The catalytic epoxidation of olefin was investigated on two copper complex-modified molybdenum oxides with a 3D supramolecular structure, [Cu(bipy)]4[Mo15O47].2H2O (1) and [Cu1(bix)][(Cu1bix) (δ-MoVl8O26)0....The catalytic epoxidation of olefin was investigated on two copper complex-modified molybdenum oxides with a 3D supramolecular structure, [Cu(bipy)]4[Mo15O47].2H2O (1) and [Cu1(bix)][(Cu1bix) (δ-MoVl8O26)0.5] (2) (bipy = 4,4'-bipyridine, bix = 1,4-bis(imidazole-1-ylmethyl)benzene). Both compounds were catalytically active and stable for the epoxidation of cyclooctene, 1-octene, and styrene with tert-butyl hydroperoxide (t-BuOOH) as oxidant. The excellent catalytic performance was attributed to the presence of stable coordination bonds between the molybdenum oxide and copper complex, which resulted in the formation of easily accessible Mo species with high electropositivity. In addition, the copper complex also acted as an active site for the activation of t-BuOOH, thus im- proving these copper complex-modified polyoxometalates.展开更多
A new supramolecular compound, { [2-(2-pyridyl)benzimidazoleH2]2+.[SBC15]2-}2, was synthesized by the hydrothermal reaction of o-diaminobenzene, 2-pyridinecarboxylie acid and SbCl3 in 1:1 HC1 solution, and charact...A new supramolecular compound, { [2-(2-pyridyl)benzimidazoleH2]2+.[SBC15]2-}2, was synthesized by the hydrothermal reaction of o-diaminobenzene, 2-pyridinecarboxylie acid and SbCl3 in 1:1 HC1 solution, and characterized by chemical analysis, elemental analysis, IR spectra, thermogravimetfic analysis and fluorescence spectra. The crystal structure was deter- mined by X-ray single-crystal diffraction. The crystal belongs to the monoclinic system, space group P211c, with a = 16.0397(13), b = 14.3189(12), c = 15.6370(13) A, β = 105.8980(10)°, V = 3454.0(5) A3, Z = 4, C24H22Cl10N6Sb2, Mr = 992.48, Dc = 1.909 g/cm3,/z = 2.366 mm-1, S = 1.010, F(000) = 1920, R = 0.0254 and wR = 0.0555. The coordination anion, [SbCl5]2- which is a distorted tetragonal pyramid, is composed by coordinating action with Sb3+ ion and five adjacent chloride ions. Every four coordination anions of [SbCl5]2- form a biquaternion ring structure through the secondary bonding of Sb...Cl. Moreover, the compound adopts a three-dimensional network supramolecular structure because of the hydrogen bonds and π-π stacking between the rings and the 2-(2-pyridyl)benzimidazole divalent cations. The title compound also shows good fluorescent behaviors.展开更多
The title complex [(C8H9NO2)·HgI2]n has been synthesized from the reaction of pyridine-3-ethylformate with mercury iodide in the mixture of DMF and absolute methanol. Its structure was determined by IR, element...The title complex [(C8H9NO2)·HgI2]n has been synthesized from the reaction of pyridine-3-ethylformate with mercury iodide in the mixture of DMF and absolute methanol. Its structure was determined by IR, elemental analysis and X-ray single-crystal diffraction analysis. The crystal is of monoclinic system, space group P21/n with a = 4.3397(5), b = 25.051(3), c = 12.3719(13)A, β = 92.2130(10)°, CsH9HgI2NO2, Mr = 605.55, V = 1344.0(3)A^3, Z = 4, Dc = 2.993 mg·m^-3, F(000) = 1064, μ = 16.024 mml, the final R = 0.0258 and wR = 0.0504. In the title complex, the center Hg(II) exhibits a four-coordinated distorted tetrahedral geometry. A three-dimensional network arrangement is presented via Hg…I weak interactions among adjacent molecules.展开更多
A supramolecular compound(H2en)2[Cu(en)2(H3O)2][Mo8O28](en=ethylenediamine) was hydrothermally prepared and confirmed by elemental analysis and TG analysis.Single-crystal X-ray analysis reveals that the crysta...A supramolecular compound(H2en)2[Cu(en)2(H3O)2][Mo8O28](en=ethylenediamine) was hydrothermally prepared and confirmed by elemental analysis and TG analysis.Single-crystal X-ray analysis reveals that the crystal crystallizes in the triclinic system,space group P1 with a=9.4635(4),b=9.8645(5),c=10.9794(5)A,α=69.2050(10),β=72.3730(10),γ=78.4510(10)o,Mr=1559.55,V=908.24(7)A^3,Z=1,Dc=2.851 g/m^3,F(000)=749,μ=3.350 mm^-1,S=1.000,the final R=0.0217 and wR=0.0567.The compound consists of(H2en)^2+,[Mo8O28]^8-anion and [Cu(en)2(H3O)2]^2+ cations and constructs a 3D supramolecular structure through hydrogen bonds between the nitrogen atoms from en of [Cu(en)2(H3O)2]^4+ fragments and the terminal oxygen atoms from the [Mo8O28]^8-polyoxoanions.The electrochemical behavior of this compound has been studied in detail based on a solid bulk modified carbon paste electrode of compound(CPE).展开更多
A novel supramolecular compound,{[2-(2-pyridyl)benzimidazoleH2]2·[BiCl6]·Cl},was synthesized by the hydrothermal reaction of o-phenylenediamine and α-pyridinecarboxylic acid with BiCl3 in 6.0 mol·L-1...A novel supramolecular compound,{[2-(2-pyridyl)benzimidazoleH2]2·[BiCl6]·Cl},was synthesized by the hydrothermal reaction of o-phenylenediamine and α-pyridinecarboxylic acid with BiCl3 in 6.0 mol·L-1 HCl solution,and characterized by elemental analysis,IR,X-ray single-crystal diffraction and photoluminescence spectroscopy.The crystal (C24H22N6Cl7Bi,Mr= 851.61) belongs to the triclinic system,space group P1 with a =7.2887(18),b =9.548(2),c= 12.469(3),α=85.306(4),β=82.814(4),γ=71.349(4)°,Z=1,V=814.9(3)3,Dc=1.735 g/cm3,μ(MoKα)=6.007 mm-1,F(000)=410,R=0.0307 and wR=0.0787.The bismuth ion and six chlorine ions construct a distorted octahedral configuration.The three-dimensional supramolecular network is built from electrostatic attractions,hydrogen bonds and π-π interaction between the BiCl6 anion,Cl anion and [2-(2-pyridyl)benzimidazoleH2] cation.The photoluminescence spectroscopy study shows that the title compound has a blue fluorescent emission at 450 nm in the solid state.展开更多
A supramolecular compound, [ Co(2,2'-bipy) ( H2O)4 ] [ trans-1,4-chdc ] ( compound 1 ) ( 2,2'-bipy = 2,2'- bipyridine, 1,4-chdcH2 = 1,4-cyclohexanedicarboxylic acid), was synthesized and characterized by si...A supramolecular compound, [ Co(2,2'-bipy) ( H2O)4 ] [ trans-1,4-chdc ] ( compound 1 ) ( 2,2'-bipy = 2,2'- bipyridine, 1,4-chdcH2 = 1,4-cyclohexanedicarboxylic acid), was synthesized and characterized by single-crystal Xray diffraction analysis, IR spectrometry, TG analysis, and elemental analyses. Single-crystal X-ray diffraction analysis revealed that [ Co( 2,2'-bipy) ( H2O)4 ]^2+ units and adjacent 1,4-chdc^2- formed a single layer by hydrogen bonding and electrostatic interactions along the ac-plane, and two symmetry-related single layers interacted with each other by hydrogen bonding, resulting in a double layer, which further formed a 3-D structure by π-π stacking. The most attractive structural feature of compound 1 is that 1,4-chdc2- possesses only tram-conformation although there are both c/s- and tram-conformations in the raw material.展开更多
A novel 3D ytterbium supramolecular compound, [Yb(HBDDC)(H20)4]·2H2O(1), was synthesized via 5,5'-(buta-diyne-1,4-diyl)diisophthalic acid ligand(HaBDDC) under solvothermal conditions. Single-crystal X-...A novel 3D ytterbium supramolecular compound, [Yb(HBDDC)(H20)4]·2H2O(1), was synthesized via 5,5'-(buta-diyne-1,4-diyl)diisophthalic acid ligand(HaBDDC) under solvothermal conditions. Single-crystal X-ray diffraction analysis reveals that compound 1 crystallizes in triclinic system, PT space group with a=0.71372(14) nm, b=1.0566(2) nm, c=1.7969(4) nm, a=101.01(3)°, β=98.15(3)°, γ=99.17(3)° and V=1.2922(4) nm3. Compound 1 exhi- bits a special infinite 1D chain, which stacks parallel each other in an ABAB sequence, leading to the formation of a 3D supramolecular structure owing to the strong π-π interactions between adjacent phenyl ring groups. Moreover, compound 1 manifests excellent luminescent property.展开更多
The supramolecular compound [(AgI3)(4-HBPFA)2(H2O)] (Mr = 1361.11) was synthesized via the reaction of 1,1?-bis[(4-pyridylamino)carbonyl]ferrocene (4-BPFA) with AgI, and structurally characterized by single-crystal X-...The supramolecular compound [(AgI3)(4-HBPFA)2(H2O)] (Mr = 1361.11) was synthesized via the reaction of 1,1?-bis[(4-pyridylamino)carbonyl]ferrocene (4-BPFA) with AgI, and structurally characterized by single-crystal X-ray diffraction analysis. Crystal data: monoclinic, space group C2/c, a = 1.6783(3), b = 10.646(2), c = 2.5419(5) ?, β = 93.66(3)o, V = 4532.2(16) ?3, Z = 4, Dc = 1.995 g/cm3, F(000) = 2632 and μ = 3.158 mm-1. The compound consists of (4- HBPFA)+, (AgI3)2- and H2O. In the structure, the adjacent (4-HBPFA)+ are linked by C–H…O and N–H…N hydrogen bonds into 1-D chains which are further linked by C–H…I and N–H…I hydrogen bonds as well as intermolecular π-π stacking interactions to form a 3-D supramolecular compound.展开更多
Two new bearing Bi(Ⅲ) supramolecular compounds [Bi(pydcH)_(3)(Bi(pydcH)(pydcH_(2))(pydc)(Bi(pydcH)(pydcH_(2))(pydc)](1) and {[Bi(pydcH)_(3)]·(H_(2)O)_(5)(Dmap)}_(2)(2) have been successfully synthesized via hydr...Two new bearing Bi(Ⅲ) supramolecular compounds [Bi(pydcH)_(3)(Bi(pydcH)(pydcH_(2))(pydc)(Bi(pydcH)(pydcH_(2))(pydc)](1) and {[Bi(pydcH)_(3)]·(H_(2)O)_(5)(Dmap)}_(2)(2) have been successfully synthesized via hydrothermal reaction(pydcH_(2) = 2,6-pyridine dicarboxylate, Dmap = 4-dimethylamiopyridine). They have been structurally determined by single-crystal X-ray analysis, and characterized by fluorescence analysis and thermogravimetric analysis(TG). Both compounds 1 and 2 are of the same triclinic system with different structures. The decomposition mechanisms of compounds 1 and 2 are discussed. Compared to 1, lots of small molecules were possibly removed from compound 2 below 250 ℃. In addition, the photoluminescence properties were also investigated.展开更多
Interaction between chiral diols BDPDD, DMBDPD and BINOL with prochiral compounds was examined and some new supramolecular complexes were prepared. It was found that these chiral hosts could include prochiral guests,...Interaction between chiral diols BDPDD, DMBDPD and BINOL with prochiral compounds was examined and some new supramolecular complexes were prepared. It was found that these chiral hosts could include prochiral guests, a, b-unsaturated compounds or piper- azinedione derivatives to give inclusion crystals in different molar ratio. Formations of these supramolecular complexes were characterized by the data of IR and 1H NMR spectra.展开更多
Functional organic molecular materials and conjugated oligomers or polymers now allow the low-cost fabrication of thin films for insertion into new generations of electronic and optoelectronic devices. The performance...Functional organic molecular materials and conjugated oligomers or polymers now allow the low-cost fabrication of thin films for insertion into new generations of electronic and optoelectronic devices. The performance of these devices relies on the understanding and optimization of several complementary processes. Our goal is to discuss the relationship between the molecular stacking structures and their optoelectronic properties that are of importance in all these areas. The concept of intermolecular interaction should be taken here in the special sense that is inter-dipole coupling. Specifically, we will address the impact of inter-dipole interaction between adjacent molecules in aggregate state on the solid-state emission properties.展开更多
A novel ionic compound [Fe(CN)6·(PhCHeNC9H7)4]·12H2O(C70H80FeN10O12, Mr = 1309.29) has been synthesized and its structure was characterized by I-R, elemental analysis and X-ray diffraction. The compoun...A novel ionic compound [Fe(CN)6·(PhCHeNC9H7)4]·12H2O(C70H80FeN10O12, Mr = 1309.29) has been synthesized and its structure was characterized by I-R, elemental analysis and X-ray diffraction. The compound crystaUizes in triclinic, space group P1, with a = 10.968(7), b = 11.466(7), c = 14.077(8)A, α= 87.014(7), β= 78.124(7), γ = 72.708(7)°, V = 1654.1(17)A3, Z = 1, Dc = 1.314 g·cm^-3, F(000) = 692, p = 0.298 mm^-1, the final R = 0.0519 and wR = 0.1355. The building unit of the title compound consists of four (PhCH2N+C9H7) ions, one [Fe(CN)6]4- anion, and a dozen water molecules. According to the structural analysis, [Fe(CN)6]4- ions are linked together by O-H…O and O-H…N hydrogen bonds, while (PhCH2N+C9HT) and [Fe(CN)6]4- ions interact with each other by electrostatic force to form an ionic compound.展开更多
The reactions of SbCl3 and HgCl2 with 2-(3-pyridyl)benzimidazole (PyBIm) in solution acidified with HCl have been investigated. The PyBIm ligands are protonated into 2-(3-pyridinio)benzimidazolium (H2PyBIm) ca...The reactions of SbCl3 and HgCl2 with 2-(3-pyridyl)benzimidazole (PyBIm) in solution acidified with HCl have been investigated. The PyBIm ligands are protonated into 2-(3-pyridinio)benzimidazolium (H2PyBIm) cations and the corresponding metal ions are bonded with chloride atoms into coordination anions, forming two new coordination compounds, namely, (H2PyBIm)(SbCl5) 1 and (H2PyBIm)2(Hg2Cl8) 2. Both compounds were characterized by X-ray crystallography. Crystal data for 1: triclinic, space group P1^- with a = 5.7030(7), b = 9.0625(11), c = 16.5929(18) A, α = 91.808(7)°, β = 93.234(6), γ = 99.216(7)°, C12H11N3SbCl5, Mr = 496.24, V = 844.44(17) A^3, Z = 2, Dc = 1.952 g/cm^3, μ(MoKα) = 2.419 mm^-1, F(000) = 480, the final R = 0.0496 and wR = 0.1382 for 3433 observed reflections (I 〉 2σ(I)). Crystal data for 2: monoclinic, space group P21/c with a = 7.8061(5), b = 15.8127(9), c = 12.2435(9) , β = 91.955(4)o, C24H22N6Hg2Cl8, Mr = 1079.26, V = 1510.40(17) 3, Z = 2, Dc = 2.373 g/cm3, μ(MoKα) = 10.889 mm-1, F(000) = 1008, the final R = 0.0293 and wR = 0.0562 for 2854 observed reflections (I 〉 2σ(I)). X-ray diffraction analysis reveals that the antimony(III) is five-coordinated, exhibiting a slightly distorted square-pyramidal coordination geometry; while in 2, a dimeric [Hg2Cl8]^4-anion consists of two trigonal bipyramids sharing two common edges. The organic cations and coordination anions are connected into a one-dimensional belt and a two-dimensional sheet through N-H···Cl hydrogen bonding interactions in compounds 1 and 2, respectively; both are further aggregated into 3D frameworks by strong π-π contacts.展开更多
A new cobalt compound,{[Co(H2btec)(2,2'-bipy)(H2O)3]·H2O}n (1,H4btec=1,2,4,5-benzenetetracarboxylic acid,2,2'-bipy=2,2'-bipyridine),has been synthesized and charac-terized by single-crystal X-ray diffr...A new cobalt compound,{[Co(H2btec)(2,2'-bipy)(H2O)3]·H2O}n (1,H4btec=1,2,4,5-benzenetetracarboxylic acid,2,2'-bipy=2,2'-bipyridine),has been synthesized and charac-terized by single-crystal X-ray diffraction,elemental analysis,IR and X-ray powder diffraction.The crystal belongs to the triclinic system,space group P1,with a=7.230(3),b=11.626(5),c=14.001(6),α=108.12(0)°,β=95.85(0)°,V=1095.33(157)3,C20H20CoN2O12,Mr=539.31,Z= 2,Dc=1.635 g/cm3,μ=0.855 mm-1,F(000)=554,R=0.0427 and wR=0.1042 for 3883 observed reflections (I 〉 2σ(I)).The title compound features a discrete molecular structure,which is connected with each other through extensive O-H…O hydrogen bonds into an intricate 3D supramolecular network.Additionally,two different patterns of π-π stacking interactions further consolidate the framework.展开更多
基金supported by the National Natural Science Foundation of China(21173100 and 21320102001)~~
文摘The catalytic epoxidation of olefin was investigated on two copper complex-modified molybdenum oxides with a 3D supramolecular structure, [Cu(bipy)]4[Mo15O47].2H2O (1) and [Cu1(bix)][(Cu1bix) (δ-MoVl8O26)0.5] (2) (bipy = 4,4'-bipyridine, bix = 1,4-bis(imidazole-1-ylmethyl)benzene). Both compounds were catalytically active and stable for the epoxidation of cyclooctene, 1-octene, and styrene with tert-butyl hydroperoxide (t-BuOOH) as oxidant. The excellent catalytic performance was attributed to the presence of stable coordination bonds between the molybdenum oxide and copper complex, which resulted in the formation of easily accessible Mo species with high electropositivity. In addition, the copper complex also acted as an active site for the activation of t-BuOOH, thus im- proving these copper complex-modified polyoxometalates.
基金Supported by the Natural Science Foundation of Henan Province (No. 0611023700)Natural Science Foundation of Education Department of Henan Province (No. 2006150019)
文摘A new supramolecular compound, { [2-(2-pyridyl)benzimidazoleH2]2+.[SBC15]2-}2, was synthesized by the hydrothermal reaction of o-diaminobenzene, 2-pyridinecarboxylie acid and SbCl3 in 1:1 HC1 solution, and characterized by chemical analysis, elemental analysis, IR spectra, thermogravimetfic analysis and fluorescence spectra. The crystal structure was deter- mined by X-ray single-crystal diffraction. The crystal belongs to the monoclinic system, space group P211c, with a = 16.0397(13), b = 14.3189(12), c = 15.6370(13) A, β = 105.8980(10)°, V = 3454.0(5) A3, Z = 4, C24H22Cl10N6Sb2, Mr = 992.48, Dc = 1.909 g/cm3,/z = 2.366 mm-1, S = 1.010, F(000) = 1920, R = 0.0254 and wR = 0.0555. The coordination anion, [SbCl5]2- which is a distorted tetragonal pyramid, is composed by coordinating action with Sb3+ ion and five adjacent chloride ions. Every four coordination anions of [SbCl5]2- form a biquaternion ring structure through the secondary bonding of Sb...Cl. Moreover, the compound adopts a three-dimensional network supramolecular structure because of the hydrogen bonds and π-π stacking between the rings and the 2-(2-pyridyl)benzimidazole divalent cations. The title compound also shows good fluorescent behaviors.
文摘The title complex [(C8H9NO2)·HgI2]n has been synthesized from the reaction of pyridine-3-ethylformate with mercury iodide in the mixture of DMF and absolute methanol. Its structure was determined by IR, elemental analysis and X-ray single-crystal diffraction analysis. The crystal is of monoclinic system, space group P21/n with a = 4.3397(5), b = 25.051(3), c = 12.3719(13)A, β = 92.2130(10)°, CsH9HgI2NO2, Mr = 605.55, V = 1344.0(3)A^3, Z = 4, Dc = 2.993 mg·m^-3, F(000) = 1064, μ = 16.024 mml, the final R = 0.0258 and wR = 0.0504. In the title complex, the center Hg(II) exhibits a four-coordinated distorted tetrahedral geometry. A three-dimensional network arrangement is presented via Hg…I weak interactions among adjacent molecules.
基金Supported by the National Natural Science Foundation of China (No 20371014 and 20671026)the Study Technological Innovation Projects Special Foundation of Harbin (2009RFXXG202)
文摘A supramolecular compound(H2en)2[Cu(en)2(H3O)2][Mo8O28](en=ethylenediamine) was hydrothermally prepared and confirmed by elemental analysis and TG analysis.Single-crystal X-ray analysis reveals that the crystal crystallizes in the triclinic system,space group P1 with a=9.4635(4),b=9.8645(5),c=10.9794(5)A,α=69.2050(10),β=72.3730(10),γ=78.4510(10)o,Mr=1559.55,V=908.24(7)A^3,Z=1,Dc=2.851 g/m^3,F(000)=749,μ=3.350 mm^-1,S=1.000,the final R=0.0217 and wR=0.0567.The compound consists of(H2en)^2+,[Mo8O28]^8-anion and [Cu(en)2(H3O)2]^2+ cations and constructs a 3D supramolecular structure through hydrogen bonds between the nitrogen atoms from en of [Cu(en)2(H3O)2]^4+ fragments and the terminal oxygen atoms from the [Mo8O28]^8-polyoxoanions.The electrochemical behavior of this compound has been studied in detail based on a solid bulk modified carbon paste electrode of compound(CPE).
基金Supported by the Natural Science Foundation of Henan Province (No. 0611023700)
文摘A novel supramolecular compound,{[2-(2-pyridyl)benzimidazoleH2]2·[BiCl6]·Cl},was synthesized by the hydrothermal reaction of o-phenylenediamine and α-pyridinecarboxylic acid with BiCl3 in 6.0 mol·L-1 HCl solution,and characterized by elemental analysis,IR,X-ray single-crystal diffraction and photoluminescence spectroscopy.The crystal (C24H22N6Cl7Bi,Mr= 851.61) belongs to the triclinic system,space group P1 with a =7.2887(18),b =9.548(2),c= 12.469(3),α=85.306(4),β=82.814(4),γ=71.349(4)°,Z=1,V=814.9(3)3,Dc=1.735 g/cm3,μ(MoKα)=6.007 mm-1,F(000)=410,R=0.0307 and wR=0.0787.The bismuth ion and six chlorine ions construct a distorted octahedral configuration.The three-dimensional supramolecular network is built from electrostatic attractions,hydrogen bonds and π-π interaction between the BiCl6 anion,Cl anion and [2-(2-pyridyl)benzimidazoleH2] cation.The photoluminescence spectroscopy study shows that the title compound has a blue fluorescent emission at 450 nm in the solid state.
基金Supported by the National Natural Science Foundation of China (No. 20571014) and the Scientific Research Foundation forReturned Overseas Chinese Scholars, the Ministry of Education of China
文摘A supramolecular compound, [ Co(2,2'-bipy) ( H2O)4 ] [ trans-1,4-chdc ] ( compound 1 ) ( 2,2'-bipy = 2,2'- bipyridine, 1,4-chdcH2 = 1,4-cyclohexanedicarboxylic acid), was synthesized and characterized by single-crystal Xray diffraction analysis, IR spectrometry, TG analysis, and elemental analyses. Single-crystal X-ray diffraction analysis revealed that [ Co( 2,2'-bipy) ( H2O)4 ]^2+ units and adjacent 1,4-chdc^2- formed a single layer by hydrogen bonding and electrostatic interactions along the ac-plane, and two symmetry-related single layers interacted with each other by hydrogen bonding, resulting in a double layer, which further formed a 3-D structure by π-π stacking. The most attractive structural feature of compound 1 is that 1,4-chdc2- possesses only tram-conformation although there are both c/s- and tram-conformations in the raw material.
基金Supported by the National Natural Science Foundation of China(No.20701015).
文摘A novel 3D ytterbium supramolecular compound, [Yb(HBDDC)(H20)4]·2H2O(1), was synthesized via 5,5'-(buta-diyne-1,4-diyl)diisophthalic acid ligand(HaBDDC) under solvothermal conditions. Single-crystal X-ray diffraction analysis reveals that compound 1 crystallizes in triclinic system, PT space group with a=0.71372(14) nm, b=1.0566(2) nm, c=1.7969(4) nm, a=101.01(3)°, β=98.15(3)°, γ=99.17(3)° and V=1.2922(4) nm3. Compound 1 exhi- bits a special infinite 1D chain, which stacks parallel each other in an ABAB sequence, leading to the formation of a 3D supramolecular structure owing to the strong π-π interactions between adjacent phenyl ring groups. Moreover, compound 1 manifests excellent luminescent property.
基金This work was supported by the Outstanding Young Foundation of Henan Province
文摘The supramolecular compound [(AgI3)(4-HBPFA)2(H2O)] (Mr = 1361.11) was synthesized via the reaction of 1,1?-bis[(4-pyridylamino)carbonyl]ferrocene (4-BPFA) with AgI, and structurally characterized by single-crystal X-ray diffraction analysis. Crystal data: monoclinic, space group C2/c, a = 1.6783(3), b = 10.646(2), c = 2.5419(5) ?, β = 93.66(3)o, V = 4532.2(16) ?3, Z = 4, Dc = 1.995 g/cm3, F(000) = 2632 and μ = 3.158 mm-1. The compound consists of (4- HBPFA)+, (AgI3)2- and H2O. In the structure, the adjacent (4-HBPFA)+ are linked by C–H…O and N–H…N hydrogen bonds into 1-D chains which are further linked by C–H…I and N–H…I hydrogen bonds as well as intermolecular π-π stacking interactions to form a 3-D supramolecular compound.
基金supported by the Natural Science Foundation of Hunan Province(2020JJ6041)the Foundation of Key Laboratory of Functional Organometallic Compounds of Hunan Province(MO20K04)the Center for Functionalization of Metal-Organic Frameworks Materials Studies(KYJG1082)。
文摘Two new bearing Bi(Ⅲ) supramolecular compounds [Bi(pydcH)_(3)(Bi(pydcH)(pydcH_(2))(pydc)(Bi(pydcH)(pydcH_(2))(pydc)](1) and {[Bi(pydcH)_(3)]·(H_(2)O)_(5)(Dmap)}_(2)(2) have been successfully synthesized via hydrothermal reaction(pydcH_(2) = 2,6-pyridine dicarboxylate, Dmap = 4-dimethylamiopyridine). They have been structurally determined by single-crystal X-ray analysis, and characterized by fluorescence analysis and thermogravimetric analysis(TG). Both compounds 1 and 2 are of the same triclinic system with different structures. The decomposition mechanisms of compounds 1 and 2 are discussed. Compared to 1, lots of small molecules were possibly removed from compound 2 below 250 ℃. In addition, the photoluminescence properties were also investigated.
基金This work was supported by the National Natural Science Foundation of China (Project 29972033) and the Key Science Research Foundation of Hubei Province of China (Project 98IP1305).
文摘Interaction between chiral diols BDPDD, DMBDPD and BINOL with prochiral compounds was examined and some new supramolecular complexes were prepared. It was found that these chiral hosts could include prochiral guests, a, b-unsaturated compounds or piper- azinedione derivatives to give inclusion crystals in different molar ratio. Formations of these supramolecular complexes were characterized by the data of IR and 1H NMR spectra.
文摘Functional organic molecular materials and conjugated oligomers or polymers now allow the low-cost fabrication of thin films for insertion into new generations of electronic and optoelectronic devices. The performance of these devices relies on the understanding and optimization of several complementary processes. Our goal is to discuss the relationship between the molecular stacking structures and their optoelectronic properties that are of importance in all these areas. The concept of intermolecular interaction should be taken here in the special sense that is inter-dipole coupling. Specifically, we will address the impact of inter-dipole interaction between adjacent molecules in aggregate state on the solid-state emission properties.
基金supported by the Natural Science Foundation of Education Committee of Henan Province (2006150016)
文摘A novel ionic compound [Fe(CN)6·(PhCHeNC9H7)4]·12H2O(C70H80FeN10O12, Mr = 1309.29) has been synthesized and its structure was characterized by I-R, elemental analysis and X-ray diffraction. The compound crystaUizes in triclinic, space group P1, with a = 10.968(7), b = 11.466(7), c = 14.077(8)A, α= 87.014(7), β= 78.124(7), γ = 72.708(7)°, V = 1654.1(17)A3, Z = 1, Dc = 1.314 g·cm^-3, F(000) = 692, p = 0.298 mm^-1, the final R = 0.0519 and wR = 0.1355. The building unit of the title compound consists of four (PhCH2N+C9H7) ions, one [Fe(CN)6]4- anion, and a dozen water molecules. According to the structural analysis, [Fe(CN)6]4- ions are linked together by O-H…O and O-H…N hydrogen bonds, while (PhCH2N+C9HT) and [Fe(CN)6]4- ions interact with each other by electrostatic force to form an ionic compound.
基金supported by the Natural Science Foundation of Fujian Province (2007HZ0001-1, 2009HZ0004-1, 2009HZ0006-1 and 2006L2005)
文摘The reactions of SbCl3 and HgCl2 with 2-(3-pyridyl)benzimidazole (PyBIm) in solution acidified with HCl have been investigated. The PyBIm ligands are protonated into 2-(3-pyridinio)benzimidazolium (H2PyBIm) cations and the corresponding metal ions are bonded with chloride atoms into coordination anions, forming two new coordination compounds, namely, (H2PyBIm)(SbCl5) 1 and (H2PyBIm)2(Hg2Cl8) 2. Both compounds were characterized by X-ray crystallography. Crystal data for 1: triclinic, space group P1^- with a = 5.7030(7), b = 9.0625(11), c = 16.5929(18) A, α = 91.808(7)°, β = 93.234(6), γ = 99.216(7)°, C12H11N3SbCl5, Mr = 496.24, V = 844.44(17) A^3, Z = 2, Dc = 1.952 g/cm^3, μ(MoKα) = 2.419 mm^-1, F(000) = 480, the final R = 0.0496 and wR = 0.1382 for 3433 observed reflections (I 〉 2σ(I)). Crystal data for 2: monoclinic, space group P21/c with a = 7.8061(5), b = 15.8127(9), c = 12.2435(9) , β = 91.955(4)o, C24H22N6Hg2Cl8, Mr = 1079.26, V = 1510.40(17) 3, Z = 2, Dc = 2.373 g/cm3, μ(MoKα) = 10.889 mm-1, F(000) = 1008, the final R = 0.0293 and wR = 0.0562 for 2854 observed reflections (I 〉 2σ(I)). X-ray diffraction analysis reveals that the antimony(III) is five-coordinated, exhibiting a slightly distorted square-pyramidal coordination geometry; while in 2, a dimeric [Hg2Cl8]^4-anion consists of two trigonal bipyramids sharing two common edges. The organic cations and coordination anions are connected into a one-dimensional belt and a two-dimensional sheet through N-H···Cl hydrogen bonding interactions in compounds 1 and 2, respectively; both are further aggregated into 3D frameworks by strong π-π contacts.
基金supported by 973 Program (2007CB815302,2009CB939803)Chinese Academy of Sciences (KJCX2.YW.319,KJCX2.YW.M10,KJCX2-YW-M05)the Knowledge Innovation Program of Chinese Academy of Science,and Fujian Key Laboratory of Nanomaterials (2006L2005)
文摘A new cobalt compound,{[Co(H2btec)(2,2'-bipy)(H2O)3]·H2O}n (1,H4btec=1,2,4,5-benzenetetracarboxylic acid,2,2'-bipy=2,2'-bipyridine),has been synthesized and charac-terized by single-crystal X-ray diffraction,elemental analysis,IR and X-ray powder diffraction.The crystal belongs to the triclinic system,space group P1,with a=7.230(3),b=11.626(5),c=14.001(6),α=108.12(0)°,β=95.85(0)°,V=1095.33(157)3,C20H20CoN2O12,Mr=539.31,Z= 2,Dc=1.635 g/cm3,μ=0.855 mm-1,F(000)=554,R=0.0427 and wR=0.1042 for 3883 observed reflections (I 〉 2σ(I)).The title compound features a discrete molecular structure,which is connected with each other through extensive O-H…O hydrogen bonds into an intricate 3D supramolecular network.Additionally,two different patterns of π-π stacking interactions further consolidate the framework.