Two 1D chain metal-organic framework complexes, {Co[（C10H5N3O5）- （H2O）2？H2O]}n （1） and {Cd[（C10H5N3O5）（H2O）2]}n （2）, based on a T-shaped tripodal ligand 4-（4,5-dicarboxy- 1H-imidazol-2-yl） pyridine 1-ox...Two 1D chain metal-organic framework complexes, {Co[（C10H5N3O5）- （H2O）2？H2O]}n （1） and {Cd[（C10H5N3O5）（H2O）2]}n （2）, based on a T-shaped tripodal ligand 4-（4,5-dicarboxy- 1H-imidazol-2-yl） pyridine 1-oxide （H3DCImPyO） have been reacted under hydrothermal conditions, and were characterized by single-crystal X-ray structure analysis, fluorescent analysis and thermal gravimetric analysis. According to single-crystal X-ray determination, complex 1 crystallizes in the monoclinic system, space group P21/n with a = 9.4930（13）, b = 13.2024（18）, c = 10.5203（14） A^°, β = 98.402（2）°, Z = 4, V = 1304.4（3）A^°3; and complex 2 crystallizes in the monoclinic system, space group C2/c with a = 13.557（3）, b = 13.568（3）, c = 6.7804（13） A^°, β = 105.095（2）°, Z = 4 and V = 1204.2（4） A^°3. Fluorescent analysis of complex 2 showed an intense emission band at 466 nm when the exciting radiation was set at 360 nm. Dielectric constants of complexes 1 and 2 were measured at different frequencies with temperature variation.展开更多
Under hydrothermal conditions,isonicotinic acid reacted with BiCl 3 to give 1D zigzag chain complex [（C 6 H 6 NO 2） 2 ·（BiCl 5）·2H 2 O] n （1）.Single-crystal X-ray determination shows that compound 1 cr...Under hydrothermal conditions,isonicotinic acid reacted with BiCl 3 to give 1D zigzag chain complex [（C 6 H 6 NO 2） 2 ·（BiCl 5）·2H 2 O] n （1）.Single-crystal X-ray determination shows that compound 1 crystal-lizes in the monoclinic system,space group C2/c with a=13.115（3）,b=19.957（4）,c=7.9374（16）,β=97.45（3）°,Z=4,V=2060.0（8） 3,C 12 H 16 BiCl 5 N 2 O 6,D c=2.162 g/cm 3,M r=670.50,λ（MoKa）=0.71073,μ=9.237 mm-1,F（000）=1272,R=0.0208 and wR=0.0503.Dielectric constant of compound 1 was measured at different conditions.Measurements on the dielectric properties of 1 showed that the 1D chain coordination polymer exhibited a dipolar chain relaxation process and a relatively high dielectric constant.展开更多
A new coordination compound [Ba（OBPT）2（H2O）2]·H2O was obtained at room temperature by the reaction of 4,6-bis（2-pyridyl）-1,3,5-triazin-2-ol（HOBPT） with BaCl2.It was characterized by elemental analysis,FTI...A new coordination compound [Ba（OBPT）2（H2O）2]·H2O was obtained at room temperature by the reaction of 4,6-bis（2-pyridyl）-1,3,5-triazin-2-ol（HOBPT） with BaCl2.It was characterized by elemental analysis,FTIR,TG analysis,powder X-ray diffraction analysis and single-crystal X-ray diffraction analysis.The complex crystallizes in the monoclinic P21/n space group,with a = 16.325（1）,b = 6.7977（5）,c = 24.164（2） ,β = 104.009（1）,V = 2601.8（3） 3,Z =4,C26H22BaN10O5,Mr = 691.88,Dc = 1.766 g/cm3,F（000） = 1376 and μ（MoKα） = 1.587 mm-1.The final R = 0.0282 and wR = 0.0724 for 5095 observed reflections with I 〉 2σ（I） and R = 0.0312 and wR = 0.0744 for all data.In the complex,the barium ion is ten-coordinated with six nitrogen atoms from two ligands,two deprotonated hydroxyl oxygen atoms from another two ligands and two coordinated water molecules to form a double stranded chain.The extensive supramolecular interac-tions lead to the formation of an infinite 2D framework.展开更多
Hydrothermal reaction of 1,10-phenanthroline with CdCl2·2.5H2O in aqueous solution leads to the complex of [Cd(μ-Cl)2(phen)]n (phen = 1-10-phenanthroline). The crystal structure has been determined by X-ray anal...Hydrothermal reaction of 1,10-phenanthroline with CdCl2·2.5H2O in aqueous solution leads to the complex of [Cd(μ-Cl)2(phen)]n (phen = 1-10-phenanthroline). The crystal structure has been determined by X-ray analysis. It crystallizes in monoclinic with space group C2/c, a = 16.947(3), b = 10.529(2), c = 7.235(1) , β = 110.795(3)°, V = 1208.8(3) 3, Z = 4, Dc = 1.997 g.cm-3, μ= 2.22 mm-1, F(000) = 704, R = 0.0231, Rw = 0.0626 for 1194 reflections with I > 2σ (I). In the crystal structure, the [Cd(phen)]2+ units are bridged by chloride ions to form 1D chain. The 1D chains combine through π……π interactions of phen groups to form 2D infinite molecular zipper.展开更多
1 Introduction The design and construction of metal-organic polymers has been a field of rapid growth in materials chemistry because of their intriguing topologies and potential applications as functional materials. ...1 Introduction The design and construction of metal-organic polymers has been a field of rapid growth in materials chemistry because of their intriguing topologies and potential applications as functional materials. In this regard, every effort has been devoted to the deliberate design and control of self-assembly infinite coordination networks via selecting the chemistry structures of ligands, Multidentate carboxylate ligands are widely adopted for construction of coordination frameworks due to their rich coordination modes.展开更多
The title compound,poly[N-[1-（3-pydidyl）ethylidene]-4H-1,2,4-triazol-4-amine sil-ver（I） tetrafluoroborate],[Ag（C9H9N5）（BF4）]n,is the result of complexing Ag cation with N-[1-（3-pydidyl）ethylidene]-4H-1,2,4-t...The title compound,poly[N-[1-（3-pydidyl）ethylidene]-4H-1,2,4-triazol-4-amine sil-ver（I） tetrafluoroborate],[Ag（C9H9N5）（BF4）]n,is the result of complexing Ag cation with N-[1-（3-pydidyl）ethylidene]-4H-1,2,4-triazol-4-amine （L）,and its crystal structure was determined by single-crystal X-ray diffraction.The crystal belongs to the monoclinic system,space group C2/c with a= 18.899（6）,b=9.882（2）,c=15.472（4）,β=120.158（3）°,V=2498.5（11）3,C9H9AgBF4N5,Mr= 381.89,Dc=2.031 g/cm3,μ（MoKα）=1.659 mm-1,F（000）=1488,Z=8,the final R=0.0441 and wR=0.0619 for 1094 observed reflections （I 〉 2σ（I））.In the structure,ligand L bridges the two metal Ag（I） centers in a bidentate fashion and each metal ion coordinates with two nitrogen atoms,forming a one-dimensional rectangular chain.The neighboring chains are connected by two additional Ag-N weak interactions into a 3D framework structure.The title compound shows blue fluorescence property at room temperature.展开更多
We analyze the spectral distribution of localisation in a 1D diagonally disordered chain of fragments each of which consist of m coupled two-level systems. The calculations performed by means of developed perturbation...We analyze the spectral distribution of localisation in a 1D diagonally disordered chain of fragments each of which consist of m coupled two-level systems. The calculations performed by means of developed perturbation theory for joint statistics of advanced and retarded Green’s functions. We show that this distribution is rather inhomogeneous and reveals spectral regions of weakly localized states with sharp peaks of the localization degree in the centers of these regions.展开更多
The organically templated titanium phosphate [Ti 3P 6O 27 H 5] · [C 2H 9N 2] 5·2 [H 3O] has been synthesized by solvothermal method and its structure was determined by single crystal X ray diffraction. The c...The organically templated titanium phosphate [Ti 3P 6O 27 H 5] · [C 2H 9N 2] 5·2 [H 3O] has been synthesized by solvothermal method and its structure was determined by single crystal X ray diffraction. The crystal crystallizes in a orthorhombic system of the enantiomorphic space group P 2 12 12 1 , with a = 1.018 0(6) nm , b =1.589 9(9) nm, c =2.322 7(12) nm, V =3.759 4(4) nm 3, Z =4, D c= 1.96 g/cm 3 , F (000)= 2 296 , R =0.048 6, ωR 2=0.125 7. The title compound contains chiral spirals formed from macroanionic chains of titanium oxygen octahedra bonded together by phosphate tetrahedral. These spirals are interconnected through hydrogen bonding in a manner to form unusual tunnels along the [001] direction in which H 2N(CH 2) 2NH 3 + cations are included. Second harmonics are generated in powdered sample. [WT5HZ]展开更多
The title compound, Co（L）2（CH3OH）2Cl2 （L = 3-（1,2,4-triazole-yl）-6-chloro-pyridazine） 1, has been synthesized and its crystal structure has been determined by X-ray analysis. Complex 1 crystallizes in the tric...The title compound, Co（L）2（CH3OH）2Cl2 （L = 3-（1,2,4-triazole-yl）-6-chloro-pyridazine） 1, has been synthesized and its crystal structure has been determined by X-ray analysis. Complex 1 crystallizes in the triclinic system, space group P1 with a = 6.018（3）, b = 9.832（5）, c = 9.921（5）A, a = 78.270（8）, β = 74.550（8）, γ = 83.807（8）°, V = 553.1（5）A^3, Z = 1, C14H16Cl4CoN10O2, Mr = 557.10, Dc = 1.673 g/cm^3, F（000） = 281,μ（MoKα） = 1.293 mm^-1, the final R = 0.0453 and wR = 0.1181 for 1539 observed reflections with I 〉 2σ（I）. The Co（II） ion is in a distorted centrosymmetric six-coordinate octahedral environment with two Ntriazole, two Omethanol and two Cl atoms. Via hydrogen bonds the configuration of 1 has been extended into 1D chains which are developed to 2D layers via π-π sticking action, and these layers are further extended into a 3D network by hydrogen bonds. The antibacterial activity of the title compound has been detected, and the results show that the ligands and cobalt（II） complex exhibit certain fungicidal activity against several bacteria. Furthermore, the spectral properties of the title compound have been also studied and discussed.展开更多
基金Supported by the National Natural Science Foundation of China(No.21201087 and 51502117)NSF of JiangSu Province(BK20131244 and BK20130460)+1 种基金the Foundation of Jiangsu Educational Committee(11KJB150004)the Qinglan Project of Jiangsu Province and Jiangsu Overseas Research&Training Program for University Prominent Young&Middle-aged Teacher and Presidents
文摘Two 1D chain metal-organic framework complexes, {Co[（C10H5N3O5）- （H2O）2？H2O]}n （1） and {Cd[（C10H5N3O5）（H2O）2]}n （2）, based on a T-shaped tripodal ligand 4-（4,5-dicarboxy- 1H-imidazol-2-yl） pyridine 1-oxide （H3DCImPyO） have been reacted under hydrothermal conditions, and were characterized by single-crystal X-ray structure analysis, fluorescent analysis and thermal gravimetric analysis. According to single-crystal X-ray determination, complex 1 crystallizes in the monoclinic system, space group P21/n with a = 9.4930（13）, b = 13.2024（18）, c = 10.5203（14） A^°, β = 98.402（2）°, Z = 4, V = 1304.4（3）A^°3; and complex 2 crystallizes in the monoclinic system, space group C2/c with a = 13.557（3）, b = 13.568（3）, c = 6.7804（13） A^°, β = 105.095（2）°, Z = 4 and V = 1204.2（4） A^°3. Fluorescent analysis of complex 2 showed an intense emission band at 466 nm when the exciting radiation was set at 360 nm. Dielectric constants of complexes 1 and 2 were measured at different frequencies with temperature variation.
基金supported by the Natural Science Foundation of Jiangsu Province (BK2008029)
文摘Under hydrothermal conditions,isonicotinic acid reacted with BiCl 3 to give 1D zigzag chain complex [（C 6 H 6 NO 2） 2 ·（BiCl 5）·2H 2 O] n （1）.Single-crystal X-ray determination shows that compound 1 crystal-lizes in the monoclinic system,space group C2/c with a=13.115（3）,b=19.957（4）,c=7.9374（16）,β=97.45（3）°,Z=4,V=2060.0（8） 3,C 12 H 16 BiCl 5 N 2 O 6,D c=2.162 g/cm 3,M r=670.50,λ（MoKa）=0.71073,μ=9.237 mm-1,F（000）=1272,R=0.0208 and wR=0.0503.Dielectric constant of compound 1 was measured at different conditions.Measurements on the dielectric properties of 1 showed that the 1D chain coordination polymer exhibited a dipolar chain relaxation process and a relatively high dielectric constant.
基金Supported by the National Natural Science Foundation of China (21001031)Special funds of discipline construction and teaching quality and teaching reform project of higher education institutions of the education department of Guangdong province
文摘A new coordination compound [Ba（OBPT）2（H2O）2]·H2O was obtained at room temperature by the reaction of 4,6-bis（2-pyridyl）-1,3,5-triazin-2-ol（HOBPT） with BaCl2.It was characterized by elemental analysis,FTIR,TG analysis,powder X-ray diffraction analysis and single-crystal X-ray diffraction analysis.The complex crystallizes in the monoclinic P21/n space group,with a = 16.325（1）,b = 6.7977（5）,c = 24.164（2） ,β = 104.009（1）,V = 2601.8（3） 3,Z =4,C26H22BaN10O5,Mr = 691.88,Dc = 1.766 g/cm3,F（000） = 1376 and μ（MoKα） = 1.587 mm-1.The final R = 0.0282 and wR = 0.0724 for 5095 observed reflections with I 〉 2σ（I） and R = 0.0312 and wR = 0.0744 for all data.In the complex,the barium ion is ten-coordinated with six nitrogen atoms from two ligands,two deprotonated hydroxyl oxygen atoms from another two ligands and two coordinated water molecules to form a double stranded chain.The extensive supramolecular interac-tions lead to the formation of an infinite 2D framework.
文摘Hydrothermal reaction of 1,10-phenanthroline with CdCl2·2.5H2O in aqueous solution leads to the complex of [Cd(μ-Cl)2(phen)]n (phen = 1-10-phenanthroline). The crystal structure has been determined by X-ray analysis. It crystallizes in monoclinic with space group C2/c, a = 16.947(3), b = 10.529(2), c = 7.235(1) , β = 110.795(3)°, V = 1208.8(3) 3, Z = 4, Dc = 1.997 g.cm-3, μ= 2.22 mm-1, F(000) = 704, R = 0.0231, Rw = 0.0626 for 1194 reflections with I > 2σ (I). In the crystal structure, the [Cd(phen)]2+ units are bridged by chloride ions to form 1D chain. The 1D chains combine through π……π interactions of phen groups to form 2D infinite molecular zipper.
基金Supported by the National Natural Science Foundation of China(Nos. 20601007, 50472020 and 20773034)the Natural Science Foundation of Hebei Education Department, China(No.ZH2006002)+1 种基金the Natural Science Foundation of Hebei Province, China(No.B2008000143)the Doctoral Foundation of Hebei Normal University, China(No.103261).
文摘1 Introduction The design and construction of metal-organic polymers has been a field of rapid growth in materials chemistry because of their intriguing topologies and potential applications as functional materials. In this regard, every effort has been devoted to the deliberate design and control of self-assembly infinite coordination networks via selecting the chemistry structures of ligands, Multidentate carboxylate ligands are widely adopted for construction of coordination frameworks due to their rich coordination modes.
基金supported by the Innovation Program for College Students of Central South University (No. 081053308)Central South University Science Development Foundation (No. 09SDF06)
文摘The title compound,poly[N-[1-（3-pydidyl）ethylidene]-4H-1,2,4-triazol-4-amine sil-ver（I） tetrafluoroborate],[Ag（C9H9N5）（BF4）]n,is the result of complexing Ag cation with N-[1-（3-pydidyl）ethylidene]-4H-1,2,4-triazol-4-amine （L）,and its crystal structure was determined by single-crystal X-ray diffraction.The crystal belongs to the monoclinic system,space group C2/c with a= 18.899（6）,b=9.882（2）,c=15.472（4）,β=120.158（3）°,V=2498.5（11）3,C9H9AgBF4N5,Mr= 381.89,Dc=2.031 g/cm3,μ（MoKα）=1.659 mm-1,F（000）=1488,Z=8,the final R=0.0441 and wR=0.0619 for 1094 observed reflections （I 〉 2σ（I））.In the structure,ligand L bridges the two metal Ag（I） centers in a bidentate fashion and each metal ion coordinates with two nitrogen atoms,forming a one-dimensional rectangular chain.The neighboring chains are connected by two additional Ag-N weak interactions into a 3D framework structure.The title compound shows blue fluorescence property at room temperature.
文摘We analyze the spectral distribution of localisation in a 1D diagonally disordered chain of fragments each of which consist of m coupled two-level systems. The calculations performed by means of developed perturbation theory for joint statistics of advanced and retarded Green’s functions. We show that this distribution is rather inhomogeneous and reveals spectral regions of weakly localized states with sharp peaks of the localization degree in the centers of these regions.
文摘The organically templated titanium phosphate [Ti 3P 6O 27 H 5] · [C 2H 9N 2] 5·2 [H 3O] has been synthesized by solvothermal method and its structure was determined by single crystal X ray diffraction. The crystal crystallizes in a orthorhombic system of the enantiomorphic space group P 2 12 12 1 , with a = 1.018 0(6) nm , b =1.589 9(9) nm, c =2.322 7(12) nm, V =3.759 4(4) nm 3, Z =4, D c= 1.96 g/cm 3 , F (000)= 2 296 , R =0.048 6, ωR 2=0.125 7. The title compound contains chiral spirals formed from macroanionic chains of titanium oxygen octahedra bonded together by phosphate tetrahedral. These spirals are interconnected through hydrogen bonding in a manner to form unusual tunnels along the [001] direction in which H 2N(CH 2) 2NH 3 + cations are included. Second harmonics are generated in powdered sample. [WT5HZ]
文摘The title compound, Co（L）2（CH3OH）2Cl2 （L = 3-（1,2,4-triazole-yl）-6-chloro-pyridazine） 1, has been synthesized and its crystal structure has been determined by X-ray analysis. Complex 1 crystallizes in the triclinic system, space group P1 with a = 6.018（3）, b = 9.832（5）, c = 9.921（5）A, a = 78.270（8）, β = 74.550（8）, γ = 83.807（8）°, V = 553.1（5）A^3, Z = 1, C14H16Cl4CoN10O2, Mr = 557.10, Dc = 1.673 g/cm^3, F（000） = 281,μ（MoKα） = 1.293 mm^-1, the final R = 0.0453 and wR = 0.1181 for 1539 observed reflections with I 〉 2σ（I）. The Co（II） ion is in a distorted centrosymmetric six-coordinate octahedral environment with two Ntriazole, two Omethanol and two Cl atoms. Via hydrogen bonds the configuration of 1 has been extended into 1D chains which are developed to 2D layers via π-π sticking action, and these layers are further extended into a 3D network by hydrogen bonds. The antibacterial activity of the title compound has been detected, and the results show that the ligands and cobalt（II） complex exhibit certain fungicidal activity against several bacteria. Furthermore, the spectral properties of the title compound have been also studied and discussed.
