The iR and Raman spectra were rrieasured for[Fe_2Cr(μ_3-O)-(glycine)_6 (H_2O)_3] (NO_3)_7. 3H2O in the range of 2000～90 cm￣-1. The assignment of the main skeleton vibrations was made in comparison with related comp...The iR and Raman spectra were rrieasured for[Fe_2Cr(μ_3-O)-(glycine)_6 (H_2O)_3] (NO_3)_7. 3H2O in the range of 2000～90 cm￣-1. The assignment of the main skeleton vibrations was made in comparison with related compounds. A simplified model as well as a simplified general valence force field was used in the normal coordinate analysis of the skeleton and a set of force constants has been obtained. The calculated frequencies agree well with the observed ones, with a mean deviation of 1.8% which confirms the assignn: ient of their vibrational spectra. On the basis of the data obtained some discussions were made.展开更多
A new coordination polymer of Cd(Ⅱ) was prepared by the reaction of Cd(ClO4)2·6H2O with mixed ligands, namely, neutral double betaine derivative 1,3-bis(pyridinio-4-carboxylato)propane and SCN- anion in aqueous ...A new coordination polymer of Cd(Ⅱ) was prepared by the reaction of Cd(ClO4)2·6H2O with mixed ligands, namely, neutral double betaine derivative 1,3-bis(pyridinio-4-carboxylato)propane and SCN- anion in aqueous solution. The crystal structure of 1 has been determined by single-crystal X-ray diffraction methods. Crystal data for 1: orthorhombic, space group P212121, a=1.050 9(2), b=1.162 8(2), c=1.649 5(3) nm, V=2.015 7(7) nm3, Z=4, F(000)=1 064, Dc=1.756 g·cm-3, the final R=0.050 8 and wR=0.130 1 for 3 530 observed reflections [I>2σ(I)]. Crystal structure of 1 indicates that the ( μ-1,3-NCS) bridging NCS- ligand connects neighboring cadmium atoms, leading to a single strand helical chain which propagates along crystallographic a axis. The metallic nodes of adjacent helical chains are linked by monodentate-monodentate coordination mode of both carboxylate groups in L molecules to generate 2D coordination sheet which parallels to the (001) plane. Adjacent layers are further joined by C-H…O hydrogen bonds; the structure thus expanded into a three-dimensional network. CCDC: 612657.展开更多
The reaction behaviors of the title complexes have been studied in thesystem of dinitrogen gas by means of in situ IR. It has been found that some activefragments created at some stage of the thermal decomposition pro...The reaction behaviors of the title complexes have been studied in thesystem of dinitrogen gas by means of in situ IR. It has been found that some activefragments created at some stage of the thermal decomposition process of the complexes.enable.the acetic acid both obtained from the ligand of the complexes and introducedfrom outside to convert to acetone by decarboxylation. Their optimum reaction temperatures are of 240~270℃ for [Fe2MnO(O2CCH3),(H2O)3], 290~320 C for [Fe3Q(O2CCH3)6(H2O)3], 300~330℃ for [Fe2CoO(O2CCH3),(H2O)3] and 320~ 350℃for [Fe2NiO(O2CCH3)6(H2O)3], indicating the lowering sequence of the activity of active species. At the same time it has been shown that this activity may come from thejoined contributions of both the coordinating capability of the hetero-metals in the complexes and their structural factors. On the basis of the TGA, DTA and EI-MS data,the composition of the active fragments has been tentatively inferred as [Fe2MnO(O2CCH3)3-2].展开更多
The compound [Fe2V(μ3-O) (μ-O2CCH3), (THF)3]Cl. 3H2O (THF=tetrahydrofuran) crystallizes in monoclinic system, space group C2, with cell di-mensions a= l2. 847(2), b= l5. 875 (6), c= lO. 211 (3) A, β= 109- 34 (3)...The compound [Fe2V(μ3-O) (μ-O2CCH3), (THF)3]Cl. 3H2O (THF=tetrahydrofuran) crystallizes in monoclinic system, space group C2, with cell di-mensions a= l2. 847(2), b= l5. 875 (6), c= lO. 211 (3) A, β= 109- 34 (3)', V=1965. 1(4) A3, Z= 2, D,c= 1. 73 g/cm'3 Mr= 838. 5 . F(000) = 1040, λ(MoKa) =14. 0 cm-1. The final R=0. 094, Rw= 0. O95 for 13O4 observed reflections with I≥3. 0σ (I). The result of structure analysis indicates that the framework of this com-pound is a typical trimeric oxo ccntered carboxylato compound.展开更多
A coordination polymer formulated as {[Mn2L（N3）4]·2H2O）n（1） [L = 1,4-bis（pyridinil-3-carboxylato）-1,4- dimethylbenzene] was synthesized and structurally and magnetically characterized. The uniform Mn（Ⅱ）...A coordination polymer formulated as {[Mn2L（N3）4]·2H2O）n（1） [L = 1,4-bis（pyridinil-3-carboxylato）-1,4- dimethylbenzene] was synthesized and structurally and magnetically characterized. The uniform Mn（Ⅱ） chains with mixed （μ-EO-N3）2（μ-COO） triple bridges （EO = end-on） are linked by L ligands to generate a 2-fold interpenetrating 3D framework. Meanwhile, magnetism analysis reveals antiferromagnetic coupling for 1.展开更多
文摘The iR and Raman spectra were rrieasured for[Fe_2Cr(μ_3-O)-(glycine)_6 (H_2O)_3] (NO_3)_7. 3H2O in the range of 2000～90 cm￣-1. The assignment of the main skeleton vibrations was made in comparison with related compounds. A simplified model as well as a simplified general valence force field was used in the normal coordinate analysis of the skeleton and a set of force constants has been obtained. The calculated frequencies agree well with the observed ones, with a mean deviation of 1.8% which confirms the assignn: ient of their vibrational spectra. On the basis of the data obtained some discussions were made.
文摘A new coordination polymer of Cd(Ⅱ) was prepared by the reaction of Cd(ClO4)2·6H2O with mixed ligands, namely, neutral double betaine derivative 1,3-bis(pyridinio-4-carboxylato)propane and SCN- anion in aqueous solution. The crystal structure of 1 has been determined by single-crystal X-ray diffraction methods. Crystal data for 1: orthorhombic, space group P212121, a=1.050 9(2), b=1.162 8(2), c=1.649 5(3) nm, V=2.015 7(7) nm3, Z=4, F(000)=1 064, Dc=1.756 g·cm-3, the final R=0.050 8 and wR=0.130 1 for 3 530 observed reflections [I>2σ(I)]. Crystal structure of 1 indicates that the ( μ-1,3-NCS) bridging NCS- ligand connects neighboring cadmium atoms, leading to a single strand helical chain which propagates along crystallographic a axis. The metallic nodes of adjacent helical chains are linked by monodentate-monodentate coordination mode of both carboxylate groups in L molecules to generate 2D coordination sheet which parallels to the (001) plane. Adjacent layers are further joined by C-H…O hydrogen bonds; the structure thus expanded into a three-dimensional network. CCDC: 612657.
文摘The reaction behaviors of the title complexes have been studied in thesystem of dinitrogen gas by means of in situ IR. It has been found that some activefragments created at some stage of the thermal decomposition process of the complexes.enable.the acetic acid both obtained from the ligand of the complexes and introducedfrom outside to convert to acetone by decarboxylation. Their optimum reaction temperatures are of 240~270℃ for [Fe2MnO(O2CCH3),(H2O)3], 290~320 C for [Fe3Q(O2CCH3)6(H2O)3], 300~330℃ for [Fe2CoO(O2CCH3),(H2O)3] and 320~ 350℃for [Fe2NiO(O2CCH3)6(H2O)3], indicating the lowering sequence of the activity of active species. At the same time it has been shown that this activity may come from thejoined contributions of both the coordinating capability of the hetero-metals in the complexes and their structural factors. On the basis of the TGA, DTA and EI-MS data,the composition of the active fragments has been tentatively inferred as [Fe2MnO(O2CCH3)3-2].
文摘The compound [Fe2V(μ3-O) (μ-O2CCH3), (THF)3]Cl. 3H2O (THF=tetrahydrofuran) crystallizes in monoclinic system, space group C2, with cell di-mensions a= l2. 847(2), b= l5. 875 (6), c= lO. 211 (3) A, β= 109- 34 (3)', V=1965. 1(4) A3, Z= 2, D,c= 1. 73 g/cm'3 Mr= 838. 5 . F(000) = 1040, λ(MoKa) =14. 0 cm-1. The final R=0. 094, Rw= 0. O95 for 13O4 observed reflections with I≥3. 0σ (I). The result of structure analysis indicates that the framework of this com-pound is a typical trimeric oxo ccntered carboxylato compound.
基金supported by MOE Innovation Team of China(No.IRT13022)
文摘A coordination polymer formulated as {[Mn2L（N3）4]·2H2O）n（1） [L = 1,4-bis（pyridinil-3-carboxylato）-1,4- dimethylbenzene] was synthesized and structurally and magnetically characterized. The uniform Mn（Ⅱ） chains with mixed （μ-EO-N3）2（μ-COO） triple bridges （EO = end-on） are linked by L ligands to generate a 2-fold interpenetrating 3D framework. Meanwhile, magnetism analysis reveals antiferromagnetic coupling for 1.
