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Information card for entry 4314240
Preview
Coordinates | 4314240.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C62 H95 Cl3 Cu2 N16 O16 Zn2 |
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Calculated formula | C62 H95 Cl3 Cu2 N16 O16 Zn2 |
SMILES | [Cu]1234[NH]5CC[N]1(CC[NH]2Cc1ccc(C[NH]2[Zn]67([N](CC2)(CC[NH]6Cc2ccc(C5)cc2)CCO7)[n]2cn3cc2)cc1)CC[OH]4.[Zn]1234[NH]5CC[N]3(CC[NH]2Cc2ccc(cc2)C[NH]2[Cu]36([NH](CC[N]3(CC2)CCO6)Cc2ccc(cc2)C5)n2c[n]4cc2)CCO1.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-] |
Title of publication | Syntheses, Structures, and Properties of Imidazolate-Bridged Cu(II)-Cu(II) and Cu(II)-Zn(II) Dinuclear Complexes of a Single Macrocyclic Ligand with Two Hydroxyethyl Pendants |
Authors of publication | Dongfeng Li; Shuan Li; Dexi Yang; Jiuhong Yu; Jin Huang; Yizhi Li; Wenxia Tang |
Journal of publication | Inorganic Chemistry |
Year of publication | 2003 |
Journal volume | 42 |
Pages of publication | 6071 - 6080 |
a | 14.172 ± 0.002 Å |
b | 16.673 ± 0.002 Å |
c | 21.284 ± 0.003 Å |
α | 74.11 ± 0.01° |
β | 75.2 ± 0.01° |
γ | 82.22 ± 0.01° |
Cell volume | 4665 ± 1.1 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0931 |
Residual factor for significantly intense reflections | 0.0516 |
Weighted residual factors for significantly intense reflections | 0.122 |
Weighted residual factors for all reflections included in the refinement | 0.1282 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.005 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4314240.html
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