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Information card for entry 4326877
Preview
Coordinates | 4326877.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C46 H54 Cl2 Cu3 N6 O6 |
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Calculated formula | C46 H54 Cl2 Cu3 N6 O6 |
SMILES | c12ccccc1C[NH]1CC(C)(c3ccccn3)C[NH]3Cc4c(cccc4)[O]4[Cu]5([O]2[Cu]134Cl)[O]1c2ccccc2C[NH]2CC(C)(c3ccccn3)C[NH]3Cc4ccccc4[O]5[Cu]123Cl.O.O |
Title of publication | Tetradentate vs Pentadentate Coordination in Copper(II) Complexes of Pyridylbis(aminophenol) Ligands Depends on Nucleophilicity of Phenol Donors |
Authors of publication | Rajendra Shakya; Zhaodong Wang; Douglas R. Powell; Robert P. Houser |
Journal of publication | Inorganic Chemistry |
Year of publication | 2011 |
Journal volume | 50 |
Pages of publication | 11581 - 11591 |
a | 19.352 ± 0.003 Å |
b | 13.614 ± 0.002 Å |
c | 19.977 ± 0.003 Å |
α | 90° |
β | 117.984 ± 0.005° |
γ | 90° |
Cell volume | 4647.7 ± 1.2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0551 |
Residual factor for significantly intense reflections | 0.0431 |
Weighted residual factors for significantly intense reflections | 0.1138 |
Weighted residual factors for all reflections included in the refinement | 0.1231 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.001 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4326877.html
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