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Information card for entry 7212273
Preview
Coordinates | 7212273.cif |
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Original paper (by DOI) | HTML |
Formula | C45 H57 N5 O2 |
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Calculated formula | C45 H57 N5 O2 |
SMILES | c1c(cccn1)c1cc(c(c(c1)C(C)C)/N=C(\C)c1cccc(C(=N\c2c(cc(cc2C(C)C)c2cccnc2)C(C)C)\C)n1)C(C)C.CO.CO |
Title of publication | Solvent-directed conformational variation of Co(ii)/(iii) complexes with a diiminopyridine ligand |
Authors of publication | Wu, Biao; Yang, Jin; Liu, Yanyan; Zhuge, Fuyu; Tang, Ning; Yang, Xiao-Juan |
Journal of publication | CrystEngComm |
Year of publication | 2010 |
Journal volume | 12 |
Journal issue | 10 |
Pages of publication | 2755 |
a | 8.7594 ± 0.0016 Å |
b | 15.754 ± 0.003 Å |
c | 15.889 ± 0.003 Å |
α | 76.862 ± 0.003° |
β | 87.533 ± 0.004° |
γ | 86.832 ± 0.003° |
Cell volume | 2130.9 ± 0.7 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1948 |
Residual factor for significantly intense reflections | 0.0672 |
Weighted residual factors for significantly intense reflections | 0.1518 |
Weighted residual factors for all reflections included in the refinement | 0.2035 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.918 |
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/7212273.html
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