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Information card for entry 7202004
Preview
Coordinates | 7202004.cif |
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Original paper (by DOI) | HTML |
Formula | C22 H26 Cu N8 O10 |
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Calculated formula | C22 H26 Cu N8 O10 |
SMILES | c1c(/C=C/c2ccncn2)ccc[n]1[Cu]([OH2])([n]1cc(ccc1)/C=C/c1ccncn1)([OH2])([OH2])[OH2].N(=O)(=O)[O-].N(=O)(=O)[O-] |
Title of publication | Supramolecular architectures based on transition metal complexes with 1-(3-pyridyl)-2-(4′-pyrimidyl)ethene |
Authors of publication | Liu, Na; Wang, Yan-Qin; Gao, En-Qing; Chen, Zhen-Xia; Weng, Lin-Hong |
Journal of publication | CrystEngComm |
Year of publication | 2008 |
Journal volume | 10 |
Journal issue | 7 |
Pages of publication | 915 |
a | 9.778 ± 0.004 Å |
b | 12.825 ± 0.006 Å |
c | 10.618 ± 0.005 Å |
α | 90° |
β | 95.422 ± 0.007° |
γ | 90° |
Cell volume | 1325.6 ± 1 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.1034 |
Residual factor for significantly intense reflections | 0.0575 |
Weighted residual factors for significantly intense reflections | 0.1356 |
Weighted residual factors for all reflections included in the refinement | 0.15 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.992 |
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/7202004.html
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