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Information card for entry 8102424
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Coordinates | 8102424.cif |
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Formula | C26 H26 Cd N4 O4 |
---|---|
Calculated formula | C26 H26 Cd N4 O4 |
SMILES | [Cd]12([O]=C(/C=C/c3ccccc3)O1)([O]=C(/C=C/c1ccccc1)O2)([n]1c(C)[nH]cc1)[n]1c(C)[nH]cc1 |
Title of publication | Crystal structure of cis-bis(2-methylimidazolyl)-bis(cis-cinnamato-O,O')cadmium(II), Cd(C9H7O2)2(C4H6N2)2 |
Authors of publication | Hong Chen; Xiu-Ling Wu; Bo Hu; Bing Xiao; Ye Wu; Li Zhang; Si-Yuan Luo; Hong-Xue Xie; Da-Wei Meng |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2009 |
Journal volume | 224 |
Journal issue | 2 |
Pages of publication | 215 |
a | 18.3178 ± 0.0014 Å |
b | 10.9019 ± 0.0008 Å |
c | 13.258 ± 0.001 Å |
α | 90° |
β | 99.618 ± 0.001° |
γ | 90° |
Cell volume | 2610.4 ± 0.3 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0539 |
Residual factor for significantly intense reflections | 0.0367 |
Weighted residual factors for significantly intense reflections | 0.084 |
Weighted residual factors for all reflections included in the refinement | 0.0981 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.952 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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