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Information card for entry 8107082
Preview
Coordinates | 8107082.cif |
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Original paper (by DOI) | HTML |
Formula | C40 H27 Cd N4 O9.5 |
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Calculated formula | C40 H27 Cd N4 O9.5 |
Title of publication | Crystal structure of aqua (5,5′-dicarboxy-(1,1′-biphenyl)-2,3′-dicarboxylato-κO) bis(1,10-phenanthroline-κ2 N,N′)cadmium monohydrate, C40H28CdN4O10 |
Authors of publication | Yao, Li-Ping; Zhao, Yan; Zhang, Rui |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2016 |
Journal volume | 231 |
Journal issue | 4 |
Pages of publication | 1017 - 1019 |
a | 9.5953 ± 0.0008 Å |
b | 22.1448 ± 0.0017 Å |
c | 16.3937 ± 0.0013 Å |
α | 90° |
β | 90.528 ± 0.001° |
γ | 90° |
Cell volume | 3483.3 ± 0.5 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 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 | 0.0924 |
Residual factor for significantly intense reflections | 0.0568 |
Weighted residual factors for significantly intense reflections | 0.1179 |
Weighted residual factors for all reflections included in the refinement | 0.1343 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.27 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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