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Information card for entry 8106044
Preview
Coordinates | 8106044.cif |
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Original paper (by DOI) | HTML |
Formula | C68 H54 Co2 N8 O15 S2 |
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Calculated formula | C68 H54 Co2 N8 O15 S2 |
Title of publication | Crystal structure of poly{[μ2-1,1′-(sulfonylbis(4,1-phenylene))bis(2-methyl-1H-imidazole)-κ2 N:N′][μ2-4,4′-oxydibenzoato-κ2 O:O′]cobalt(II)} hemihydrate, C34H27N4O7.5SCo |
Authors of publication | Li, Wei; Sun, Xuan; Suo, Jian; Xing, Yanpeng; Wang, Daguang |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2018 |
Journal volume | 233 |
Journal issue | 1 |
Pages of publication | 65 - 66 |
a | 23.7684 ± 0.0016 Å |
b | 13.5683 ± 0.001 Å |
c | 10.0223 ± 0.0007 Å |
α | 90° |
β | 94.405 ± 0.002° |
γ | 90° |
Cell volume | 3222.6 ± 0.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 9 |
Hermann-Mauguin space group symbol | C 1 c 1 |
Hall space group symbol | C -2yc |
Residual factor for all reflections | 0.0741 |
Residual factor for significantly intense reflections | 0.0427 |
Weighted residual factors for significantly intense reflections | 0.0715 |
Weighted residual factors for all reflections included in the refinement | 0.0815 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.012 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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