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Information card for entry 8103353
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Coordinates | 8103353.cif |
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Formula | C20 H20 Br4 Co N2 O2 |
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Calculated formula | C20 H20 Br4 Co N2 O2 |
SMILES | [Co]12([N](=Cc3c(O1)c(Br)cc(Br)c3)C(C)C)[N](=Cc1c(O2)c(Br)cc(Br)c1)C(C)C |
Title of publication | Crystal structure of bis(3,5-dibromo-N-isopropylsalicylaldiminato-k2N,O)cobalt(II), Co(C10H10Br2NO)2 |
Authors of publication | Xuejun Long; Pan Zhou; Yingjie Cai |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2012 |
Journal volume | 227 |
Journal issue | 2 |
Pages of publication | 193 |
a | 9.9465 ± 0.0006 Å |
b | 13.3142 ± 0.0008 Å |
c | 19.9025 ± 0.0012 Å |
α | 73.035 ± 0.001° |
β | 76.02 ± 0.001° |
γ | 81.725 ± 0.001° |
Cell volume | 2438.6 ± 0.3 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.136 |
Residual factor for significantly intense reflections | 0.0629 |
Weighted residual factors for significantly intense reflections | 0.0962 |
Weighted residual factors for all reflections included in the refinement | 0.1084 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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