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Information card for entry 4064790
Preview
Coordinates | 4064790.cif |
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Original paper (by DOI) | HTML |
Formula | C18 H15 Cl2 Co N3 |
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Calculated formula | C18 H15 Cl2 Co N3 |
SMILES | [Co]1(Cl)(Cl)[n]2c(c3cccc4ccc([n]1c34)C)n(c1ccccc21)C |
Title of publication | Dichlorocobalt(II) Complexes Ligated by Bidentate 8-(Benzoimidazol-2-yl)quinolines: Synthesis, Characterization, and Catalytic Behavior toward Ethylene |
Authors of publication | Xiao, Tianpengfei; Hao, Peng; Kehr, Gerald; Hao, Xiang; Erker, Gerhard; Sun, Wen-Hua |
Journal of publication | Organometallics |
Year of publication | 2011 |
Journal volume | 30 |
Journal issue | 18 |
Pages of publication | 4847 |
a | 7.1634 ± 0.0014 Å |
b | 17.152 ± 0.003 Å |
c | 13.66 ± 0.003 Å |
α | 90° |
β | 101.5 ± 0.03° |
γ | 90° |
Cell volume | 1644.7 ± 0.6 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 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 | 0.0763 |
Residual factor for significantly intense reflections | 0.0581 |
Weighted residual factors for significantly intense reflections | 0.122 |
Weighted residual factors for all reflections included in the refinement | 0.1345 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.238 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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