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Information card for entry 4071771
Preview
Coordinates | 4071771.cif |
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Original paper (by DOI) | HTML |
Formula | C14 H20 Co Si2 |
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Calculated formula | C14 H20 Co Si2 |
SMILES | [Co]123456789[c]%10([cH]1[cH]2[cH]3[cH]4%10)[Si](C)(C)[Si]([c]15[cH]6[cH]7[cH]8[cH]91)(C)C |
Title of publication | Synthesis, Crystal Structure, EPR and DFT Studies, and Redox Properties of [2]Tetramethyldisilacobaltocenophane |
Authors of publication | Braunschweig, Holger; Breher, Frank; Kaupp, Martin; Gross, Manuela; Kupfer, Thomas; Nied, Dominik; Radacki, Krzysztof; Schinzel, Sandra |
Journal of publication | Organometallics |
Year of publication | 2008 |
Journal volume | 27 |
Journal issue | 24 |
Pages of publication | 6427 |
a | 8.2595 ± 0.0003 Å |
b | 10.3127 ± 0.0005 Å |
c | 8.5719 ± 0.0004 Å |
α | 90° |
β | 90.38 ± 0.002° |
γ | 90° |
Cell volume | 730.12 ± 0.06 Å3 |
Cell temperature | 99 ± 2 K |
Ambient diffraction temperature | 99 ± 2 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0195 |
Residual factor for significantly intense reflections | 0.018 |
Weighted residual factors for significantly intense reflections | 0.0519 |
Weighted residual factors for all reflections included in the refinement | 0.0626 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.197 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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