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Information card for entry 4071935
Preview
Coordinates | 4071935.cif |
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Original paper (by DOI) | HTML |
Formula | C6 H22 B9 Cl Ge S |
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Calculated formula | C6 H21 B9 Cl Ge S |
SMILES | [Ge](Cl)([C]123[CH]45[BH]67[BH]89[B]%101([S](C)C)[BH]1%112[BH]234[BH]356[BH]478[BH]9%101[BH]%11234)(C)C |
Title of publication | Silicon(IV) and Germanium(IV) Moieties Stabilized by the Charge-Compensated Carborane Ligand [9-SMe2-7,8-C2B9H10]−: Synthetic and Structural Investigation |
Authors of publication | Meshcheryakov, Vladimir I.; Zheng, Chong; Kudinov, Alexander R.; Maguire, John A.; Hosmane, Narayan S. |
Journal of publication | Organometallics |
Year of publication | 2008 |
Journal volume | 27 |
Journal issue | 19 |
Pages of publication | 5033 |
a | 8.8368 ± 0.0008 Å |
b | 12.8117 ± 0.0011 Å |
c | 14.1838 ± 0.0012 Å |
α | 90° |
β | 90.913 ± 0.001° |
γ | 90° |
Cell volume | 1605.6 ± 0.2 Å3 |
Cell temperature | 203 ± 2 K |
Ambient diffraction temperature | 203 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0352 |
Residual factor for significantly intense reflections | 0.0341 |
Weighted residual factors for significantly intense reflections | 0.1109 |
Weighted residual factors for all reflections included in the refinement | 0.112 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.128 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4071935.html
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