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Information card for entry 4106001
Preview
Coordinates | 4106001.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | 1,3-Bis[2,2-di-tert-butyl-1-(di-tert-butylmethylsilyl)- 2-methyldisilanyl]benzene-1',1''-diyl |
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Formula | C42 H88 Si6 |
Calculated formula | C42 H88 Si6 |
SMILES | c1c(cccc1[Si]([Si](C)(C(C)(C)C)C(C)(C)C)[Si](C)(C(C)(C)C)C(C)(C)C)[Si]([Si](C)(C(C)(C)C)C(C)(C)C)[Si](C)(C(C)(C)C)C(C)(C)C |
Title of publication | Isolable p- and m-[(tBu2MeSi)2Si]2C6H4: Disilaquinodimethane vs Triplet Bis(silyl radical) |
Authors of publication | Takeshi Nozawa; Michiyo Nagata; Masaaki Ichinohe; Akira Sekiguchi |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2011 |
Journal volume | 133 |
Pages of publication | 5773 - 5775 |
a | 26.201 ± 0.0011 Å |
b | 12.156 ± 0.0006 Å |
c | 15.404 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4906.2 ± 0.7 Å3 |
Cell temperature | 150 ± 0.1 K |
Ambient diffraction temperature | 150 ± 0.1 K |
Number of distinct elements | 3 |
Space group number | 56 |
Hermann-Mauguin space group symbol | P c c n |
Hall space group symbol | -P 2ab 2ac |
Residual factor for all reflections | 0.1035 |
Residual factor for significantly intense reflections | 0.0621 |
Weighted residual factors for significantly intense reflections | 0.1492 |
Weighted residual factors for all reflections included in the refinement | 0.1685 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
Diffraction radiation wavelength | 0.7107 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/4106001.html
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