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Information card for entry 4503063
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 4503063.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | tetramethylsilane |
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Formula | C4 H12 Si |
Calculated formula | C4 H12 Si |
SMILES | C[Si](C)(C)C |
Title of publication | The Interplay of Molecular Conformation and Crystal Packing in Pressure-Frozen Tetramethylsilane |
Authors of publication | Gajda, Roman; Katrusiak, Andrzej |
Journal of publication | Crystal Growth & Design |
Year of publication | 2008 |
Journal volume | 8 |
Journal issue | 1 |
Pages of publication | 211 |
a | 10.7328 ± 0.0013 Å |
b | 10.7328 ± 0.0013 Å |
c | 10.7328 ± 0.0013 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1236.3 ± 0.3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 3 |
Space group number | 205 |
Hermann-Mauguin space group symbol | P a -3 |
Hall space group symbol | -P 2ac 2ab 3 |
Residual factor for all reflections | 0.0576 |
Residual factor for significantly intense reflections | 0.0551 |
Weighted residual factors for significantly intense reflections | 0.0941 |
Weighted residual factors for all reflections included in the refinement | 0.0948 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.381 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4503063.html
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structural data.