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Information card for entry 4101763
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Coordinates | 4101763.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | 1,1,4,4-tetrakis[bis(trimethylsilyl)methyl]-1,4-diisopropyl- 2-tetrasilyne anion radical |
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Formula | C50 H130 K O8 Si12 |
Calculated formula | C50 H130 K O8 Si12 |
SMILES | [K]1234([O](C)CC[O]1C)([O](C)CC[O]2C)([O](C)CC[O]3C)[O](C)CC[O]4C.[Si]([Si][Si](C([Si](C)(C)C)[Si](C)(C)C)(C([Si](C)(C)C)[Si](C)(C)C)C(C)C)[Si](C([Si](C)(C)C)[Si](C)(C)C)(C([Si](C)(C)C)[Si](C)(C)C)C(C)C |
Title of publication | An isolable disilyne anion radical and a new route to the disilenide ion upon reduction of a disilyne. |
Authors of publication | Kinjo, Rei; Ichinohe, Masaaki; Sekiguchi, Akira |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2007 |
Journal volume | 129 |
Journal issue | 1 |
Pages of publication | 26 - 27 |
a | 11.171 ± 0.0008 Å |
b | 22.179 ± 0.0012 Å |
c | 31.458 ± 0.0019 Å |
α | 90° |
β | 93.542 ± 0.004° |
γ | 90° |
Cell volume | 7779.2 ± 0.8 Å3 |
Cell temperature | 120 ± 0.1 K |
Ambient diffraction temperature | 120 ± 0.1 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1229 |
Residual factor for significantly intense reflections | 0.0712 |
Weighted residual factors for significantly intense reflections | 0.1798 |
Weighted residual factors for all reflections included in the refinement | 0.2145 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.984 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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