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Information card for entry 7027638
Preview
Coordinates | 7027638.cif |
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Original paper (by DOI) | HTML |
Formula | C14 H12 O8 Re2 S |
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Calculated formula | C14 H12 O8 Re2 S |
SMILES | [Re]1([H][Re]([S]1C1CCCCC1)(C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])(C#[O])C#[O] |
Title of publication | The reaction of [Re2(CO)8(MeCN)2] with thiols. Formation of hydrido sulfido bridged dirhenium cluster complexes [Re2(μ-H)(μ-SR)(CO)8] (R = H, n-Bu, Cy, Ph, C6H4F-p, C6F5 or 2-naphthyl) |
Authors of publication | Egold, Hans; Schwarze, Detlef; Flörke, Ulrich |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 1999 |
Journal issue | 18 |
Pages of publication | 3203 |
a | 10.399 ± 0.002 Å |
b | 11.555 ± 0.003 Å |
c | 16.244 ± 0.005 Å |
α | 90° |
β | 98.63 ± 0.02° |
γ | 90° |
Cell volume | 1929.8 ± 0.9 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0807 |
Residual factor for significantly intense reflections | 0.0469 |
Weighted residual factors for significantly intense reflections | 0.0989 |
Weighted residual factors for all reflections included in the refinement | 0.1116 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.018 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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