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Information card for entry 7038691
Preview
| Coordinates | 7038691.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H94 F12 P10 Re2 Si2 |
|---|---|
| Calculated formula | C38 H94 F12 P10 Re2 Si2 |
| SMILES | C(#[Re](C#C[Si](C)(C)C)([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)[P](C)(C)C)CCC#[Re](C#C[Si](C)(C)C)([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)[P](C)(C)C.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-] |
| Title of publication | Electronic communication in phosphine substituted bridged dirhenium complexes - clarifying ambiguities raised by the redox non-innocence of the C4H2- and C4-bridges. |
| Authors of publication | Li, Yan; Blacque, Olivier; Fox, Thomas; Luber, Sandra; Polit, Walther; Winter, Rainer F.; Venkatesan, Koushik; Berke, Heinz |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2016 |
| Journal volume | 45 |
| Journal issue | 13 |
| Pages of publication | 5783 - 5799 |
| a | 10.1955 ± 0.0002 Å |
| b | 10.4458 ± 0.0001 Å |
| c | 15.8038 ± 0.0003 Å |
| α | 90.942 ± 0.001° |
| β | 108.673 ± 0.001° |
| γ | 91.938 ± 0.001° |
| Cell volume | 1592.94 ± 0.05 Å3 |
| Cell temperature | 183 ± 2 K |
| Ambient diffraction temperature | 183 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0257 |
| Residual factor for significantly intense reflections | 0.0215 |
| Weighted residual factors for significantly intense reflections | 0.0497 |
| Weighted residual factors for all reflections included in the refinement | 0.0503 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.973 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181636 (current) | 2016-04-05 | cif/ Updating files of 7038690, 7038691, 7038692, 7038693, 7038694, 7038695 Original log message: Adding full bibliography for 7038690--7038695.cif. |
7038691.cif |
| 177272 | 2016-03-04 | cif/ Adding structures of 7038690, 7038691, 7038692, 7038693, 7038694, 7038695 via cif-deposit CGI script. |
7038691.cif |
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Users of the data should acknowledge the original authors of the
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