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Information card for entry 7031180
Preview
| Coordinates | 7031180.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H32 O3 P2 Ru W |
|---|---|
| Calculated formula | C38 H32 O3 P2 Ru W |
| SMILES | [Ru]1234([P](c5ccccc5)(c5ccccc5)C[P](c5ccccc5)(c5ccccc5)[W]5678([cH]9[cH]5[cH]6[cH]7[cH]89)(C#[O])C#[O])([cH]5[cH]1[cH]2[cH]3[cH]45)C#[O] |
| Title of publication | Synthesis, characterization and reactivity of heterobimetallic complexes (?5-C5R5)Ru(CO)(�-dppm)M(CO)2(?5-C5H5) (R = H, CH3; M = Mo, W). Interconversion of hydrogen/carbon dioxide and formic acid by these complexesElectronic supplementary information (ESI) available: Selected bond lengths and angles and ORTEP diagrams for complexes 2?4 and 6�Cl and discussion on the structure of 6�Cl. See http://www.rsc.org/suppdata/dt/b3/b306835h/ |
| Authors of publication | Man, Man Lok; Zhou, Zhongyuan; Ng, Siu Man; Lau, Chak Po |
| Journal of publication | Dalton Transactions |
| Year of publication | 2003 |
| Journal issue | 19 |
| Pages of publication | 3727 |
| a | 15.181 ± 0.008 Å |
| b | 17.843 ± 0.01 Å |
| c | 24.543 ± 0.013 Å |
| α | 90° |
| β | 98.901 ± 0.011° |
| γ | 90° |
| Cell volume | 6568 ± 6 Å3 |
| Cell temperature | 294 ± 2 K |
| Ambient diffraction temperature | 294 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.124 |
| Residual factor for significantly intense reflections | 0.0801 |
| Weighted residual factors for significantly intense reflections | 0.2009 |
| Weighted residual factors for all reflections included in the refinement | 0.2189 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180017 (current) | 2016-03-25 | cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/11. |
7031180.cif |
| 115399 | 2014-06-03 | cif/ Adding structures of 7031178, 7031179, 7031180, 7031181, 7031182, 7031183 via cif-deposit CGI script. |
7031180.cif |
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