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Information card for entry 7042473
Preview
| Coordinates | 7042473.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C100 H78 B2 F48 Mo2 O2 P2 S2 |
|---|---|
| Calculated formula | C100 H78 B2 F48 Mo2 O2 P2 S2 |
| Title of publication | Chemistry of CS2- and SCNPh-adducts of the pyramidal phosphinidene-bridged complex [Mo2Cp(μ-κ(1):κ(1),η(5)-PC5H4)(CO)2(η(6)-HMes*)(PMe3)]. |
| Authors of publication | Albuerne, Isabel G.; Alvarez, M. Angeles; García, M Esther; García-Vivó, Daniel; Ruiz, Miguel A. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2017 |
| Journal volume | 46 |
| Journal issue | 11 |
| Pages of publication | 3510 - 3525 |
| a | 14.0227 ± 0.0006 Å |
| b | 14.4107 ± 0.0003 Å |
| c | 28.596 ± 0.001 Å |
| α | 82.24 ± 0.002° |
| β | 79.614 ± 0.004° |
| γ | 79.716 ± 0.003° |
| Cell volume | 5560.9 ± 0.3 Å3 |
| Cell temperature | 152 ± 4 K |
| Ambient diffraction temperature | 152 ± 4 K |
| Number of distinct elements | 8 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1184 |
| Residual factor for significantly intense reflections | 0.0849 |
| Weighted residual factors for significantly intense reflections | 0.2389 |
| Weighted residual factors for all reflections included in the refinement | 0.2797 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 194245 (current) | 2017-03-15 | cif/ Adding structures of 7042470, 7042471, 7042472, 7042473, 7042474, 7042475 via cif-deposit CGI script. |
7042473.cif |
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Users of the data should acknowledge the original authors of the
structural data.