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Information card for entry 4081569
Preview
| Coordinates | 4081569.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C56 H57 B6 F27 Mo6 N16 O12 |
|---|---|
| Calculated formula | C56 H56.997 B6.001 F27.006 Mo6 N16 O12 |
| Title of publication | Synthesis and Characterization of Dimolybdenum(II) Complexes Connected by Carboxylate Linkers |
| Authors of publication | Cai, Xu-Min; Höhne, Dominik; Köberl, Mathias; Cokoja, Mirza; Pöthig, Alexander; Herdtweck, Eberhardt; Haslinger, Stefan; Herrmann, Wolfgang A.; Kühn, Fritz E. |
| Journal of publication | Organometallics |
| Year of publication | 2013 |
| Journal volume | 32 |
| Journal issue | 20 |
| Pages of publication | 6004 |
| a | 20.6355 ± 0.0003 Å |
| b | 20.6355 ± 0.0003 Å |
| c | 13.6658 ± 0.0002 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 5039.6 ± 0.13 Å3 |
| Cell temperature | 123 ± 1 K |
| Ambient diffraction temperature | 123 ± 1 K |
| Number of distinct elements | 7 |
| Space group number | 147 |
| Hermann-Mauguin space group symbol | P -3 |
| Hall space group symbol | -P 3 |
| Residual factor for all reflections | 0.045 |
| Residual factor for significantly intense reflections | 0.0437 |
| Weighted residual factors for significantly intense reflections | 0.1199 |
| Weighted residual factors for all reflections included in the refinement | 0.1207 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.063 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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