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Information card for entry 4346678
Preview
| Coordinates | 4346678.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C106 H108 Mo4 N12 O16.5 S4 |
|---|---|
| Calculated formula | C106 H108 Mo4 N12 O16.5 S4 |
| Title of publication | Electronic Coupling in [Mo2]-Bridge-[Mo2] Systems with Twisted Bridges. |
| Authors of publication | Zhang, Hong Li; Zhu, Guang Yuan; Wang, Gangyi; Meng, Miao; Liu, Chun Y.; Lei, Hao |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2015 |
| Journal volume | 54 |
| Journal issue | 23 |
| Pages of publication | 11314 - 11322 |
| a | 11.3795 ± 0.0006 Å |
| b | 13.3623 ± 0.0008 Å |
| c | 18.6024 ± 0.0011 Å |
| α | 101.421 ± 0.005° |
| β | 98.685 ± 0.005° |
| γ | 98.148 ± 0.005° |
| Cell volume | 2697.5 ± 0.3 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 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 | 0.0904 |
| Residual factor for significantly intense reflections | 0.0685 |
| Weighted residual factors for significantly intense reflections | 0.1713 |
| Weighted residual factors for all reflections included in the refinement | 0.1863 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.09 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 231917 (current) | 2019-11-23 | cif/ Adding structures of 4346677, 4346678 via cif-deposit CGI script. |
4346678.cif |
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Users of the data should acknowledge the original authors of the
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