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Information card for entry 1571036
Preview
| Coordinates | 1571036.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C84 H66 Al B4 F36 Mo2 N19 O4 |
|---|---|
| Calculated formula | C84 H66 Al B4 F36 Mo2 N19 O4 |
| Title of publication | Oxidation-induced ambiphilicity triggers N-N bond formation and dinitrogen release in octahedral terminal molybdenum(v) nitrido complexes. |
| Authors of publication | Almquist, C. Christopher; Rajeshkumar, Thayalan; Jayaweera, H. D. A. Chathumal; Removski, Nicole; Zhou, Wen; Gelfand, Benjamin S.; Maron, Laurent; Piers, Warren E. |
| Journal of publication | Chemical science |
| Year of publication | 2024 |
| Journal volume | 15 |
| Journal issue | 14 |
| Pages of publication | 5152 - 5162 |
| a | 15.9395 ± 0.0009 Å |
| b | 18.5574 ± 0.0008 Å |
| c | 18.9383 ± 0.0009 Å |
| α | 116.155 ± 0.002° |
| β | 90.495 ± 0.002° |
| γ | 98.658 ± 0.002° |
| Cell volume | 4953.2 ± 0.4 Å3 |
| Cell temperature | 173.15 K |
| Ambient diffraction temperature | 173.15 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 | 0.0658 |
| Residual factor for significantly intense reflections | 0.0554 |
| Weighted residual factors for significantly intense reflections | 0.1453 |
| Weighted residual factors for all reflections included in the refinement | 0.1559 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 291576 (current) | 2024-05-05 | cif/ Updating files of 1571025, 1571026, 1571027, 1571028, 1571029, 1571030, 1571031, 1571032, 1571033, 1571034, 1571035, 1571036, 1571037 Original log message: Adding full bibliography for 1571025--1571037.cif. |
1571036.cif |
| 289851 | 2024-02-17 | cif/ Adding structures of 1571025, 1571026, 1571027, 1571028, 1571029, 1571030, 1571031, 1571032, 1571033, 1571034, 1571035, 1571036, 1571037 via cif-deposit CGI script. |
1571036.cif |
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Users of the data should acknowledge the original authors of the
structural data.