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Information card for entry 1573268
Preview
Coordinates | 1573268.cif |
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Original paper (by DOI) | HTML |
Formula | C51 H83 B Mo N2 P4 |
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Calculated formula | C51 H83 B Mo N2 P4 |
Title of publication | Reactivity of metal hydrides with CO<sub>2</sub>: going beyond formate with a high-valent cationic pentahydride Mo(vi) complex. |
Authors of publication | Queyriaux, Nicolas; Cabrera-Trujillo, Jorge J; Durvin, Nina; Vendier, Laure; Miqueu, Karinne; Simonneau, Antoine |
Journal of publication | Chemical science |
Year of publication | 2024 |
Journal volume | 15 |
Journal issue | 48 |
Pages of publication | 20582 - 20589 |
a | 11.2886 ± 0.0001 Å |
b | 25.1547 ± 0.0002 Å |
c | 20.9232 ± 0.0002 Å |
α | 90° |
β | 90.436 ± 0.001° |
γ | 90° |
Cell volume | 5941.21 ± 0.09 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0566 |
Residual factor for significantly intense reflections | 0.0552 |
Weighted residual factors for significantly intense reflections | 0.1354 |
Weighted residual factors for all reflections included in the refinement | 0.1363 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
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 |
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297099 (current) | 2025-01-06 | cif/ Updating files of 1573265, 1573266, 1573267, 1573268 Original log message: Adding full bibliography for 1573265--1573268.cif. |
1573268.cif |
296099 | 2024-11-26 | cif/ Adding structures of 1573265, 1573266, 1573267, 1573268 via cif-deposit CGI script. |
1573268.cif |
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Users of the data should acknowledge the original authors of the
structural data.