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Information card for entry 1561002
Preview
Coordinates | 1561002.cif |
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Original paper (by DOI) | HTML |
Formula | C48.1 H105.26 N4 O24.52 V6 |
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Calculated formula | C48.104 H105.26 N4 O24.526 V6 |
Title of publication | Physicochemical implications of surface alkylation of high-valent, Lindqvist-type polyoxovanadate-alkoxide clusters. |
Authors of publication | Fertig, Alex A.; Rabbani, S. M. Gulam; Koch, Melissa D.; Brennessel, William W.; Miró, Pere; Matson, Ellen M. |
Journal of publication | Nanoscale |
Year of publication | 2021 |
Journal volume | 13 |
Journal issue | 12 |
Pages of publication | 6162 - 6173 |
a | 12.6947 ± 0.0004 Å |
b | 15.5293 ± 0.0005 Å |
c | 18.1049 ± 0.0006 Å |
α | 90° |
β | 109.99 ± 0.004° |
γ | 90° |
Cell volume | 3354.2 ± 0.2 Å3 |
Cell temperature | 100 ± 0.1 K |
Ambient diffraction temperature | 100 ± 0.1 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0757 |
Residual factor for significantly intense reflections | 0.0597 |
Weighted residual factors for significantly intense reflections | 0.1691 |
Weighted residual factors for all reflections included in the refinement | 0.1827 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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