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Information card for entry 7714032
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Coordinates | 7714032.cif |
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Original paper (by DOI) | HTML |
Formula | C53 H89 Cs N2 O12 |
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Calculated formula | C53 H89 Cs N2 O12 |
Title of publication | Revealing unbound β-diketiminate anions: structural dynamics from caesium complexes. |
Authors of publication | Videa, Hellen; Martínez-Martínez, Antonio J |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2023 |
Journal volume | 52 |
Journal issue | 37 |
Pages of publication | 13058 - 13062 |
a | 26.0601 ± 0.0005 Å |
b | 13.0041 ± 0.0002 Å |
c | 18.7072 ± 0.0003 Å |
α | 90° |
β | 117.471 ± 0.001° |
γ | 90° |
Cell volume | 5624.82 ± 0.17 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 5 |
Space group number | 9 |
Hermann-Mauguin space group symbol | C 1 c 1 |
Hall space group symbol | C -2yc |
Residual factor for all reflections | 0.0374 |
Residual factor for significantly intense reflections | 0.0283 |
Weighted residual factors for significantly intense reflections | 0.0714 |
Weighted residual factors for all reflections included in the refinement | 0.0771 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.076 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
286548 (current) | 2023-09-27 | cif/ Adding structures of 7714030, 7714031, 7714032, 7714033 via cif-deposit CGI script. |
7714032.cif |
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Users of the data should acknowledge the original authors of the
structural data.