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Information card for entry 4313959
Preview
Coordinates | 4313959.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C73 H64 Ag As4 Br O4 |
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Calculated formula | C73 H60 Ag As4 Br O4 |
SMILES | [Ag]([As](c1ccccc1)(c1ccccc1)c1ccccc1)([As](c1ccccc1)(c1ccccc1)c1ccccc1)([As](c1ccccc1)(c1ccccc1)c1ccccc1)[As](c1ccccc1)(c1ccccc1)c1ccccc1.[Br](=O)(=O)[O-].OC |
Title of publication | Crystal Structures and Vibrational and Solution and Solid-State (CPMAS) NMR Spectroscopic Studies in Triphenyl Phosphine, Arsine, and Stibine Silver(I) Bromate Systems, (R3E)xAgBrO3 (E = P, As, Sb;x= 1-4) |
Authors of publication | Augusto Cingolani; Effendy; John V. Hanna; Maura Pellei; Claudio Pettinari; Carlo Santini; Brian W. Skelton; Allan H. White |
Journal of publication | Inorganic Chemistry |
Year of publication | 2003 |
Journal volume | 42 |
Pages of publication | 4938 - 4948 |
a | 11.8708 ± 0.0009 Å |
b | 14.562 ± 0.001 Å |
c | 18.613 ± 0.001 Å |
α | 88.874 ± 0.002° |
β | 87.088 ± 0.002° |
γ | 84.518 ± 0.002° |
Cell volume | 3198.3 ± 0.4 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 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 | 0.113 |
Residual factor for significantly intense reflections | 0.069 |
Weighted residual factors for all reflections | 0.114 |
Weighted residual factors for all reflections included in the refinement | 0.088 |
Goodness-of-fit parameter for all reflections | 2.075 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.97 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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