Information card for entry 4313957

Structure parameters

• Formula: C72 H60 Ag4 Br4 O12 P4
• Calculated formula: C72 H60 Ag4 Br4 O12 P4
• SMILES: [P]([Ag]12[O]=[Br]([O]3[Ag]([P](c4ccccc4)(c4ccccc4)c4ccccc4)([O]1[Br](=[O]2)=O)[O]1[Ag]3([P](c2ccccc2)(c2ccccc2)c2ccccc2)[O]2[Ag]([P](c3ccccc3)(c3ccccc3)c3ccccc3)([O]=[Br]1=O)[O]=[Br]2=O)=O)(c1ccccc1)(c1ccccc1)c1ccccc1
• 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: 8.85 ± 0.002 Å
• b: 14.086 ± 0.003 Å
• c: 14.738 ± 0.003 Å
• α: 81.066 ± 0.004°
• β: 73.708 ± 0.004°
• γ: 86.966 ± 0.004°
• Cell volume: 1742 ± 0.6 ų
• 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: 0.059
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for all reflections: 0.047
• Weighted residual factors for all reflections included in the refinement: 0.043
• Goodness-of-fit parameter for all reflections: 1.174
• Goodness-of-fit parameter for all reflections included in the refinement: 1.244
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No