Information card for entry 7010913

Structure parameters

• Formula: C48 H42 Ag Br N2 P4 Se4
• Calculated formula: C48 H42 Ag Br N2 P4 Se4
• SMILES: [Ag]12([Se]=P(NP(=[Se]1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)[Se]=P(NP(=[Se]2)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
• Title of publication: Silver(i) coordination by variants of the bis(diphenylphosphino)amine chalcogenide ligandElectronic supplementary information (ESI) available: tables of crystal data. See http://www.rsc.org/suppdata/dt/b1/b105154g/
• Authors of publication: Wilton-Ely, James D. E. T.; Schier, Annette; Schmidbaur, Hubert
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2001
• Journal issue: 24
• Pages of publication: 3647
• a: 19.8727 ± 0.0002 Å
• b: 19.9494 ± 0.0003 Å
• c: 26.8027 ± 0.0003 Å
• α: 76.036 ± 0.001°
• β: 72.849 ± 0.001°
• γ: 72.363 ± 0.001°
• Cell volume: 9540.4 ± 0.2 ų
• Cell temperature: 143 ± 2 K
• Ambient diffraction temperature: 143 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0994
• Residual factor for significantly intense reflections: 0.0618
• Weighted residual factors for significantly intense reflections: 0.0991
• Weighted residual factors for all reflections included in the refinement: 0.1107
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No