Information card for entry 7708403

Structure parameters

• Formula: C12 H20 Br N4 O8 P2 Pt
• Calculated formula: C12 H20 Br N4 O8 P2 Pt
• Title of publication: Interdigitated Pt-Br chains with π-stacking: an approach toward Robin-Day class I mixed valency in MX-chain complexes
• Authors of publication: Afrin, Unjila; Fuku, Kentaro; Cui, Mengxing; Iguchi, Hiroaki; Mian, Mohammad Rasel; Nakanishi, Ryo; Takaishi, Shinya; Yamashita, Masahiro
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 6.6978 ± 0.0015 Å
• b: 8.6438 ± 0.0018 Å
• c: 8.8483 ± 0.0019 Å
• α: 85.271 ± 0.004°
• β: 86.921 ± 0.005°
• γ: 67.163 ± 0.004°
• Cell volume: 470.37 ± 0.18 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0254
• Residual factor for significantly intense reflections: 0.0247
• Weighted residual factors for significantly intense reflections: 0.0564
• Weighted residual factors for all reflections included in the refinement: 0.0567
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No