Information card for entry 7228585

Structure parameters

• Formula: C48 H58 Br18 N6 O14 Pb6
• Calculated formula: C48 H58 Br18 N6 O14 Pb6
• Title of publication: Viologen-Templated Bromoplumbate: A New in situ Synthetic Method and Energy Gap Engineering
• Authors of publication: Sun, Cai; Wang, Ming-Sheng; Zhang, Xian; Zhang, Ning-Ning; Cai, Lin-Rong; Guo, Guo-Cong
• Journal of publication: CrystEngComm
• Year of publication: 2017
• a: 11.7804 ± 0.0005 Å
• b: 12.0677 ± 0.0006 Å
• c: 14.8096 ± 0.0008 Å
• α: 99.043 ± 0.002°
• β: 94.199 ± 0.002°
• γ: 93.992 ± 0.002°
• Cell volume: 2066.57 ± 0.18 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0602
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.0794
• Weighted residual factors for all reflections included in the refinement: 0.0823
• Goodness-of-fit parameter for all reflections included in the refinement: 0.985
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No