Information card for entry 4003557

Structure parameters

• Formula: C7 H7 Br3 N O Pb
• Calculated formula: C7 H10 Br3 N O Pb
• Title of publication: Targeted Synthesis of Trimeric Organic‒Bromoplumbate Hybrids That Display Intrinsic, Highly Stokes-Shifted, Broadband Emission
• Authors of publication: Febriansyah, Benny; Neo, Chong Shern Daniel; Giovanni, David; Srivastava, Shivani; Lekina, Yulia; Koh, Teck Ming; Li, Yongxin; Shen, Ze Xiang; Asta, Mark; Sum, Tze Chien; Mathews, Nripan; England, Jason
• Journal of publication: Chemistry of Materials
• Year of publication: 2020
• a: 7.7918 ± 0.0007 Å
• b: 11.1156 ± 0.0009 Å
• c: 14.7794 ± 0.0012 Å
• α: 90.295 ± 0.002°
• β: 98.934 ± 0.002°
• γ: 100.308 ± 0.002°
• Cell volume: 1243.4 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1173
• Residual factor for significantly intense reflections: 0.0579
• Weighted residual factors for significantly intense reflections: 0.1004
• Weighted residual factors for all reflections included in the refinement: 0.123
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No