Information card for entry 7237490

Structure parameters

• Formula: C32 H32 B10
• Calculated formula: C32 H32 B10
• Title of publication: Photoluminescence in m-carborane‒anthracene triads: a combined experimental and computational study
• Authors of publication: Chaari, Mahdi; Kelemen, Zsolt; Planas, José Giner; Teixidor, Francesc; Choquesillo-Lazarte, Duane; Ben Salah, Abdelhamid; Viñas, Clara; Núñez, Rosario
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2018
• Journal volume: 6
• Journal issue: 42
• Pages of publication: 11336
• a: 14.9081 ± 0.0004 Å
• b: 18.3536 ± 0.0006 Å
• c: 10.6137 ± 0.0004 Å
• α: 90°
• β: 100.673 ± 0.003°
• γ: 90°
• Cell volume: 2853.85 ± 0.16 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0705
• Residual factor for significantly intense reflections: 0.0542
• Weighted residual factors for significantly intense reflections: 0.1582
• Weighted residual factors for all reflections included in the refinement: 0.1702
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No