Information card for entry 7123535

Structure parameters

• Formula: C18 H40 Br4 Mn N2
• Calculated formula: C18 H40 Br4 Mn N2
• Title of publication: Efficient modulation of photoluminescence by hydrogen bonding interactions among inorganic [MnBr4]2- anions and organic cations
• Authors of publication: Gong, Liaokuo; Hu, Qianqian; Huang, Fuquan; Zhang, Zhi-Zhuan; Shen, Nan-Nan; Hu, Bing; Song, Ying; Wang, Ze-Ping; Du, Kezhao; Huang, Xiao-ying
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 17.0484 ± 0.0003 Å
• b: 10.3083 ± 0.0001 Å
• c: 29.8192 ± 0.0004 Å
• α: 90°
• β: 100.037 ± 0.001°
• γ: 90°
• Cell volume: 5160.22 ± 0.13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0539
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for significantly intense reflections: 0.1065
• Weighted residual factors for all reflections included in the refinement: 0.1149
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No