Information card for entry 7242061

Structure parameters

• Formula: C10 H24 Br4 Mn N2
• Calculated formula: C10 H24 Br4 Mn N2
• SMILES: Br[Mn](Br)([Br-])[Br-].C[N+](C=C)(C)C.C(=C)[N+](C)(C)C
• Title of publication: Red/green-light emission in continuous dielectric phase transition materials: [Me3NVinyl]2[MnX4] (X = Cl, Br)
• Authors of publication: Li, Yanyan; Lin, Liting; Yang, Jie; Qian, Kun; Jiang, Tao; Li, Hong
• Journal of publication: RSC Advances
• Year of publication: 2021
• Journal volume: 11
• Journal issue: 4
• Pages of publication: 2329 - 2336
• a: 9.2339 ± 0.0006 Å
• b: 15.1859 ± 0.001 Å
• c: 13.7409 ± 0.0008 Å
• α: 90°
• β: 91.494 ± 0.006°
• γ: 90°
• Cell volume: 1926.2 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.1699
• Residual factor for significantly intense reflections: 0.1302
• Weighted residual factors for significantly intense reflections: 0.2812
• Weighted residual factors for all reflections included in the refinement: 0.3056
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No