Information card for entry 1552316

Structure parameters

• Chemical name: Bis(quinolinium) tetrabromidomanganate(II)
• Formula: C18 H16 Br4 Mn N2
• Calculated formula: C18 H16 Br4 Mn N2
• SMILES: c1ccc2ccccc2[nH+]1.Br[Mn](Br)([Br-])[Br-].c1ccc2ccccc2[nH+]1
• Title of publication: Bis(quinolinium) tetrabromidomanganate(II)
• Authors of publication: Papa, Veronica; Spannenberg, Anke; Beller, Matthias; Junge, Kathrin
• Journal of publication: IUCrData
• Year of publication: 2019
• Journal volume: 4
• Journal issue: 9
• Pages of publication: x191231
• a: 17.4314 ± 0.0006 Å
• b: 9.1871 ± 0.0003 Å
• c: 13.227 ± 0.0004 Å
• α: 90°
• β: 93.7501 ± 0.0012°
• γ: 90°
• Cell volume: 2113.69 ± 0.12 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0186
• Residual factor for significantly intense reflections: 0.0163
• Weighted residual factors for significantly intense reflections: 0.0397
• Weighted residual factors for all reflections included in the refinement: 0.0406
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes