Information card for entry 2214724

Structure parameters

• Common name: (2,3-DMQH2).(SnBr6) 3 (H2O)
• Chemical name: 2,3-Dimethylquinoxalinediium hexabromostannate(IV) trihydrate
• Formula: C10 H18 Br6 N2 O3 Sn
• Calculated formula: C10 H18 Br6 N2 O3 Sn
• SMILES: [Sn](Br)([Br-])(Br)(Br)([Br-])Br.O.O.O.[nH+]1c(C)c([nH+]c2c1cccc2)C
• Title of publication: 2,3-Dimethylquinoxalinediium hexabromidostannate(IV) trihydrate
• Authors of publication: Ali, Basem Fares; Al-Far, Rawhi; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: m2102 - m2103
• a: 9.898 ± 0.003 Å
• b: 13.62 ± 0.005 Å
• c: 16.098 ± 0.006 Å
• α: 90°
• β: 103.599 ± 0.006°
• γ: 90°
• Cell volume: 2109.3 ± 1.3 ų
• Cell temperature: 84 ± 2 K
• Ambient diffraction temperature: 84 ± 2 K
• Number of distinct elements: 6
• 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: 0.0727
• Residual factor for significantly intense reflections: 0.0623
• Weighted residual factors for significantly intense reflections: 0.1265
• Weighted residual factors for all reflections included in the refinement: 0.1319
• Goodness-of-fit parameter for all reflections included in the refinement: 1.204
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes