Information card for entry 2213055

Structure parameters

• Chemical name: Bis(triethylammonium) tetrachloridomanganate(II)
• Formula: C12 H32 Cl4 Mn N2
• Calculated formula: C12 H32 Cl4 Mn N2
• SMILES: [Mn](Cl)(Cl)([Cl-])[Cl-].[NH+](CC)(CC)CC.[NH+](CC)(CC)CC
• Title of publication: Bis(triethylammonium) tetrachloridomanganate(II)
• Authors of publication: Clegg, William; Martin, Nicola C.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 4
• Pages of publication: m1151 - m1151
• a: 12.0533 ± 0.0005 Å
• b: 13.0595 ± 0.0006 Å
• c: 26.0147 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4095 ± 0.3 ų
• Cell temperature: 160 ± 2 K
• Ambient diffraction temperature: 160 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0417
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.0872
• Weighted residual factors for all reflections included in the refinement: 0.0895
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes