Information card for entry 1564832

Structure parameters

• Formula: C3 H32 Mn N Na4 O22 P3
• Calculated formula: C3 H32 Mn N Na4 O22 P3
• Title of publication: Tetra-sodium Nitrilo-tris(methylenephosphonato)-manganate(II) Na4[MnII{N(CH2PO3)3}] 13H2O: Synthesis and Some Structural Features
• Authors of publication: Somov, N.V.; Chausov, F.F.; Lomova, N.V.; Shumilova, M.A.; Zhirov, D.K.
• Journal of publication: Crystallography Reports
• Year of publication: 2020
• Journal volume: 65
• Journal issue: 2
• Pages of publication: 233 - 241
• a: 11.2146 ± 0.0004 Å
• b: 11.2687 ± 0.0004 Å
• c: 12.4625 ± 0.0004 Å
• α: 108.619 ± 0.003°
• β: 97.149 ± 0.003°
• γ: 116.991 ± 0.004°
• Cell volume: 1260.47 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0368
• Residual factor for significantly intense reflections: 0.0288
• Weighted residual factors for significantly intense reflections: 0.0703
• Weighted residual factors for all reflections included in the refinement: 0.0747
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No