Information card for entry 2210279

Structure parameters

• Chemical name: Tris(3,3'-diamino-2,2'-bipyridine)manganese(II) dinitrate
• Formula: C30 H30 Mn N14 O6
• Calculated formula: C30 H30 Mn N14 O6
• SMILES: N(=O)(=O)[O-].[Mn]123([n]4c(c5c(ccc[n]25)N)c(ccc4)N)([n]2c(c4c(ccc[n]14)N)c(ccc2)N)[n]1c(c2c(ccc[n]32)N)c(ccc1)N.N(=O)(=O)[O-]
• Title of publication: Tris(3,3'-diamino-2,2'-bipyridine)manganese(II) dinitrate
• Authors of publication: Shi, Jing-Min; Chen, Ju-Na; Liu, Lian-Dong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: m2151 - m2152
• a: 14.7149 ± 0.0016 Å
• b: 14.7149 ± 0.0016 Å
• c: 13.229 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2480.7 ± 0.7 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 155
• Hermann-Mauguin space group symbol: R 3 2 :H
• Hall space group symbol: R 3 2"
• Residual factor for all reflections: 0.0423
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.087
• Weighted residual factors for all reflections included in the refinement: 0.0891
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes