Information card for entry 2232095

Structure parameters

• Common name: (<i>N</i>,<i>N</i>'-<i>o</i>-Phenylenebis(pyridine-2-carboxamidato)) (dimethylaminopyridine) (nitrosyl)manganese(II) heptakis ethanol solvate hydrate
• Chemical name: octakis{[4-(dimethylamino)pyridine](nitrosyl)[<i>N</i>,<i>N</i>'-(<i>o</i>- phenylene)bis(pyridine-2-carboxamidato)]manganese(II)} ethanol heptasolvate 3.5-hydrate
• Formula: C26.75 H28.12 Mn N7 O4.31
• Calculated formula: C26.75 H27.25 Mn N7 O4.3125
• Title of publication: [Mn(bpb)(DMAP)(NO)], an {Mn‒NO}^6^ nitrosyl with <i>Z</i>' = 8
• Authors of publication: Olmstead, Marilyn M.; Eroy-Reveles, A. Alegra; Mascharak, Pradip K.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 10
• Pages of publication: m1451 - m1452
• a: 24.943 ± 0.003 Å
• b: 14.4343 ± 0.0018 Å
• c: 29.688 ± 0.004 Å
• α: 90°
• β: 101.19 ± 0.003°
• γ: 90°
• Cell volume: 10486 ± 2 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 5
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Residual factor for all reflections: 0.2135
• Residual factor for significantly intense reflections: 0.0679
• Weighted residual factors for significantly intense reflections: 0.1206
• Weighted residual factors for all reflections included in the refinement: 0.1514
• Goodness-of-fit parameter for all reflections included in the refinement: 0.637
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes