Information card for entry 2004458

Structure parameters

• Common name: Mn(ω-nap)~2~ dipyridine adduct
• Chemical name: bis(ω-nitroacetophenonato)Mn(II) cis-dipyridine adduct
• Formula: C26 H22 Mn N4 O6
• Calculated formula: C26 H22 Mn N4 O6
• SMILES: c1ccccc1C1=CN(=O)=[O][Mn]2([n]3ccccc3)(O1)([n]1ccccc1)OC(=CN(=O)=[O]2)c1ccccc1
• Title of publication: <i>cis</i>-Dipyridine Complex of Bis(ω-nitroacetophenonato)manganese(II)
• Authors of publication: Hicke, S.; Mueller, T. E.; Falvello, L. R.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 2
• Pages of publication: 307 - 309
• a: 13.847 ± 0.002 Å
• b: 12.2 ± 0.001 Å
• c: 15.981 ± 0.002 Å
• α: 90°
• β: 105.72 ± 0.01°
• γ: 90°
• Cell volume: 2598.7 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.1301
• Residual factor for significantly intense reflections: 0.0582
• Weighted residual factors for all reflections: 0.1185
• Weighted residual factors for significantly intense reflections: 0.104
• Goodness-of-fit parameter for all reflections: 1.054
• Goodness-of-fit parameter for significantly intense reflections: 1.202
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No