Information card for entry 8106952

Structure parameters

• Formula: C44 H54 Mn N4
• Calculated formula: C44 H54 Mn N4
• Title of publication: Crystal structure of (((1E,1′E)-(cyclohexane-1,2-diylbis(azanylylidene-κ2 N,N′))bis(methanylylidene))bis(2,1-phenylene))bis((2,6-diisopropylphenyl)amide-κ2 N′′,N′′′)manganese(II), C44H54N4Mn
• Authors of publication: Ji, Xiangdong; Gao, Wei; Mu, Ying
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2016
• Journal volume: 231
• Journal issue: 2
• Pages of publication: 605 - 607
• a: 15.315 ± 0.003 Å
• b: 14.259 ± 0.003 Å
• c: 18.118 ± 0.003 Å
• α: 90°
• β: 105.252 ± 0.003°
• γ: 90°
• Cell volume: 3817.2 ± 1.3 ų
• Cell temperature: 185 ± 2 K
• Ambient diffraction temperature: 185 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0627
• Residual factor for significantly intense reflections: 0.0472
• Weighted residual factors for significantly intense reflections: 0.1177
• Weighted residual factors for all reflections included in the refinement: 0.1287
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No