Information card for entry 2215707

Structure parameters

• Chemical name: (1-{(<i>E</i>)-2-[(2E,3Z)-4-Oxidopent-3-en-2- ylideneamino]ethyliminomethyl}naphthalen-2-olato)manganese(II) methanol solvate
• Formula: C19 H22 Mn N2 O3
• Calculated formula: C19 H22 Mn N2 O3
• SMILES: [Mn@@]123[N](=C(C=C(O2)C)C)CC[N]1=Cc1c(O3)ccc2c1cccc2.OC
• Title of publication: (1-{(<i>E</i>)-2-[(2<i>E</i>,3<i>Z</i>)-4-Oxidopent-3-en-2-ylideneamino]ethyliminomethyl}naphthalen-2-olato)manganese(II) methanol solvate
• Authors of publication: Xu, Bin; Ran, Jing-Wen; Li, Ya-Hong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 10
• Pages of publication: m2579 - m2579
• a: 7.38 ± 0.0016 Å
• b: 10.8935 ± 0.0014 Å
• c: 22.01 ± 0.02 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1769.5 ± 1.7 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1044
• Residual factor for significantly intense reflections: 0.0503
• Weighted residual factors for significantly intense reflections: 0.1218
• Weighted residual factors for all reflections included in the refinement: 0.1516
• Goodness-of-fit parameter for all reflections included in the refinement: 0.907
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes