Information card for entry 2216609

Structure parameters

• Chemical name: {2,6-Bis[1-(phenylimino)ethyl]pyridine}dichloridomanganese(II) dichloromethane hemisolvate
• Formula: C21.5 H20 Cl3 Mn N3
• Calculated formula: C21.5 H20 Cl3 Mn N3
• SMILES: [Mn]12(Cl)(Cl)[N](c3ccccc3)=C(C)c3[n]1c(ccc3)C(=[N]2c1ccccc1)C.ClCCl
• Title of publication: {2,6-Bis[1-(phenylimino)ethyl]pyridine}dichloridomanganese(II) dichloromethane hemisolvate
• Authors of publication: Meng-Ping Guo; Gui-Quan Guo; Hui-Rui Guo; Di-Chang Zhong; Wei-Qiang Zhou
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 12
• Pages of publication: m3025 - m3026
• a: 9.007 ± 0.002 Å
• b: 12.834 ± 0.003 Å
• c: 20.139 ± 0.005 Å
• α: 79.582 ± 0.016°
• β: 79.23 ± 0.016°
• γ: 86.698 ± 0.016°
• Cell volume: 2248.6 ± 0.9 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0916
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.1024
• Weighted residual factors for all reflections included in the refinement: 0.1208
• Goodness-of-fit parameter for all reflections included in the refinement: 0.996
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes