Information card for entry 2225391

Structure parameters

• Chemical name: Dichlorido(2,4,6-tri-2-pyridyl-1,3,5-triazine)manganese(II)
• Formula: C18 H12 Cl2 Mn N6
• Calculated formula: C18 H12 Cl2 Mn N6
• SMILES: [Mn]12(Cl)(Cl)[n]3c(nc(nc3c3[n]2cccc3)c2ncccc2)c2[n]1cccc2
• Title of publication: Dichlorido(2,4,6-tri-2-pyridyl-1,3,5-triazine)manganese(II)
• Authors of publication: Ha, Kwang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 3
• Pages of publication: m262
• a: 8.8247 ± 0.0007 Å
• b: 10.5538 ± 0.0009 Å
• c: 10.9635 ± 0.0009 Å
• α: 66.572 ± 0.002°
• β: 75.812 ± 0.002°
• γ: 82.867 ± 0.002°
• Cell volume: 907.91 ± 0.13 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.149
• Residual factor for significantly intense reflections: 0.061
• Weighted residual factors for significantly intense reflections: 0.111
• Weighted residual factors for all reflections included in the refinement: 0.163
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes