Information card for entry 2203402

Structure parameters

• Chemical name: Dichloro-bis(1,10-phenanthroline)manganese(II) salicylaldoxime
• Formula: C31 H23 Cl2 Mn N5 O2
• Calculated formula: C31 H23 Cl2 Mn N5 O2
• SMILES: [Mn]12(Cl)(Cl)([n]3cccc4c3c3[n]1cccc3cc4)[n]1cccc3c1c1[n]2cccc1cc3.ON=Cc1ccccc1O
• Title of publication: Dichlorobis(1,10-phenanthroline)manganese(II)‒salicylaldoxime (1/1)
• Authors of publication: E Yang; Jian Zhang; Yu-Biao Chen; Yao Kang; Ye-Yan Qin; Zhaoji Li; Jian-Kai Cheng; Rui-Feng Hu; Yi-Hang Wen; Yuan-Gen Yao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 4
• Pages of publication: m390 - m391
• a: 10.7688 ± 0.0006 Å
• b: 10.8408 ± 0.0006 Å
• c: 13.3473 ± 0.0007 Å
• α: 89.032 ± 0.001°
• β: 66.477 ± 0.001°
• γ: 88.276 ± 0.001°
• Cell volume: 1428.04 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.105
• Weighted residual factors for all reflections included in the refinement: 0.1169
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes