Information card for entry 2016769

Structure parameters

• Chemical name: <i>cis</i>-Dichloridobis(1,10-phenanthroline-5,6-diol- κ^2^<i>N</i>,<i>N</i>')manganese(II)
• Formula: C24 H16 Cl2 Mn N4 O4
• Calculated formula: C24 H16 Cl2 Mn N4 O4
• SMILES: Oc1c2ccc[n]3c2c2c(c1O)ccc[n]2[Mn]13(Cl)(Cl)[n]2cccc3c2c2[n]1cccc2c(c3O)O
• Title of publication: <i>cis</i>-Dichloridobis(1,10-phenanthroline-5,6-diol-κ^2^<i>N</i>,<i>N</i>')manganese(II): a supramolecular chain formed <i>via</i> O—H···Cl bonds and aromatic stacking
• Authors of publication: Guan, Xiao-Hong; Wu, Jian-Zhong; Yu, Ying; Yang, Ping
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 9
• Pages of publication: m311 - m313
• a: 8.5272 ± 0.0002 Å
• b: 14.4503 ± 0.0004 Å
• c: 18.1776 ± 0.0005 Å
• α: 90°
• β: 101.777 ± 0.002°
• γ: 90°
• Cell volume: 2192.7 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0339
• Residual factor for significantly intense reflections: 0.0305
• Weighted residual factors for significantly intense reflections: 0.0797
• Weighted residual factors for all reflections included in the refinement: 0.0819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes