Information card for entry 2236342

Structure parameters

• Chemical name: Trichlorido(4,4'-dimethyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')(methanol- κ<i>O</i>)indium(III) methanol monosolvate
• Formula: C14 H20 Cl3 In N2 O2
• Calculated formula: C14 H20 Cl3 In N2 O2
• SMILES: [In]1([n]2c(c3cc(cc[n]13)C)cc(C)cc2)([OH]C)(Cl)(Cl)Cl.CO
• Title of publication: Trichlorido(4,4'-dimethyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')(methanol-κ<i>O</i>)indium(III) methanol monosolvate
• Authors of publication: Shirvan, Sadif A.; Haydari Dezfuli, Sara
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 9
• Pages of publication: m1189 - m1190
• a: 12.0318 ± 0.0006 Å
• b: 10.3751 ± 0.0004 Å
• c: 15.2626 ± 0.0007 Å
• α: 90°
• β: 91.981 ± 0.004°
• γ: 90°
• Cell volume: 1904.11 ± 0.15 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0475
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for significantly intense reflections: 0.0987
• Weighted residual factors for all reflections included in the refinement: 0.102
• 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