Information card for entry 2240161

Structure parameters

• Chemical name: Dichlorido(2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')zinc
• Formula: C15 H11 Cl2 N3 Zn
• Calculated formula: C15 H11 Cl2 N3 Zn
• SMILES: [Zn]12(Cl)(Cl)[n]3c(cccc3)c3[n]1c(ccc3)c1[n]2cccc1
• Title of publication: Crystal structure of dichlorido(2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')zinc: a redetermination
• Authors of publication: Kong, Cheng-Cheng; Zhou, Jia-Zheng; Yu, Jian-Hua; Li, Sheng-Li
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 11
• Pages of publication: m382 - m383
• a: 10.95 ± 0.005 Å
• b: 8.25 ± 0.005 Å
• c: 16.216 ± 0.005 Å
• α: 90°
• β: 93.911 ± 0.005°
• γ: 90°
• Cell volume: 1461.5 ± 1.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• 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: 0.0215
• Residual factor for significantly intense reflections: 0.0196
• Weighted residual factors for significantly intense reflections: 0.055
• Weighted residual factors for all reflections included in the refinement: 0.056
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes