Information card for entry 2016836

Structure parameters

• Chemical name: (4-Aminopyridine-κN^1^)(phthalocyaninato-κ^4^N)zinc(II) tetrahydrofuran disolvate
• Formula: C45 H38 N10 O2 Zn
• Calculated formula: C45 H38 N10 O2 Zn
• Title of publication: (4-Aminopyridine-κ<i>N</i>^1^)(phthalocyaninato-κ^4^<i>N</i>)zinc(II) tetrahydrofuran disolvate
• Authors of publication: Yang, Feng-Ju; Fang, Xin; Yu, Hai-Yang; Wang, Jun-Dong
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 11
• Pages of publication: m375 - m377
• a: 13.5385 ± 0.0017 Å
• b: 15.0756 ± 0.0019 Å
• c: 19.224 ± 0.003 Å
• α: 90°
• β: 100.42 ± 0.003°
• γ: 90°
• Cell volume: 3858.9 ± 0.9 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: 0.047
• Residual factor for significantly intense reflections: 0.0438
• Weighted residual factors for significantly intense reflections: 0.1174
• Weighted residual factors for all reflections included in the refinement: 0.1208
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes