Information card for entry 2216776

Structure parameters

• Chemical name: [5,10,15,20-Tetrakis(4-methoxyphenyl)porphinato]zinc(II) tetrachloroethane solvate
• Formula: C50 H38 Cl4 N4 O4 Zn
• Calculated formula: C50 H38 Cl4 N4 O4 Zn
• Title of publication: [5,10,15,20-Tetrakis(4-methoxyphenyl)porphinato]zinc(II) 1,1,2,2-tetrachloroethane solvate
• Authors of publication: Puttaiah Bhyrappa; Karuppaiah Karunanithi; Babu Varghese
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 12
• Pages of publication: m3201 - m3202
• a: 14.3347 ± 0.0003 Å
• b: 9.6644 ± 0.0002 Å
• c: 15.6369 ± 0.0003 Å
• α: 90°
• β: 100.865 ± 0.001°
• γ: 90°
• Cell volume: 2127.45 ± 0.08 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0389
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.0896
• Weighted residual factors for all reflections included in the refinement: 0.0931
• 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: Yes
• Has Fobs: Yes