Information card for entry 2234927

Structure parameters

• Chemical name: {5,10,15,20-Tetrakis[4-(hexyloxy)phenyl]porphyrinato}nickel(II)
• Formula: C68 H76 N4 Ni O4
• Calculated formula: C68 H76 N4 Ni O4
• Title of publication: {5,10,15,20-Tetrakis[4-(hexyloxy)phenyl]porphyrinato}nickel(II)
• Authors of publication: Wang, Yu-Fang; Zhao, Hong-Bin; Chen, Liang; Yang, De-Liang; Wang, Bang-Ying
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 6
• Pages of publication: m814
• a: 18.7735 ± 0.001 Å
• b: 10.8439 ± 0.0006 Å
• c: 28.7173 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5846.2 ± 0.6 ų
• Cell temperature: 185 ± 2 K
• Ambient diffraction temperature: 185 ± 2 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0751
• Residual factor for significantly intense reflections: 0.0558
• Weighted residual factors for significantly intense reflections: 0.1408
• Weighted residual factors for all reflections included in the refinement: 0.156
• 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: Yes
• Has Fobs: Yes