Information card for entry 7008129

Structure parameters

• Formula: C83 H63 N7 Zn
• Calculated formula: C83 H63 N7 Zn
• Title of publication: Porphyrin-triarylamine conjugates: strong electronic communication between triarylamine redox centers via the porphyrin dication.
• Authors of publication: Chang, Jung-Che; Ma, Chi-Juan; Lee, Gene-Hsiang; Peng, Shie-Ming; Yeh, Chen-Yu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 8
• Pages of publication: 1504 - 1508
• a: 7.0958 ± 0.0004 Å
• b: 14.3751 ± 0.0008 Å
• c: 15.7008 ± 0.001 Å
• α: 102.799 ± 0.003°
• β: 93.972 ± 0.004°
• γ: 94.086 ± 0.004°
• Cell volume: 1551.8 ± 0.16 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0768
• Residual factor for significantly intense reflections: 0.0503
• Weighted residual factors for significantly intense reflections: 0.1226
• Weighted residual factors for all reflections included in the refinement: 0.1396
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No