Information card for entry 7105499

Structure parameters

• Common name: TMBPZnCl
• Formula: C60 H44 Cl N3 Zn
• Calculated formula: C60 H44 Cl N3 Zn
• Title of publication: Construction of multidimensional nanostructures by self-assembly of a porphyrin analogue
• Authors of publication: Huang, Changshui; Li, Yuliang; Yang, Ji’en; Cheng, Nan; Liu, Huibiao; Li, Yongjun
• Journal of publication: Chemical Communications
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 18
• Pages of publication: 3161 - 3163
• a: 10.586 ± 0.002 Å
• b: 14.091 ± 0.003 Å
• c: 17.994 ± 0.004 Å
• α: 100.74 ± 0.03°
• β: 100.99 ± 0.03°
• γ: 106.8 ± 0.03°
• Cell volume: 2437.8 ± 1.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0748
• Residual factor for significantly intense reflections: 0.0653
• Weighted residual factors for significantly intense reflections: 0.1597
• Weighted residual factors for all reflections included in the refinement: 0.1673
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No