Information card for entry 7117801

Structure parameters

• Common name: Zinc porphyrin complex
• Chemical name: {5,10-Bis[3,5-di(tert-butyl)phenyl]-15,20-bis(4'-cyanobiphenyl-4-yl)porphyrinato}zinc(II)
• Formula: C149 H135 Cl3 N12 O Zn2
• Calculated formula: C149 H135 Cl3 N12 O Zn2
• Title of publication: Heat-induced formation of one-dimensional coordination polymers on Au(111): an STM study
• Authors of publication: Tuan Anh Pham; Fei Song; Mariza N. Alberti; Manh-Thuong Nguyen; Nils Trapp; Carlo Thilgen; Francois Diederich; Meike Stohr
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 14473
• a: 12.1388 ± 0.0012 Å
• b: 21.415 ± 0.002 Å
• c: 25.499 ± 0.003 Å
• α: 83.635 ± 0.002°
• β: 80.874 ± 0.002°
• γ: 83.613 ± 0.002°
• Cell volume: 6474.6 ± 1.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 ± 0.2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1008
• Residual factor for significantly intense reflections: 0.0604
• Weighted residual factors for significantly intense reflections: 0.1536
• Weighted residual factors for all reflections included in the refinement: 0.1679
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No