Information card for entry 7223984

Structure parameters

• Formula: C60 H24 N8 O8 Zn3
• Calculated formula: C60 H24 N8 O8 Zn3
• Title of publication: Control of local structures and photophysical properties of zinc porphyrin-based supramolecular assemblies structurally organized by regioselective ligand coordination.
• Authors of publication: Sakuma, Takao; Sakai, Hayato; Araki, Yasuyuki; Wada, Takehiko; Hasobe, Taku
• Journal of publication: Physical chemistry chemical physics : PCCP
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 7
• Pages of publication: 5453 - 5463
• a: 16.679 ± 0.003 Å
• b: 16.679 ± 0.003 Å
• c: 17.674 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4916.7 ± 1.5 ų
• Cell temperature: 103 K
• Ambient diffraction temperature: 103 K
• Number of distinct elements: 5
• Space group number: 139
• Hermann-Mauguin space group symbol: I 4/m m m
• Hall space group symbol: -I 4 2
• Residual factor for significantly intense reflections: 0.0889
• Weighted residual factors for all reflections included in the refinement: 0.2511
• Goodness-of-fit parameter for all reflections included in the refinement: 1.14
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No