Information card for entry 7230819

Structure parameters

• Formula: C78 H76 N6 O12 Zn
• Calculated formula: C78 H76 N6 O12 Zn
• Title of publication: Tetrakis(ethyl-4(4-butyryl)oxyphenyl)porphyrinato zinc complexes with 4,4′-bpyridin: synthesis, characterization, and its catalytic degradation of Calmagite
• Authors of publication: Soury, Raoudha; Jabli, Mahjoub; Saleh, Tawfik A.; Abdul-Hassan, Wathiq Sattar; Saint-Aman, Eric; Loiseau, Frédérique; Philouze, Christian; Nasri, Habib
• Journal of publication: RSC Advances
• Year of publication: 2018
• Journal volume: 8
• Journal issue: 36
• Pages of publication: 20143
• a: 25.89 ± 0.005 Å
• b: 18.024 ± 0.005 Å
• c: 18.699 ± 0.005 Å
• α: 90°
• β: 127.821 ± 0.005°
• γ: 90°
• Cell volume: 6893 ± 3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.113
• Residual factor for significantly intense reflections: 0.0798
• Weighted residual factors for significantly intense reflections: 0.2129
• Weighted residual factors for all reflections included in the refinement: 0.2634
• Goodness-of-fit parameter for all reflections included in the refinement: 1.119
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No