Information card for entry 1551406

Structure parameters

• Common name: Gross95 (Zhenya)
• Formula: C39 H4 Cl4 F17 I4 N4 P
• Calculated formula: C39 H4 Cl4 F17 I4 N4 P
• Title of publication: Phosphorus Corrole Complexes: From Property Tuning to Applications in Photocatalysis and Triplet-Triplet Annihilation Upconversion
• Authors of publication: Gross, Zeev; Zhao, Jianzhang; Mahammed, Atif; Chen, Kepeng; Vestfrid, Jenya
• Journal of publication: Chemical Science
• Year of publication: 2019
• a: 17.243 ± 0.0013 Å
• b: 7.806 ± 0.005 Å
• c: 17.503 ± 0.003 Å
• α: 90°
• β: 110.42 ± 0.03°
• γ: 90°
• Cell volume: 2207.8 ± 1.5 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.1284
• Residual factor for significantly intense reflections: 0.1059
• Weighted residual factors for significantly intense reflections: 0.2335
• Weighted residual factors for all reflections included in the refinement: 0.2458
• Goodness-of-fit parameter for all reflections included in the refinement: 1.124
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No