Information card for entry 7248177

Structure parameters

• Formula: C37 H12 F10 N5 O2 Sb
• Calculated formula: C37 H12 F10 N5 O2 Sb
• SMILES: [Sb]123[n]4c5ccc4C(c4cc(N(=O)=O)ccc4)=c4n2c(=C(c2n3c(c3n1c(C=5c1c(F)c(F)c(F)c(F)c1F)cc3)cc2)c1c(F)c(F)c(F)c(F)c1F)cc4
• Title of publication: First application of antimony(iii) corrole for electrocatalytic hydrogen evolution
• Authors of publication: Yan, Qiao-Wei; Wu, Ling-Wei; Liu, Zhen-Wu; Chen, Feng; Ling, Chen; Liu, Hai-Yang; Xiao, Xin-Yan; Si, Li-Ping
• Journal of publication: Green Chemistry
• Year of publication: 2024
• Journal volume: 26
• Journal issue: 8
• Pages of publication: 4574 - 4581
• a: 14.088 ± 0.0004 Å
• b: 7.8247 ± 0.0002 Å
• c: 30.2785 ± 0.0009 Å
• α: 90°
• β: 102.717 ± 0.001°
• γ: 90°
• Cell volume: 3255.85 ± 0.16 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.105
• Residual factor for significantly intense reflections: 0.0875
• Weighted residual factors for significantly intense reflections: 0.2398
• Weighted residual factors for all reflections included in the refinement: 0.2634
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No