Information card for entry 4339998

Structure parameters

• Formula: C43 H23 F15 N4 Sn
• Calculated formula: C43 H23 F15 N4 Sn
• SMILES: [Sn]123([n]4c5ccc4=C(c4n1c(cc4)c1n2c(cc1)C(=c1n3c(cc1)=C5c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F)C.CCCCC
• Title of publication: Synthesis and Reactivity Studies of a Tin(II) Corrole Complex.
• Authors of publication: Yun, Lin; Vazquez-Lima, Hugo; Fang, Huayi; Yao, Zhengmin; Geisberger, Georg; Dietl, Christian; Ghosh, Abhik; Brothers, Penelope J.; Fu, Xuefeng
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 13
• Pages of publication: 7047 - 7054
• a: 14.946 ± 0.003 Å
• b: 9.5085 ± 0.0004 Å
• c: 15.1008 ± 0.0009 Å
• α: 90°
• β: 115.749 ± 0.002°
• γ: 90°
• Cell volume: 1932.9 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0306
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0742
• Weighted residual factors for all reflections included in the refinement: 0.0747
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No