Information card for entry 1557870

Structure parameters

• Formula: C26 H25 Cl8 N O4 Sb
• Calculated formula: C26 H25 Cl8 N O4 Sb
• SMILES: [Sb](Cl)(Cl)([Cl-])(Cl)(Cl)Cl.Clc1ccc(cc1)N(c1c(cc(C(C)(C)C)cc1C(=O)OC)C(=O)OC)c1ccc(cc1)Cl
• Title of publication: Synthesis and properties of hypervalent electron-rich pentacoordinate nitrogen compounds
• Authors of publication: Yan, Chenting; Takeshita, Masato; Nakatsuji, Jun-ya; Kurosaki, Akihiro; Sato, Kaoko; Shang, Rong; Nakamoto, Masaaki; Yamamoto, Yohsuke; Adachi, Yohei; Furukawa, Ko; Kishi, Ryohei; Nakano, Masayoshi
• Journal of publication: Chemical Science
• Year of publication: 2020
• Journal volume: 11
• Journal issue: 19
• Pages of publication: 5082 - 5088
• a: 11.6398 ± 0.0008 Å
• b: 18.4868 ± 0.0013 Å
• c: 16.2027 ± 0.0011 Å
• α: 90°
• β: 109.07 ± 0.003°
• γ: 90°
• Cell volume: 3295.2 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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: 0.0338
• Residual factor for significantly intense reflections: 0.0312
• Weighted residual factors for significantly intense reflections: 0.0781
• Weighted residual factors for all reflections included in the refinement: 0.08
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No