Information card for entry 4319329

Structure parameters

• Common name: [(Mes)2DAP]SnN3
• Formula: C23 H29 N5 Sn
• Calculated formula: C23 H29 N5 Sn
• SMILES: [Sn]1(N(C(=CC(=[N]1c1c(cc(cc1C)C)C)C)C)c1c(cc(cc1C)C)C)N=N#N
• Title of publication: Azido Derivatives of Germanium(II) and Tin(II): Syntheses and Characterization of [(Mes)2DAP]GeN3, [(Mes)2DAP]SnN3, and the Corresponding Chloro Analogues Featuring Heterocyclic Six-π-Electron Ring Systems (where [(Mes)2DAP] = {N(Mes)C(Me)}2CH)
• Authors of publication: Ashley E. Ayers; Thomas M. Klapötke; H. V. Rasika Dias
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 1000 - 1005
• a: 10.8207 ± 0.0011 Å
• b: 15.254 ± 0.002 Å
• c: 14.9234 ± 0.0016 Å
• α: 90°
• β: 108.285 ± 0.009°
• γ: 90°
• Cell volume: 2338.9 ± 0.5 ų
• Cell temperature: 228 ± 2 K
• Ambient diffraction temperature: 228 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0464
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.1077
• Weighted residual factors for all reflections included in the refinement: 0.1098
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No