Information card for entry 2007314

Structure parameters

• Chemical name: N-(tert-Butoxycarbonyl)-3-Amino-4-(Trimethylstannyl)pyridine
• Formula: C13 H22 N2 O2 Sn
• Calculated formula: C13 H22 N2 O2 Sn
• SMILES: [Sn](C)(C)(C)c1c(NC(=O)OC(C)(C)C)cncc1
• Title of publication: [3-(<i>tert</i>-Butoxycarbonylamino)-4-pyridyl]trimethyltin(IV), a Tetraorganotin Compound Containing an Unexpected Intramolecular Sn···O Interaction
• Authors of publication: Crous, Renier; Holzapfel, Cedric W.; Kruger, Gert J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 6
• Pages of publication: 760 - 762
• a: 8.7829 ± 0.0007 Å
• b: 9.622 ± 0.002 Å
• c: 9.8535 ± 0.0011 Å
• α: 90°
• β: 92.948 ± 0.008°
• γ: 90°
• Cell volume: 831.6 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0278
• Residual factor for significantly intense reflections: 0.0269
• Weighted residual factors for all reflections included in the refinement: 0.0691
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No