Information card for entry 2232497

Structure parameters

• Chemical name: (2-Carbamoylethyl-κ^2^<i>C</i>^1^,<i>O</i>)triiodidotin(IV)
• Formula: C3 H6 I3 N O Sn
• Calculated formula: C3 H6 I3 N O Sn
• SMILES: [Sn]1(I)(I)(I)[O]=C(N)CC1
• Title of publication: (2-Carbamoylethyl-κ^2^<i>C</i>^1^,<i>O</i>)triiodidotin(IV)
• Authors of publication: de Lima, Geraldo M.; Tiekink, Edward R. T.; Wardell, James L.; Wardell, Solange M. S. V.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 11
• Pages of publication: m1536 - m1537
• a: 7.853 ± 0.0001 Å
• b: 10.6264 ± 0.0001 Å
• c: 14.125 ± 0.0002 Å
• α: 98.801 ± 0.001°
• β: 105.523 ± 0.001°
• γ: 102.383 ± 0.001°
• Cell volume: 1081.23 ± 0.02 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0279
• Residual factor for significantly intense reflections: 0.0273
• Weighted residual factors for significantly intense reflections: 0.0784
• Weighted residual factors for all reflections included in the refinement: 0.0788
• Goodness-of-fit parameter for all reflections included in the refinement: 1.118
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes