Information card for entry 4511914

Structure parameters

• Formula: C30 H52 N4 O10 Sn2
• Calculated formula: C30 H52 N4 O10 Sn2
• SMILES: C(C(O[Sn]1(C(C)(C)C)([OH][Sn](OC(=O)CCN2C(=O)NC(=O)C=C2)([OH]1)(C(C)(C)C)C(C)(C)C)C(C)(C)C)=O)CN1C(=O)NC(=O)C=C1
• Title of publication: Multi-Uracil Arrays Built on Organostannoxane, Organotelluroxane, and Copper(II) Carboxylate Platforms. C‒H···O Interactions Leading to Tetrameric Uracil Motifs
• Authors of publication: Kundu, Subrata; Kumar, Jitendra; Kumar, Arun; Verma, Sandeep; Chandrasekhar, Vadapalli
• Journal of publication: Crystal Growth & Design
• Year of publication: 2014
• Journal volume: 14
• Journal issue: 10
• Pages of publication: 5171
• a: 9.1622 ± 0.0007 Å
• b: 19.9765 ± 0.0016 Å
• c: 10.0933 ± 0.0009 Å
• α: 90°
• β: 93.357 ± 0.002°
• γ: 90°
• Cell volume: 1844.2 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0525
• Residual factor for significantly intense reflections: 0.0486
• Weighted residual factors for significantly intense reflections: 0.1189
• Weighted residual factors for all reflections included in the refinement: 0.1225
• 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