Information card for entry 7203825

Structure parameters

• Formula: C62 H138 N2 O28 S2 Sn12
• Calculated formula: C62 H132 N2 O28 S2 Sn12
• SMILES: C(C(C)(C)NC(=O)C=C)S(=O)(=O)[O-].[O]12[Sn]34(CCCC)[O]5[Sn]671(CCCC)[O]1[Sn]89([O]%10[Sn]%112(CCCC)[O]3[Sn]23%12([O]%13[Sn]%14%15([O]%16[Sn]%17([O]%14[Sn]%10([O]9%17)(CCCC)[O]%11%12)([O]9[Sn]%10%16([O]%11[Sn]5([O]4[Sn]%13%11(O%15)(O2)CCCC)(CCCC)[O]%10[Sn]19(O8)(O7)CCCC)CCCC)CCCC)(O3)CCCC)CCCC)(O6)CCCC.C(C(C)(C)NC(=O)C=C)S(=O)(=O)[O-]
• Title of publication: Poly[{(BuSn)12O14(OH)6}(AMPS)2] and poly[methyl acrylate-co-{(BuSn)12O14(OH)6}(AMPS)2]: hybrid polymers cross-linked through electrostatic interactions
• Authors of publication: Ribot, François; Veautier, Delphine; Guillaudeu, Steven J.; Lalot, Thierry
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2005
• Journal volume: 15
• Journal issue: 35-36
• Pages of publication: 3973
• a: 35.505 ± 0.008 Å
• b: 35.505 ± 0.008 Å
• c: 15.724 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 19822 ± 8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0822
• Residual factor for significantly intense reflections: 0.0611
• Weighted residual factors for significantly intense reflections: 0.1205
• Weighted residual factors for all reflections included in the refinement: 0.1581
• Goodness-of-fit parameter for all reflections included in the refinement: 0.983
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No