Information card for entry 7207879

Structure parameters

• Formula: C28 H32 Cd O9
• Calculated formula: C28 H32 Cd O9
• SMILES: c1cc2cc([C@H](C)C3=[O][Cd]4(O3)([OH2])([O]=C(O4)[C@H](c3cc4ccc(cc4cc3)OC)C)[OH2])ccc2cc1OC.O
• Title of publication: New homochiral ferroelectric supramolecular networks of complexes constructed by chiral S-naproxen ligand
• Authors of publication: Wang, Yong-Tao; Tang, Gui-Mei; Wan, Wen-Zhu; Wu, Yue; Tian, Ting-Cui; Wang, Jin-Hua; He, Chao; Long, Xi-Fa; Wang, Jun-Jie; Ng, Seik Weng
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 10
• Pages of publication: 3802
• a: 28.998 ± 0.012 Å
• b: 5.76 ± 0.002 Å
• c: 8.162 ± 0.003 Å
• α: 90°
• β: 92.364 ± 0.005°
• γ: 90°
• Cell volume: 1362.1 ± 0.9 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0518
• Residual factor for significantly intense reflections: 0.0436
• Weighted residual factors for significantly intense reflections: 0.0984
• Weighted residual factors for all reflections included in the refinement: 0.1064
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No