Information card for entry 4331365

Structure parameters

• Formula: C88 H132 K3 O10
• Calculated formula: C88 H132 K3 O10
• SMILES: [O]1(CCCC1)[K][O]1CCCC1.[O]1(CCCC1)[K][O]1CCCC1.[O]1(CCCC1)[K][O]1CCCC1.[O-]c1c(C(c2cc(ccc2)C(c2c([O-])c(cc(c2)C(C)(C)C)C(C)(C)C)c2c([O-])c(cc(c2)C(C)(C)C)C(C)(C)C)c2c(O)c(cc(c2)C(C)(C)C)C(C)(C)C)cc(cc1C(C)(C)C)C(C)(C)C
• Title of publication: Synthesis and Characterization of Multi-Alkali-Metal Tetraphenolates and Application in Ring-Opening Polymerization of Lactide
• Authors of publication: Jinjin Zhang; Chunli Jian; Yuan Gao; Lei Wang; Ning Tang; Jincai Wu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 13380 - 13389
• a: 35.298 ± 0.009 Å
• b: 14.342 ± 0.004 Å
• c: 19.574 ± 0.005 Å
• α: 90°
• β: 106.594 ± 0.002°
• γ: 90°
• Cell volume: 9497 ± 4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.2214
• Residual factor for significantly intense reflections: 0.0826
• Weighted residual factors for significantly intense reflections: 0.1839
• Weighted residual factors for all reflections included in the refinement: 0.2548
• Goodness-of-fit parameter for all reflections included in the refinement: 0.947
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No