Information card for entry 7243841

Structure parameters

• Formula: C16 H25 O4 P
• Calculated formula: C16 H25 O4 P
• SMILES: [P+](CC)(CC)(CC)CC.O=C([O-])c1cc(ccc1)C(=O)O
• Title of publication: Latency control of chemical reactions in polymerization of epoxy resins using a hydrogen bonding network
• Authors of publication: Haneda, Tsuyoshi; Matsuno, Shinya; Yamamoto, Hisanao; Ohtsu, Hiroyoshi; Kawano, Masaki
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 44
• Pages of publication: 7717 - 7719
• a: 15.9106 ± 0.0005 Å
• b: 14.2542 ± 0.0004 Å
• c: 15.9668 ± 0.0005 Å
• α: 90°
• β: 95.032 ± 0.007°
• γ: 90°
• Cell volume: 3607.2 ± 0.19 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0815
• Residual factor for significantly intense reflections: 0.0598
• Weighted residual factors for significantly intense reflections: 0.1823
• Weighted residual factors for all reflections included in the refinement: 0.2064
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No