Information card for entry 4111635

Structure parameters

• Formula: C24 H24 N O3 P
• Calculated formula: C24 H24 N O3 P
• SMILES: P(=O)([O-])(Oc1ccccc1)c1ccccc1.[NH3+][C@H](C)c1cccc2ccccc12
• Title of publication: Dual Memory of Enantiomeric Helices in a Polyacetylene Induced by a Single Enantiomer
• Authors of publication: Toyoharu Miyagawa; Akira Furuko; Katsuhiro Maeda; Hiroshi Katagiri; Yoshio Furusho; Eiji Yashima
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• Journal volume: 127
• Pages of publication: 5018 - 5019
• a: 12.5352 ± 0.0006 Å
• b: 6.4598 ± 0.0003 Å
• c: 14.2511 ± 0.0007 Å
• α: 90°
• β: 109.476 ± 0.001°
• γ: 90°
• Cell volume: 1087.95 ± 0.09 ų
• Cell temperature: 248 ± 2 K
• Ambient diffraction temperature: 248 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0405
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.1009
• Weighted residual factors for all reflections included in the refinement: 0.1024
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No