Information card for entry 7156418

Structure parameters

• Formula: C10 H17 F3 N2 O8
• Calculated formula: C10 H17 F3 N2 O8
• Title of publication: Enantioselective synthesis of α-perfluoroalkylated prolines, their 6,7-membered homologues and derivatives.
• Authors of publication: Voznesenskaia, Natalia G.; Shmatova, Olga I.; Khrustalev, Victor N.; Nenajdenko, Valentine G.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2018
• Journal volume: 16
• Journal issue: 38
• Pages of publication: 7004 - 7011
• a: 9.7271 ± 0.0019 Å
• b: 7.2173 ± 0.0014 Å
• c: 11.15 ± 0.002 Å
• α: 90°
• β: 111.74 ± 0.03°
• γ: 90°
• Cell volume: 727.1 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0815
• Residual factor for significantly intense reflections: 0.0562
• Weighted residual factors for significantly intense reflections: 0.1165
• Weighted residual factors for all reflections included in the refinement: 0.1365
• Goodness-of-fit parameter for all reflections included in the refinement: 0.91
• Diffraction radiation wavelength: 0.9699 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No