Information card for entry 7235297

Structure parameters

• Formula: C30 H34 Cl N2 O6 P
• Calculated formula: C30 H34 Cl N2 O6 P
• Title of publication: Regioselective asymmetric stereoablative O-alkylation of α-nitrophosphonates via o-azaxylylene intermediates generated in situ from 3-bromooxindoles
• Authors of publication: Xie, Xiaohua; Jing, Linhai; Qin, Dabin; He, Wujun; Wu, Song; Jin, Lunqiang; Luo, Gan
• Journal of publication: RSC Advances
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 23
• Pages of publication: 11605
• a: 10.109 ± 0.003 Å
• b: 20.659 ± 0.005 Å
• c: 14.446 ± 0.004 Å
• α: 90°
• β: 90.842 ± 0.006°
• γ: 90°
• Cell volume: 3016.6 ± 1.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1227
• Residual factor for significantly intense reflections: 0.0635
• Weighted residual factors for significantly intense reflections: 0.1297
• Weighted residual factors for all reflections included in the refinement: 0.1503
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No