Information card for entry 2215356

Structure parameters

• Formula: C24 H26 N2 O7
• Calculated formula: C24 H26 N2 O7
• SMILES: O1Cc2c([C@](OC(=O)N[C@@H](C)c3ccccc3)(C1=O)CC)cc1n(CCC31OCCO3)c2=O
• Title of publication: (4'<i>S</i>)-4'-Ethyl-3',10'-dioxo-3',4',7',8'-tetrahydrospiro[1,3-dioxolane-2,6'-1'<i>H</i>,6'<i>H</i>-pyrano[3,4-<i>f</i>]indolizin]-4'-yl <i>N</i>-(1-phenylethyl)carbamate
• Authors of publication: Yong Bao; Fen-Er Chen; Min-Qin Chen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 10
• Pages of publication: o3941 - o3941
• a: 7.3998 ± 0.001 Å
• b: 16.383 ± 0.002 Å
• c: 9.2162 ± 0.0013 Å
• α: 90°
• β: 92.322 ± 0.002°
• γ: 90°
• Cell volume: 1116.4 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0399
• Residual factor for significantly intense reflections: 0.0344
• Weighted residual factors for significantly intense reflections: 0.0837
• Weighted residual factors for all reflections included in the refinement: 0.0872
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes