Information card for entry 7130498

Structure parameters

• Formula: C30 H27 N O5
• Calculated formula: C30 H27 N O5
• Title of publication: A Triple Cascade Approach Towards Diastereoselective Synthesis of Spiro trans-decalinol Scaffolds
• Authors of publication: Settipalli, Poorna Chandrasekhar; Shaik, Anwar
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 12.039 ± 0.002 Å
• b: 18.483 ± 0.003 Å
• c: 22.273 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4956.1 ± 1.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0836
• Residual factor for significantly intense reflections: 0.0543
• Weighted residual factors for significantly intense reflections: 0.0989
• Weighted residual factors for all reflections included in the refinement: 0.11
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No