Information card for entry 7224626

Structure parameters

• Formula: C22 H21.18 N2 O2.59
• Calculated formula: C22 H21.178 N2 O2.589
• Title of publication: Homochiral crystal generation via sequential dehydration and Viedma ripening
• Authors of publication: Sivakumar, Reajean; Askari, Mohammad S.; Woo, Simon; Madwar, Carolin; Ottenwaelder, Xavier; Bohle, D. Scott; Cuccia, Louis A.
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 23
• Pages of publication: 4277
• a: 9.1639 ± 0.0009 Å
• b: 21.32 ± 0.002 Å
• c: 10.0007 ± 0.001 Å
• α: 90°
• β: 109.652 ± 0.001°
• γ: 90°
• Cell volume: 1840.1 ± 0.3 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0522
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.1025
• Weighted residual factors for all reflections included in the refinement: 0.1072
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No