Information card for entry 4020192

Structure parameters

• Formula: C19 H29 N O5
• Calculated formula: C19 H29 N O5
• SMILES: C12([C@H]([C@@H](c3ccc(cc3)OC(C)(C)C)OC)N)OCC(CO1)(CO2)C
• Authors of publication: Darren B. Hansen; Xiaobo Wan; Patrick J. Carroll; Madeleine M. Joullié
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 3120 - 3126
• a: 11.253 ± 0.0014 Å
• b: 6.0225 ± 0.0007 Å
• c: 14.1891 ± 0.0018 Å
• α: 90°
• β: 95.661 ± 0.003°
• γ: 90°
• Cell volume: 956.9 ± 0.2 ų
• Cell temperature: 143 ± 1 K
• Ambient diffraction temperature: 143 ± 1 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
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No