Information card for entry 1100531

Structure parameters

• Formula: C16 H19 N O2
• Calculated formula: C16 H19 N O2
• SMILES: N12C(=O)OC([C@@H]1[C@H]1C[C@@H]([C@H]1C2)c1ccccc1)(C)C.N12C(=O)OC([C@H]1[C@@H]1C[C@H]([C@@H]1C2)c1ccccc1)(C)C
• Title of publication: Facial diastereoselectivity in the [2+2]-photocycloaddition of chiral vinylglycine-derived N,N-diallyl amines
• Authors of publication: Bach, Thorsten; Pelkmann, Christa; Harms, Klaus
• Journal of publication: Tetrahedron Letters
• Year of publication: 1999
• Journal volume: 40
• Journal issue: 11
• Pages of publication: 2103 - 2104
• a: 5.9874 ± 0.001 Å
• b: 17.461 ± 0.002 Å
• c: 12.965 ± 0.002 Å
• α: 90°
• β: 95.339 ± 0.016°
• γ: 90°
• Cell volume: 1349.56 ų
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No