Information card for entry 5000129

Structure parameters

• Formula: C27 H32 I N3 O4
• Calculated formula: C13.5 H15.5 I0.5 N1.5 O1.5
• Title of publication: Molecular Structure of LSD
• Authors of publication: Baker, R. W.; Chothia, C.; Pauling, P.; Weber, H. P.
• Journal of publication: Science
• Year of publication: 1972
• Journal volume: 178
• Journal issue: 4061
• Pages of publication: 614 - 615
• a: 14.21 ± 0.02 Å
• b: 7.65 ± 0.01 Å
• c: 13.24 ± 0.02 Å
• α: 90°
• β: 115.53 ± 0.05°
• γ: 90°
• Cell volume: 1298.74 ų
• Number of distinct elements: 5
• 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