Information card for entry 8100991

Structure parameters

• Formula: C14 H21 N O Si
• Calculated formula: C14 H21 N O Si
• SMILES: [Si]([C@@H]1[C@@H]2N(C2)c2c(C[C@@H]1O)cccc2)(C)(C)C.[Si]([C@H]1[C@H]2N(C2)c2c(C[C@H]1O)cccc2)(C)(C)C
• Title of publication: Crystal structure of (1aS,2S,3R)-2-trimethylsilyl-1a,2,3,4-tetrahydro- 1H-8b-aza-benzo[a]cyclopropa[c]cyclohepten-3-ol, C~14~H~21~NOSi
• Authors of publication: Ducray, Richard; Grosvalet, Laurent; Ciufolini, Marco A.; Perrin, Monique
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2001
• Journal volume: 216
• Journal issue: 3
• Pages of publication: 349 - 350
• a: 10.36 ± 0.002 Å
• b: 9.0597 ± 0.0018 Å
• c: 15.511 ± 0.003 Å
• α: 90°
• β: 101.12 ± 0.03°
• γ: 90°
• Cell volume: 1428.4 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No