Information card for entry 8100786

Structure parameters

• Formula: C20 H23 N O
• Calculated formula: C20 H23 N O
• SMILES: N1(C(=O)c2c(C1)cccc2)c1c(cccc1C(C)C)C(C)C
• Title of publication: Crystal structure of 2-[2,6-bis(1-methylethyl)phenyl]-2,3-dihydro- 1H-isoindol-1-one, C~20~H~23~NO, at 193K
• Authors of publication: Polamo, Mika; Hämäläinen, Markku
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2002
• Journal volume: 217
• Journal issue: 4
• Pages of publication: 561 - 562
• a: 18.402 ± 0.004 Å
• b: 14.897 ± 0.003 Å
• c: 12.318 ± 0.003 Å
• α: 90°
• β: 95.09 ± 0.03°
• γ: 90°
• Cell volume: 3363.5 ± 1.1 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No