Information card for entry 8100617

Structure parameters

• Formula: C15 H13 Cl N2 S
• Calculated formula: C15 H13 Cl N2 S
• SMILES: Clc1c2c(nc3c1CCCC3)ccc1nc(sc21)C
• Title of publication: Crystal structure of 11-chloro-2-methyl-7,8,9,10-tetrahydro[1,3]thiazolo- [5,4-a]acridine, C~15~H~13~ClN~2~S
• Authors of publication: Robin, M.; Galy, J.-P.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2002
• Journal volume: 217
• Journal issue: 2
• Pages of publication: 233 - 234
• a: 10.225 ± 0.001 Å
• b: 11.484 ± 0.0009 Å
• c: 12.019 ± 0.001 Å
• α: 96.732 ± 0.005°
• β: 99.616 ± 0.004°
• γ: 102.884 ± 0.004°
• Cell volume: 1338.8 ± 0.2 ų
• Cell temperature: 298 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Goodness-of-fit parameter for significantly intense reflections: 1.332
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No