Information card for entry 8100487

Structure parameters

• Formula: C17 H19 Cl N2
• Calculated formula: C17 H19 Cl N2
• SMILES: Clc1ccc([C@H](N2CCNCC2)c2ccccc2)cc1
• Title of publication: Crystal structure of 1-[(4-chloro-phenyl)-phenyl-methyl]piperazine, C~17~H~19~ClN~2~
• Authors of publication: Hu, Xiu-Rong; Gu, Jian-Ming; Lu, Guang-Lie
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2003
• Journal volume: 218
• Journal issue: 4
• Pages of publication: 497 - 498
• a: 18.092 ± 0.0001 Å
• b: 5.8896 ± 0.0001 Å
• c: 14.6011 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1555.82 ± 0.04 ų
• Cell temperature: 298.1 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No