Information card for entry 2220462

Structure parameters

• Chemical name: 1-(3-Phenylisoquinolin-1-yl)hydrazine
• Formula: C15 H13 N3
• Calculated formula: C15 H13 N3
• SMILES: NNc1nc(cc2c1cccc2)c1ccccc1
• Title of publication: 1-(3-Phenylisoquinolin-1-yl)hydrazine
• Authors of publication: Manivel, P.; Hathwar, Venkatesha R.; Nithya, P.; Prabakaran, K.; Khan, F. Nawaz
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 1
• Pages of publication: o137 - o138
• a: 6.672 ± 0.002 Å
• b: 13.825 ± 0.004 Å
• c: 14.934 ± 0.005 Å
• α: 63.836 ± 0.005°
• β: 86.895 ± 0.006°
• γ: 82.106 ± 0.005°
• Cell volume: 1224.6 ± 0.7 ų
• Cell temperature: 290 ± 2 K
• Ambient diffraction temperature: 290 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0847
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.1045
• Weighted residual factors for all reflections included in the refinement: 0.1163
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes