Information card for entry 2007540

Structure parameters

• Formula: C18 H14 Br N O
• Calculated formula: C18 H14 Br N O
• SMILES: Brc1cc(C)ccc1/N=C/c1c2ccccc2ccc1O
• Title of publication: <i>N</i>-(2-Bromo-4-methylphenyl)naphthaldimine
• Authors of publication: Elmali, Ayhan; Elerman, Yalc̨in; Kendi̇, Engin
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 8
• Pages of publication: 1137 - 1139
• a: 6.1373 ± 0.0006 Å
• b: 8.979 ± 0.002 Å
• c: 13.3554 ± 0.001 Å
• α: 90°
• β: 96.88 ± 0.005°
• γ: 90°
• Cell volume: 730.67 ± 0.19 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.07
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for all reflections included in the refinement: 0.094
• Goodness-of-fit parameter for all reflections included in the refinement: 1.254
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No