Information card for entry 2215340

Structure parameters

• Chemical name: 4-Fluorobenzaldehyde [(E)-4-fluorobenzylidene]hydrazone
• Formula: C14 H10 F2 N2
• Calculated formula: C14 H10 F2 N2
• SMILES: Fc1ccc(cc1)/C=N/N=C/c1ccc(cc1)F
• Title of publication: 4-Fluorobenzaldehyde [(<i>E</i>)-4-fluorobenzylidene]hydrazone
• Authors of publication: Odabaşoğlu, Mustafa; Büyükgüngör, Orhan; K. Sunil; B. Narayana
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 10
• Pages of publication: o4145 - o4146
• a: 3.8488 ± 0.0018 Å
• b: 13.629 ± 0.005 Å
• c: 11.083 ± 0.005 Å
• α: 90°
• β: 93.17 ± 0.04°
• γ: 90°
• Cell volume: 580.5 ± 0.4 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0679
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for significantly intense reflections: 0.1298
• Weighted residual factors for all reflections included in the refinement: 0.1427
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes