Information card for entry 2003327

Structure parameters

• Chemical name: carbonic dihydrazide, bis(3-fluorophenylmethylene)-
• Formula: C15 H12 F2 N4 O
• Calculated formula: C15 H12 F2 N4 O
• SMILES: O=C(N/N=C/c1cccc(c1)F)N/N=C/c1cccc(c1)F
• Title of publication: Dimeric Hydrogen-Bonded Structure of Bis(3-fluorophenylmethine)carbonohydrazide
• Authors of publication: Meyers, C. Y.; Kolb, V. M.; Robinson, P. D.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 4
• Pages of publication: 775 - 777
• a: 7.805 ± 0.001 Å
• b: 15.157 ± 0.002 Å
• c: 6.094 ± 0.001 Å
• α: 100.9 ± 0.01°
• β: 92.99 ± 0.01°
• γ: 86.71 ± 0.01°
• Cell volume: 706.12 ± 0.18 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for significantly intense reflections: 0.051
• Goodness-of-fit parameter for significantly intense reflections: 1.92
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No