Information card for entry 2022639

Structure parameters

• Chemical name: <i>N</i>,<i>N</i>'-(Cyclohexane-1,2-diylidene)bis(4-fluorobenzohydrazide) methanol monosolvate
• Formula: C21 H22 F2 N4 O3
• Calculated formula: C21 H22 F2 N4 O3
• SMILES: Fc1ccc(C(=O)N/N=C2\C(=N\NC(=O)c3ccc(F)cc3)CCCC2)cc1.OC
• Title of publication: Two new zinc(II) and mercury(II) complexes based on N,N'-(cyclohexane-1,2-diylidene)bis(4-fluorobenzohydrazide): synthesis, crystal structures and antibacterial activities
• Authors of publication: OmarAli, Al-Ameen Bariz; Al-Karawi, Ahmed Jasim M.; Awad, Adil A.; Dege, Necmi; Kansız, Sevgi; Agar, Erbil; Hussein, Zaman Ahmed; Mohammed, Iman Rajab
• Journal of publication: Acta Crystallographica, Section C: Structural Chemistry
• Year of publication: 2020
• Journal volume: 76
• Journal issue: 5
• Pages of publication: 476 - 482
• a: 7.5679 ± 0.0003 Å
• b: 15.25 ± 0.0007 Å
• c: 17.5264 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2022.73 ± 0.15 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0967
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.0953
• Weighted residual factors for all reflections included in the refinement: 0.111
• Goodness-of-fit parameter for all reflections included in the refinement: 0.964
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes