Information card for entry 7101630

Structure parameters

• Common name: (E)-1-((Z)-(4-methylphenyl)(phenylhydrazono)methyl)-2- phenyldiazene
• Chemical name: (E)-1-[(Z)-(4-methylphenyl)(phenylhydrazono)methyl]-2-phenyldiazene
• Formula: C20 H18 N4
• Calculated formula: C20 H18 N4
• SMILES: N(/Nc1ccccc1)=C(/N=N/c1ccccc1)c1ccc(cc1)C
• Title of publication: Formazans as beta-diketiminate analogues. Structural characterization of boratatetrazines and their reduction to borataverdazyl radical anions.
• Authors of publication: Gilroy, Joe B; Ferguson, Michael J; McDonald, Robert; Patrick, Brian O; Hicks, Robin G
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2006
• Journal issue: 2
• Pages of publication: 126 - 128
• a: 11.7762 ± 0.0008 Å
• b: 13.4272 ± 0.0009 Å
• c: 12.022 ± 0.0008 Å
• α: 90°
• β: 118.594 ± 0.0012°
• γ: 90°
• Cell volume: 1669.08 ± 0.19 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 3
• 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: 0.0742
• Residual factor for significantly intense reflections: 0.0503
• Weighted residual factors for significantly intense reflections: 0.1224
• Weighted residual factors for all reflections included in the refinement: 0.1364
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No