Information card for entry 2200080

Structure parameters

• Chemical name: (E)-1-(2-Thienyl)ethanone 8-quinolylhydrozone
• Formula: C15 H13 N3 S
• Calculated formula: C15 H13 N3 S
• SMILES: n1cccc2cccc(c12)N\N=C(C)\c1sccc1
• Title of publication: (<i>E</i>)-1-(2-Thienyl)ethanone 8-quinolylhydrozone
• Authors of publication: Lynch, Daniel E.; McClenaghan, Ian
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 1
• Pages of publication: o52 - o53
• a: 10.148 ± 0.002 Å
• b: 14.251 ± 0.003 Å
• c: 18.103 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2618 ± 1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.15
• Residual factor for significantly intense reflections: 0.061
• Weighted residual factors for all reflections included in the refinement: 0.17
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes