Information card for entry 2227541

Structure parameters

• Chemical name: 2-Phenylacetic acid‒3-{(<i>E</i>)-2-[(<i>E</i>)-pyridin-3-ylmethylidene]hydrazin-1- ylidenemethyl}pyridine (2/1)
• Formula: C28 H26 N4 O4
• Calculated formula: C28 H26 N4 O4
• SMILES: c1ccc(cn1)/C=N/N=C/c1cccnc1.OC(=O)Cc1ccccc1.OC(=O)Cc1ccccc1
• Title of publication: 2-Phenylacetic acid‒3-{(<i>E</i>)-2-[(<i>E</i>)-pyridin-3-ylmethylidene]hydrazin-1-ylidenemethyl}pyridine (2/1)
• Authors of publication: Arman, Hadi D.; Kaulgud, Trupta; Tiekink, Edward R. T.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 10
• Pages of publication: o2684
• a: 5.511 ± 0.002 Å
• b: 9.536 ± 0.004 Å
• c: 12.434 ± 0.006 Å
• α: 80.3 ± 0.02°
• β: 88.45 ± 0.03°
• γ: 76.46 ± 0.02°
• Cell volume: 626.1 ± 0.5 ų
• Cell temperature: 98 ± 2 K
• Ambient diffraction temperature: 98 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.056
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.124
• Weighted residual factors for all reflections included in the refinement: 0.13
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes