Information card for entry 2234967

Structure parameters

• Chemical name: (<i>E</i>)-<i>N</i>'-Hydroxy-1,3-diphenyl-4,5-dihydro-1<i>H</i>-pyrazole-5- carboximidamide
• Formula: C16 H16 N4 O
• Calculated formula: C16 H16 N4 O
• SMILES: O/N=C(N)/C1N(N=C(C1)c1ccccc1)c1ccccc1
• Title of publication: (<i>E</i>)-<i>N</i>'-Hydroxy-1,3-diphenyl-4,5-dihydro-1<i>H</i>-pyrazole-5-carboximidamide
• Authors of publication: Chandra; Srikantamurthy, N.; Umesha, K. B.; Jeyaseelan, S.; Mahendra, M.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 6
• Pages of publication: o1661 - o1662
• a: 7.845 ± 0.011 Å
• b: 8.94 ± 0.012 Å
• c: 11.116 ± 0.015 Å
• α: 99.5 ± 0.02°
• β: 99.76 ± 0.02°
• γ: 106.7 ± 0.02°
• Cell volume: 716.8 ± 1.7 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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: 0.0697
• Residual factor for significantly intense reflections: 0.0534
• Weighted residual factors for significantly intense reflections: 0.1539
• Weighted residual factors for all reflections included in the refinement: 0.172
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes