Information card for entry 2227955

Structure parameters

• Chemical name: <i>N</i>^2^,<i>N</i>^2'^-Bis[4-(dimethylamino)benzylidene]pyridine-2,6- dicarbohydrazide monohydrate
• Formula: C25 H29 N7 O3
• Calculated formula: C25 H29 N7 O3
• SMILES: CN(c1ccc(cc1)/C=N/NC(=O)c1cccc(n1)C(=O)N/N=C/c1ccc(cc1)N(C)C)C.O
• Title of publication: <i>N</i>^2^,<i>N</i>^2'^-Bis[4-(dimethylamino)benzylidene]pyridine-2,6-dicarbohydrazide monohydrate
• Authors of publication: Wang, Yong; Sun, Yan Liang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 11
• Pages of publication: o2718
• a: 8.5718 ± 0.0011 Å
• b: 10.2802 ± 0.0014 Å
• c: 27.112 ± 0.003 Å
• α: 90°
• β: 97.865 ± 0.001°
• γ: 90°
• Cell volume: 2366.6 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0948
• Residual factor for significantly intense reflections: 0.0621
• Weighted residual factors for significantly intense reflections: 0.1866
• Weighted residual factors for all reflections included in the refinement: 0.2039
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes