Information card for entry 2005424

Structure parameters

• Formula: C10 H14 N6
• Calculated formula: C10 H14 N6
• SMILES: CN(/C=N/C(=C(C#N)\N=C\N(C)C)C#N)C
• Title of publication: (1<i>E</i>,3<i>Z</i>,5<i>E</i>)-2,5-Diaza-1,6-bis(dimethylamino)-1,3,5-hexatriene-3,4-dicarbonitrile
• Authors of publication: Küçükbay, H.; Çetinkaya, E.; Ülkü, D.; Tahir, M. N.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 9
• Pages of publication: 2271 - 2272
• a: 7.671 ± 0.001 Å
• b: 20.414 ± 0.002 Å
• c: 8.326 ± 0.002 Å
• α: 90°
• β: 112.39 ± 0.02°
• γ: 90°
• Cell volume: 1205.5 ± 0.4 ų
• Cell temperature: 295 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.043
• Goodness-of-fit parameter for significantly intense reflections: 0.76
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No