Information card for entry 2001735

Structure parameters

• Formula: C12 H12 N2
• Calculated formula: C12 H12 N2
• SMILES: Cc1cnccc1c1ccncc1C
• Title of publication: 3,3'-Dimethyl-4,4'-bipyridine and 5,5'-dimethyl-4,4'-bipyrimidine
• Authors of publication: Gourdon, A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 5
• Pages of publication: 1011 - 1013
• a: 7.492 ± 0.003 Å
• b: 7.505 ± 0.005 Å
• c: 9.502 ± 0.003 Å
• α: 90°
• β: 109.02 ± 0.03°
• γ: 90°
• Cell volume: 505.1 ± 0.4 ų
• Cell temperature: 300 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.043
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No