Information card for entry 7050824

Structure parameters

• Formula: C14 H14 N4
• Calculated formula: C14 H14 N4
• SMILES: n1ccccc1/C(=N/N=C(c1ncccc1)\C)C
• Title of publication: The synthesis and structural characterisation of helical silver(i) complexes with short bis(pyridylimine) ligands
• Authors of publication: Dong, Guo; Cheng, He; Chun-Ying, Duan; Chun-Qi, Qian; Qing-Jin, Meng
• Journal of publication: New Journal of Chemistry
• Year of publication: 2002
• Journal volume: 26
• Journal issue: 6
• Pages of publication: 796
• a: 8.5633 ± 0.0009 Å
• b: 18.779 ± 0.002 Å
• c: 24.041 ± 0.003 Å
• α: 90°
• β: 96.154 ± 0.002°
• γ: 90°
• Cell volume: 3843.8 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0937
• Residual factor for significantly intense reflections: 0.0628
• Weighted residual factors for significantly intense reflections: 0.1573
• Weighted residual factors for all reflections included in the refinement: 0.1675
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No