Information card for entry 1513557

Structure parameters

• Formula: C12 H14 Cl2 N2 Zn
• Calculated formula: C12 H14 Cl2 N2 Zn
• SMILES: [Zn](Cl)(Cl)([NH2]c1ccccc1)[NH2]c1ccccc1
• Title of publication: Facile synthesis of acridine derivatives by ZnCl2-promoted intramolecular cyclization of o-arylaminophenyl Schiff bases.
• Authors of publication: Su, Qing; Li, Pei; He, Mina; Wu, Qiaolin; Ye, Ling; Mu, Ying
• Journal of publication: Organic letters
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 1
• Pages of publication: 18 - 21
• a: 26.139 ± 0.005 Å
• b: 4.8057 ± 0.001 Å
• c: 11.615 ± 0.002 Å
• α: 90°
• β: 108.86 ± 0.03°
• γ: 90°
• Cell volume: 1380.7 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0318
• Residual factor for significantly intense reflections: 0.0262
• Weighted residual factors for significantly intense reflections: 0.0571
• Weighted residual factors for all reflections included in the refinement: 0.0591
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No