Information card for entry 4020994

Structure parameters

• Formula: C17 H15 Cl2 N3 O Zn
• Calculated formula: C17 H15 Cl2 N3 O Zn
• SMILES: [Zn]1(Cl)(Cl)[n]2ccccc2N(c2[n]1cccc2)c1ccc(OC)cc1
• Title of publication: Zn(II)-Induced Ground-State π-Deconjugation and Excited-State Electron Transfer in N,N-Bis(2-pyridyl)amino-Substituted Arenes
• Authors of publication: Jye-Shane Yang; Yan-Duo Lin; Yu-Hsi Lin; Fen-Ling Liao
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 3517 - 3525
• a: 21.3511 ± 0.0012 Å
• b: 12.8237 ± 0.0007 Å
• c: 14.7555 ± 0.0008 Å
• α: 90°
• β: 119.184 ± 0.001°
• γ: 90°
• Cell volume: 3527.2 ± 0.3 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No