Information card for entry 7100463

Structure parameters

• Formula: C28 H46 N8 O4 Zn
• Calculated formula: C28 H46 N8 O4 Zn
• SMILES: [Zn]1234(OC5=CC(=O)C(=CC5=[N]2CC[N]4(C)C)NCCN(C)C)OC2=CC(=O)C(=CC2=[N]1CC[N]3(C)C)NCCN(C)C
• Title of publication: First Transamination Reactions for the One-Pot Synthesis of Substituted Zwitterionic Quinones
• Authors of publication: Qing-Zheng Yang.; Olivier Siri; Pierre Braunstein
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 12.309 ± 0.005 Å
• b: 17.06 ± 0.005 Å
• c: 15.059 ± 0.005 Å
• α: 90°
• β: 96.02 ± 0.05°
• γ: 90°
• Cell volume: 3144.8 ± 1.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No