Information card for entry 4060632

Structure parameters

• Formula: C30 H27 Br2 N2 Ni O P
• Calculated formula: C30 H27 Br2 N2 Ni O P
• SMILES: [Ni]12(Br)[P](c3ccccc3C=[N]1c1cccc3ccc[n]2c13)(c1c(C)cccc1)c1c(C)cccc1.[Br-].O
• Title of publication: Synthesis and Characterization of Tridentate Nickel Complexes Bearing P∧N∧N and P∧N∧P Ligands and Their Catalytic Property in Ethylene Oligomerization
• Authors of publication: Hou, Junxian; Sun, Wen-Hua; Zhang, Shu; Ma, Hongwei; Deng, Yuan; Lu, Xiaoming
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 1
• Pages of publication: 236 - 244
• a: 16.5092 ± 0.0004 Å
• b: 10.1035 ± 0.0002 Å
• c: 16.9507 ± 0.0005 Å
• α: 90°
• β: 104.781 ± 0.001°
• γ: 90°
• Cell volume: 2733.82 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No