Information card for entry 4060633

Structure parameters

• Formula: C35 H35 Br2 Cl2 N2 Ni P
• Calculated formula: C35 H35 Br2 Cl2 N2 Ni P
• SMILES: Br[Ni]12(Br)[n]3c4c(ccc3)cccc4[N]2=Cc2c([P]1(c1c(C(C)C)cccc1)c1c(cccc1)C(C)C)cccc2.ClCCl
• 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: 11.298 ± 0.002 Å
• b: 11.879 ± 0.002 Å
• c: 14.045 ± 0.003 Å
• α: 91.99 ± 0.03°
• β: 97.91 ± 0.03°
• γ: 114.07 ± 0.03°
• Cell volume: 1696.1 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No