Information card for entry 7002536

Structure parameters

• Formula: C12 H20 B F4 N3 Pd
• Calculated formula: C12 H20 B F4 N3 Pd
• SMILES: [Pd]1([n]2ccccc2C[NH]1C(C)C)([N]#CC)C.[B](F)(F)(F)[F-]
• Title of publication: Alternating ethylene-norbornene copolymerization catalyzed by cationic organopalladium complexes bearing hemilabile bidentate ligands of α-amino-pyridines
• Authors of publication: Lin, Ya-Chi; Yu, Kuo-Hsuan; Huang, Shou-Ling; Liu, Yi-Hung; Wang, Yu; Liu, Shiuh-Tzung; Chen, Jwu-Ting
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 41
• Pages of publication: 9058 - 9067
• a: 7.547 ± 0.0002 Å
• b: 11.2769 ± 0.0002 Å
• c: 11.2845 ± 0.0002 Å
• α: 62.79 ± 0.0011°
• β: 78.055 ± 0.0012°
• γ: 78.412 ± 0.0012°
• Cell volume: 829.36 ± 0.03 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0702
• Residual factor for significantly intense reflections: 0.0605
• Weighted residual factors for significantly intense reflections: 0.1658
• Weighted residual factors for all reflections included in the refinement: 0.1804
• Goodness-of-fit parameter for all reflections included in the refinement: 1.123
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No