Information card for entry 4086397

Structure parameters

• Formula: C21.5 H34 Cl N3 O1.5 Pd
• Calculated formula: C21.5 H34 Cl N3 O1.5 Pd
• Title of publication: Synthesis, Structures, and Norbornene Polymerization Behavior of Palladium Complexes Bearing Tridentateo-Aryloxide-N-heterocyclic Carbene Ligands
• Authors of publication: Yang, Dandan; Tang, Yungang; Song, Haibin; Wang, Baiquan
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 10
• Pages of publication: 1392
• a: 30.236 ± 0.006 Å
• b: 9.775 ± 0.002 Å
• c: 17.405 ± 0.004 Å
• α: 90°
• β: 101.4 ± 0.03°
• γ: 90°
• Cell volume: 5042.7 ± 1.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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
• Residual factor for all reflections: 0.0595
• Residual factor for significantly intense reflections: 0.0479
• Weighted residual factors for significantly intense reflections: 0.1373
• Weighted residual factors for all reflections included in the refinement: 0.1445
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No