Information card for entry 1564312

Structure parameters

• Formula: C34.12 H38.25 Cl1.25 N3 O3 Pd
• Calculated formula: C34.125 H38.25 Cl1.25 N3 O3 Pd
• Title of publication: Homo- and copolymerization of norbornene using tridentate IzQO palladium catalysts with dimethylaminoethyl as a side arm
• Authors of publication: Dong, Jie; Wang, Baiquan
• Journal of publication: Polymer Chemistry
• Year of publication: 2021
• Journal volume: 12
• Journal issue: 32
• Pages of publication: 4736 - 4747
• a: 18.1028 ± 0.0007 Å
• b: 14.4854 ± 0.0005 Å
• c: 24.8028 ± 0.0009 Å
• α: 90°
• β: 101.78 ± 0.004°
• γ: 90°
• Cell volume: 6367 ± 0.4 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113.15 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0544
• Residual factor for significantly intense reflections: 0.0402
• Weighted residual factors for significantly intense reflections: 0.0822
• Weighted residual factors for all reflections included in the refinement: 0.09
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No