Information card for entry 1546583

Structure parameters

• Formula: C30 H36.5 Cl3 N O8 P Pd S
• Calculated formula: C30 H36.5 Cl3 N O8 P Pd S
• Title of publication: Reactivity of Difunctional Polar Monomers and Ethylene Copolymerization: A Comprehensive Account
• Authors of publication: Gaikwad, Shahaji R.; Deshmukh, Satej S.; Koshti, Vijay S.; Poddar, Suparna; Gonnade, Rajesh G.; Rajamohanan, Pattuparambil R.; Chikkali, Samir H.
• Journal of publication: Macromolecules
• Year of publication: 2017
• Journal volume: 50
• Journal issue: 15
• Pages of publication: 5748
• a: 11.1958 ± 0.0007 Å
• b: 21.7534 ± 0.0014 Å
• c: 14.9104 ± 0.0008 Å
• α: 90°
• β: 95.643 ± 0.002°
• γ: 90°
• Cell volume: 3613.8 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0939
• Residual factor for significantly intense reflections: 0.0843
• Weighted residual factors for significantly intense reflections: 0.2271
• Weighted residual factors for all reflections included in the refinement: 0.2342
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No