Information card for entry 7242647

Structure parameters

• Formula: C64 H64 Cu2 N8 O8
• Calculated formula: C64 H64 Cu2 N8 O8
• Title of publication: Ring opening polymerization of d,l-lactide and ε-caprolactone catalysed by (pyrazol-1-yl)copper(ii) carboxylate complexes
• Authors of publication: Appavoo, Divambal; Spencer, Lara C.; Guzei, Ilia A.; Gómez-García, Carlos J.; van Wyk, Juanita L.; Darkwa, James
• Journal of publication: RSC Advances
• Year of publication: 2021
• Journal volume: 11
• Journal issue: 22
• Pages of publication: 13475 - 13485
• a: 10.468 ± 0.005 Å
• b: 10.853 ± 0.006 Å
• c: 13.43 ± 0.004 Å
• α: 79.52 ± 0.05°
• β: 73.95 ± 0.04°
• γ: 88.13 ± 0.04°
• Cell volume: 1441.6 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0369
• Residual factor for significantly intense reflections: 0.0311
• Weighted residual factors for significantly intense reflections: 0.0807
• Weighted residual factors for all reflections included in the refinement: 0.0838
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No