Information card for entry 7223602

Structure parameters

• Formula: C72 H104 Cl4 O8 V2
• Calculated formula: C72 H104 Cl4 O8 V2
• Title of publication: Vanadyl phenolate complexes for ring opening homo- and co-polymerisation of epsilon-caprolactone, L-lactide and rac-lactide
• Authors of publication: Ge, Feijie; Dan, Yi; Al-Khafaji, Yahya; Prior, Timothy J.; Jiang, Long; Elsegood, Mark Robert James; Redshaw, Carl
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 11.0268 ± 0.0007 Å
• b: 19.1028 ± 0.0013 Å
• c: 70.103 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 14766.7 ± 1.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1055
• Residual factor for significantly intense reflections: 0.0721
• Weighted residual factors for significantly intense reflections: 0.2001
• Weighted residual factors for all reflections included in the refinement: 0.2248
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No