Information card for entry 7720689

Structure parameters

• Formula: C38 H43 Br4 N2 O3 V
• Calculated formula: C38 H43 Br4 N2 O3 V
• Title of publication: Vanadyl complexes supported by O,O-and N,O-chelate ligation: Structures and polymerization catalysis
• Authors of publication: Shibata, Kaname; Michiue, Kenji; Motuzis, Ignas; Elsegood, Mark Robert James; Redshaw, Carl
• Journal of publication: Dalton Transactions
• Year of publication: 2026
• a: 11.80158 ± 0.00012 Å
• b: 12.16142 ± 0.00014 Å
• c: 13.69665 ± 0.00013 Å
• α: 77.325 ± 0.0009°
• β: 86.4467 ± 0.0008°
• γ: 89.4045 ± 0.0009°
• Cell volume: 1914.19 ± 0.04 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0261
• Residual factor for significantly intense reflections: 0.0257
• Weighted residual factors for significantly intense reflections: 0.0589
• Weighted residual factors for all reflections included in the refinement: 0.0591
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No