Information card for entry 7720685

Structure parameters

• Formula: C32 H42 Br4 N2 O2
• Calculated formula: C32 H42 Br4 N2 O2
• 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: 11.05269 ± 0.00011 Å
• b: 14.86773 ± 0.00011 Å
• c: 11.54433 ± 0.00011 Å
• α: 90°
• β: 114.907 ± 0.0012°
• γ: 90°
• Cell volume: 1720.62 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0207
• Residual factor for significantly intense reflections: 0.0201
• Weighted residual factors for significantly intense reflections: 0.0452
• Weighted residual factors for all reflections included in the refinement: 0.0455
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No