Information card for entry 7232432

Structure parameters

• Formula: C27.5 H22 N3 O5 V0.5
• Calculated formula: C27.5 H22 N3 O5 V0.5
• Title of publication: Robust and electron deficient oxidovanadium(iv) porphyrin catalysts for selective epoxidation and oxidative bromination reactions in aqueous media
• Authors of publication: Dar, Tawseef Ahmad; Uprety, Bhawna; Sankar, Muniappan; Maurya, Mannar R.
• Journal of publication: Green Chemistry
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 7
• Pages of publication: 1757
• a: 13.829 ± 0.005 Å
• b: 14.439 ± 0.005 Å
• c: 26.153 ± 0.005 Å
• α: 90 ± 0.005°
• β: 90 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 5222 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.2466
• Residual factor for significantly intense reflections: 0.1927
• Weighted residual factors for significantly intense reflections: 0.5193
• Weighted residual factors for all reflections included in the refinement: 0.5556
• Goodness-of-fit parameter for all reflections included in the refinement: 2.181
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No