Information card for entry 7058752

Structure parameters

• Formula: C44 H32 Cu2 N4 O12
• Calculated formula: C44 H32 Cu2 N4 O12
• Title of publication: Synthesis and crystal structures of a copper(ii) dinuclear complex and zinc(ii) coordination polymers as materials for efficient oxidative desulfurization of dibenzothiophene
• Authors of publication: Tella, Adedibu C.; Oladipo, Adetola C.; Adimula, Vincent O.; Ameen, Olanrewaju A.; Bourne, Susan A.; Ogunlaja, Adeniyi S.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 36
• Pages of publication: 14343
• a: 9.7035 ± 0.0007 Å
• b: 18.8466 ± 0.0014 Å
• c: 10.6948 ± 0.0008 Å
• α: 90°
• β: 102.326 ± 0.002°
• γ: 90°
• Cell volume: 1910.8 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0389
• Residual factor for significantly intense reflections: 0.0282
• Weighted residual factors for significantly intense reflections: 0.0598
• Weighted residual factors for all reflections included in the refinement: 0.0645
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No