Information card for entry 3000298

Structure parameters

• Formula: C24 H30 Cu3 Mo12 N20 O47 P
• Calculated formula: C24 H17 Cu3 Mo12 N20 O47 P
• Title of publication: Highly Efficient Synthesis of p-Benzoquinones Catalyzed by Robust Two-Dimensional POM-Based Coordination Polymers
• Authors of publication: Shenzhen Chang
• Journal of publication: To be published in ACS Applied Materials & Interfaces
• Year of publication: 2021
• Journal volume: 13
• Pages of publication: XXXX
• a: 12.6464 ± 0.0006 Å
• b: 12.6737 ± 0.0005 Å
• c: 23.6803 ± 0.001 Å
• α: 83.41 ± 0.001°
• β: 84.635 ± 0.001°
• γ: 61.333 ± 0.001°
• Cell volume: 3304.9 ± 0.2 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0509
• Residual factor for significantly intense reflections: 0.0488
• Weighted residual factors for significantly intense reflections: 0.1045
• Weighted residual factors for all reflections included in the refinement: 0.1053
• Goodness-of-fit parameter for all reflections included in the refinement: 1.208
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No