Information card for entry 1514495

Structure parameters

• Formula: C26 H27 Cu3 N8 O0
• Calculated formula: C26 H27 Cu3 N8
• Title of publication: A dynamic, luminescent and entangled MOF as a qualitative sensor for volatile organic solvents and a quantitative monitor for acetonitrile vapour
• Authors of publication: Wang, Jun-Hao; Li, Mian; Li, Dan
• Journal of publication: Chemical Science
• Year of publication: 2013
• Journal volume: 4
• Journal issue: 4
• Pages of publication: 1793
• a: 11.4287 ± 0.0018 Å
• b: 11.7031 ± 0.0018 Å
• c: 12.918 ± 0.002 Å
• α: 64.005 ± 0.003°
• β: 89.783 ± 0.003°
• γ: 71.129 ± 0.003°
• Cell volume: 1450.1 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.088
• Residual factor for significantly intense reflections: 0.0641
• Weighted residual factors for significantly intense reflections: 0.1575
• Weighted residual factors for all reflections included in the refinement: 0.1868
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No