Information card for entry 7202335

Structure parameters

• Formula: C36 H40 Cl2 Cu N6 O16
• Calculated formula: C36 H40 Cl2 Cu N6 O16
• Title of publication: Transition metal coordination frameworks with bridges of 1,2-bis(4-pyridyl)ethane-N,N′-dioxide incorporating anions of different size
• Authors of publication: Sun, Hao-Ling; Wang, Zhe-Ming; Gao, Song; Batten, Stuart R.
• Journal of publication: CrystEngComm
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 12
• Pages of publication: 1796
• a: 5.8754 ± 0.0002 Å
• b: 13.367 ± 0.0003 Å
• c: 14.6338 ± 0.0004 Å
• α: 114.664 ± 0.002°
• β: 99.732 ± 0.001°
• γ: 95.8 ± 0.001°
• Cell volume: 1010.34 ± 0.05 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0763
• Residual factor for significantly intense reflections: 0.0464
• Weighted residual factors for significantly intense reflections: 0.1262
• Weighted residual factors for all reflections included in the refinement: 0.1358
• Goodness-of-fit parameter for all reflections included in the refinement: 0.973
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No