Information card for entry 7026953

Structure parameters

• Formula: C56 H52 Cd3 N10 O18 S6
• Calculated formula: C56 H52 Cd3 N10 O18 S6
• Title of publication: Two cationic metal-organic frameworks based on cadmium and α,ω-alkanedisulfonate anions and their photoluminescent properties.
• Authors of publication: Fei, Honghan; Oliver, Scott R. J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 46
• Pages of publication: 11193 - 11200
• a: 8.4243 ± 0.0009 Å
• b: 11.6368 ± 0.0012 Å
• c: 15.7095 ± 0.0016 Å
• α: 95.494 ± 0.001°
• β: 104.725 ± 0.001°
• γ: 99.122 ± 0.001°
• Cell volume: 1455.6 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0275
• Residual factor for significantly intense reflections: 0.023
• Weighted residual factors for significantly intense reflections: 0.0578
• Weighted residual factors for all reflections included in the refinement: 0.0603
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No