Information card for entry 7202443

Structure parameters

• Formula: C39 H57 Cd3 N9 O21
• Calculated formula: C34 H44 Cd3 N8 O20
• Title of publication: Solvent as structure directing agent for the synthesis of novel coordination frameworks using a tripodal flexible ligand
• Authors of publication: Ghosh, Sujit K.; Kitagawa, Susumu
• Journal of publication: CrystEngComm
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 12
• Pages of publication: 1739
• a: 17.64 ± 0.002 Å
• b: 13.38 ± 0.003 Å
• c: 21.46 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5065.1 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0666
• Residual factor for significantly intense reflections: 0.0606
• Weighted residual factors for significantly intense reflections: 0.1703
• Weighted residual factors for all reflections included in the refinement: 0.1758
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No