Information card for entry 7240375

Structure parameters

• Formula: C48 H60 Cs5.5 Mo10 Na6 O102 P4
• Calculated formula: C48 H60 Cs5.5 Mo10 Na6 O102 P4
• Title of publication: Intrinsically porous molecular building blocks for metal organic frameworks tailored by the bridging effect of counter cations
• Authors of publication: Yang, Peng; Alshankiti, Buthainah; Khashab, Niveen M.
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 19.0337 ± 0.0007 Å
• b: 16.6107 ± 0.0005 Å
• c: 43.9445 ± 0.0016 Å
• α: 90°
• β: 93.491 ± 0.002°
• γ: 90°
• Cell volume: 13867.8 ± 0.8 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 119.98 K
• Number of distinct elements: 7
• Space group number: 5
• Hermann-Mauguin space group symbol: I 1 2 1
• Hall space group symbol: I 2y
• Residual factor for all reflections: 0.0325
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0904
• Weighted residual factors for all reflections included in the refinement: 0.0907
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No