Information card for entry 7125370

Structure parameters

• Formula: C56 H96 N4 O20 P4 S4 Zn4
• Calculated formula: C56 H96 N4 O20 P4 S4 Zn4
• Title of publication: Hitherto unknown eight-connected frameworks formed from A₄B₄O₁₂ metal organophosphate heterocubanes.
• Authors of publication: Sharma, Kamna; Gupta, Sandeep K.; Borah, Aditya; Murugavel, Ramaswamy
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2019
• Journal volume: 55
• Journal issue: 55
• Pages of publication: 7994 - 7997
• a: 21.231 ± 0.008 Å
• b: 21.328 ± 0.008 Å
• c: 20.064 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9085 ± 6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 45
• Hermann-Mauguin space group symbol: I b a 2
• Hall space group symbol: I 2 -2c
• Residual factor for all reflections: 0.0741
• Residual factor for significantly intense reflections: 0.0726
• Weighted residual factors for significantly intense reflections: 0.17
• Weighted residual factors for all reflections included in the refinement: 0.171
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No