Information card for entry 7046047

Structure parameters

• Formula: C102 H182 Cr6 F8 N O35 S U2
• Calculated formula: C102 H182 Cr6 F8 N O35 S U2
• Title of publication: Chromium chains as polydentate fluoride ligands for actinides and group IV metals.
• Authors of publication: Leng, Ji-Dong; Kostopoulos, Andreas K.; Isherwood, Liam H.; Ariciu, Ana-Maria; Tuna, Floriana; Vitórica-Yrezábal, Iñigo J; Pritchard, Robin G.; Whitehead, George F. S.; Timco, Grigore A.; Mills, David P.; Winpenny, Richard E. P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 18
• Pages of publication: 6361 - 6369
• a: 33.1772 ± 0.0007 Å
• b: 32.7339 ± 0.0008 Å
• c: 13.1235 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 14252.4 ± 0.6 ų
• Cell temperature: 150 ± 0.02 K
• Ambient diffraction temperature: 150 ± 0.02 K
• Number of distinct elements: 8
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.1202
• Residual factor for significantly intense reflections: 0.0876
• Weighted residual factors for significantly intense reflections: 0.2226
• Weighted residual factors for all reflections included in the refinement: 0.2549
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No