Information card for entry 7700901

Structure parameters

• Formula: C30 H75 Ce N9 O12 P3
• Calculated formula: C30 H75 Ce N9 O12 P3
• Title of publication: A single-ion single-electron cerrous magnet.
• Authors of publication: Gupta, Sandeep K.; Shanmugan, Swaminathan; Rajeshkumar, Thayalan; Borah, Aditya; Damjanović, Marko; Schulze, Michael; Wernsdorfer, Wolfgang; Rajaraman, Gopalan; Murugavel, Ramaswamy
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 42
• Pages of publication: 15928 - 15935
• a: 26.23 ± 0.004 Å
• b: 17.688 ± 0.002 Å
• c: 43.297 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 20088 ± 5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0446
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.075
• Weighted residual factors for all reflections included in the refinement: 0.0766
• Goodness-of-fit parameter for all reflections included in the refinement: 1.185
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No