Information card for entry 1558619

Structure parameters

• Common name: Os3(CO)8(PTA)4
• Chemical name: 1,1,2,2,2,3,3,3-Octacarbonyl-1,1,2,3-tetrakis(1,3,5-triaza-7-phosphatricyclo[3.3.1.1^3,7^]decane-κ<i>P</i>)-<i>triangulo</i>-triosmium(0)
• Formula: C32 H48 N12 O8 Os3 P4
• Calculated formula: C32 H48 N12 O8 Os3 P4
• Title of publication: 1,1,2,2,2,3,3,3-Octacarbonyl-1,1,2,3-tetrakis(1,3,5-triaza-7-phosphatricyclo[3.3.1.1^3,7^]decane-κ<i>P</i>)-<i>triangulo</i>-triosmium(0)
• Authors of publication: Marolf, David M.; Brehm, Kristen L.; Lynch, Vincent M.; Powell, Gregory L.
• Journal of publication: IUCrData
• Year of publication: 2020
• Journal volume: 5
• Journal issue: 7
• Pages of publication: x200935
• a: 18.75 ± 0.0002 Å
• b: 15.8889 ± 0.0002 Å
• c: 27.5984 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8222.03 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.039
• Residual factor for significantly intense reflections: 0.0321
• Weighted residual factors for significantly intense reflections: 0.0743
• Weighted residual factors for all reflections included in the refinement: 0.0761
• Goodness-of-fit parameter for all reflections included in the refinement: 1.141
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes