Information card for entry 4114698

Structure parameters

• Common name: Rh6(CO)5(dppm)2(CNCH2C6H5)(mu3-eta2,eta2,eta2-C60)2 (2)
• Chemical name: Hexarhodiumpentacarbonyldi(bis(diphenylphosphino)methane) benzylisocyanidedifullereneC60
• Formula: C194.75 H57 Cl3 N O5 P4 Rh6 S5.5
• Calculated formula: C194.75 H57 Cl3 N O5 P4 Rh6 S5.5
• Title of publication: The First Fullerene-Metal Sandwich Complex: An Unusually Strong Electronic Communication between Two C60 Cages
• Authors of publication: Kwangyeol Lee; Hyunjoon Song; Bongsoo Kim; Joon T. Park; Sangwoo Park; Moon-Gun Choi
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2002
• Journal volume: 124
• Pages of publication: 2872 - 2873
• a: 17.59 ± 0.03 Å
• b: 23.98 ± 0.05 Å
• c: 31.9 ± 0.06 Å
• α: 90°
• β: 96.75 ± 0.04°
• γ: 90°
• Cell volume: 13362 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1654
• Residual factor for significantly intense reflections: 0.0848
• Weighted residual factors for significantly intense reflections: 0.229
• Weighted residual factors for all reflections included in the refinement: 0.2614
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No