Information card for entry 7114250

Structure parameters

• Formula: C60 H52 F12 N8 O2 P2 Ru
• Calculated formula: C58.5 H42 F12 N8 O2 P2 Ru
• Title of publication: Dibenzoeilatin: a novel ligand exhibiting remarkable complementary ??????? stacking interactionsElectronic supplementary information (ESI) available: experimental preparations and full identification of compounds. See http://www.rsc.org/suppdata/cc/b2/b206058b/
• Authors of publication: Bergman, Sheba D.; Reshef, Dvora; Groysman, Stanislav; Goldberg, Israel; Kol, Moshe
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 20
• Pages of publication: 2374
• a: 13.242 ± 0.0003 Å
• b: 14.397 ± 0.0003 Å
• c: 17.409 ± 0.0005 Å
• α: 80.25 ± 0.0013°
• β: 75.862 ± 0.0012°
• γ: 64.212 ± 0.0016°
• Cell volume: 2890.31 ± 0.13 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.146
• Residual factor for significantly intense reflections: 0.0833
• Weighted residual factors for significantly intense reflections: 0.2107
• Weighted residual factors for all reflections included in the refinement: 0.2462
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No