Information card for entry 7007751

Structure parameters

• Common name: mer-tricarbonyl-(4,4'-bipyridine,N)-(2,2'-bipyridine,N,N')- rhenium(i) triflate dichloromethane diethylether
• Chemical name: mer-tricarbonyl-(4,4'-bipyridine,N)-(2,2'-bipyridine,N,N')-rhenium(I) triflate dichloromethane diethylether
• Formula: C27 H23 Cl2 F3 N4 O6.5 Re S
• Calculated formula: C27 H18 Cl2 F3 N4 O6.5 Re S
• Title of publication: fac-[Re(CO)3(dmso-O)3](CF3SO3): a new versatile and efficient Re(I) precursor for the preparation of mono and polynuclear compounds containing fac-[Re(CO)3]+ fragments.
• Authors of publication: Casanova, Massimo; Zangrando, Ennio; Munini, Fabio; Iengo, Elisabetta; Alessio, Enzo
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 42
• Pages of publication: 5033 - 5045
• a: 8.35 ± 0.002 Å
• b: 10.589 ± 0.003 Å
• c: 17.861 ± 0.004 Å
• α: 93.86 ± 0.02°
• β: 99.75 ± 0.02°
• γ: 94.78 ± 0.02°
• Cell volume: 1545.7 ± 0.7 ų
• Cell temperature: 210 ± 2 K
• Ambient diffraction temperature: 210 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0453
• Residual factor for significantly intense reflections: 0.0436
• Weighted residual factors for significantly intense reflections: 0.1142
• Weighted residual factors for all reflections included in the refinement: 0.1165
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No