Information card for entry 7014754

Structure parameters

• Formula: C12 Cl2 Cr F10 N2
• Calculated formula: C12 Cl2 Cr F10 N2
• SMILES: [Cr](Cl)(Cl)(=Nc1c(F)c(F)c(F)c(F)c1F)=Nc1c(F)c(F)c(F)c(F)c1F
• Title of publication: Sulfinylamine metathesis at oxo metal species - convenient entry into imido metal chemistry.
• Authors of publication: Rufanov, Konstantin A.; Kipke, Jennifer; Sundermeyer, Jörg
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 9
• Pages of publication: 1990 - 1997
• a: 7.8629 ± 0.0008 Å
• b: 15.2 ± 0.0014 Å
• c: 13.2641 ± 0.0014 Å
• α: 90°
• β: 101.879 ± 0.012°
• γ: 90°
• Cell volume: 1551.3 ± 0.3 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 K
• Number of distinct elements: 5
• 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: 0.0685
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.0657
• Weighted residual factors for all reflections included in the refinement: 0.0727
• Goodness-of-fit parameter for all reflections included in the refinement: 0.913
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No