Information card for entry 7014755

Structure parameters

• Formula: C12 H4 Cl8 Cr N2
• Calculated formula: C12 H4 Cl8 Cr N2
• SMILES: c1(c(cc(cc1Cl)Cl)Cl)N=[Cr](Cl)(=Nc1c(cc(cc1Cl)Cl)Cl)Cl
• 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: 14.2157 ± 0.0006 Å
• b: 8.5808 ± 0.0005 Å
• c: 14.6107 ± 0.0008 Å
• α: 90°
• β: 96.439 ± 0.005°
• γ: 90°
• Cell volume: 1771 ± 0.16 ų
• Cell temperature: 198 ± 2 K
• Ambient diffraction temperature: 198 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0299
• Residual factor for significantly intense reflections: 0.0258
• Weighted residual factors for significantly intense reflections: 0.0651
• Weighted residual factors for all reflections included in the refinement: 0.0676
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No