Information card for entry 4072556

Structure parameters

• Chemical name: dichloro(N,N'-di(quinoline-2-methylene)diiminocyclohexane)manganese(II) dichloromethane
• Formula: C27 H26 Cl4 Mn N4
• Calculated formula: C27 H26 Cl4 Mn N4
• SMILES: [Mn]123(Cl)(Cl)[n]4c5ccccc5ccc4C=[N]1[C@@H]1CCCC[C@H]1[N]2=Cc1[n]3c2c(cc1)cccc2.ClCCl
• Title of publication: Manganese(II) Complexes in Ethene Polymerization
• Authors of publication: Yliheikkilä, Katariina; Axenov, Kirill; Räisänen, Minna T.; Klinga, Martti; Lankinen, Mikko P.; Kettunen, Mika; Leskelä, Markku; Repo, Timo
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 4
• Pages of publication: 980
• a: 9.249 ± 0.002 Å
• b: 27.1 ± 0.004 Å
• c: 11.653 ± 0.002 Å
• α: 90°
• β: 107.78 ± 0.03°
• γ: 90°
• Cell volume: 2781.3 ± 1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1071
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.0989
• Weighted residual factors for all reflections included in the refinement: 0.1142
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No