Information card for entry 7006339

Structure parameters

• Common name: 03196
• Chemical name: LMg2Cl2OEt
• Formula: C24 H48 Cl4 Mg2 N4 O3
• Calculated formula: C24 H48 Cl4 Mg2 N4 O3
• SMILES: Cl[Mg]123[O](CC)[Mg]45(Cl)([N](Cc7c([O]34)c(cc(c7)C)C[N]1(C)CC[N]2(C)C)(C)CC[N]5(C)C)[OH]CC.ClCCl
• Title of publication: Comparison of structurally analogous Zn2, Co2, and Mg2 catalysts for the polymerization of cyclic esters.
• Authors of publication: Breyfogle, Laurie E.; Williams, Charlotte K.; Young, Jr, Victor G; Hillmyer, Marc A.; Tolman, William B.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 7
• Pages of publication: 928 - 936
• a: 20.544 ± 0.002 Å
• b: 10.6347 ± 0.0014 Å
• c: 15.894 ± 0.003 Å
• α: 90°
• β: 109.778 ± 0.002°
• γ: 90°
• Cell volume: 3267.7 ± 0.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0744
• Residual factor for significantly intense reflections: 0.0498
• Weighted residual factors for significantly intense reflections: 0.1229
• Weighted residual factors for all reflections included in the refinement: 0.1397
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No