Information card for entry 7042437

Structure parameters

• Formula: C10 H26 Cl4 Mg2 O5
• Calculated formula: C10 H26 Cl4 Mg2 O5
• SMILES: C[O]1CCC[O](C)[Mg]21([O](C)CCC[O]2C)([OH2])[Cl][Mg](Cl)(Cl)Cl
• Title of publication: Crystalline magnesium chloride-electron donor complexes: new support materials for Ziegler-Natta catalysts.
• Authors of publication: Nissinen, V. H.; Koshevoy, I. O.; Pakkanen, T. T.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 13
• Pages of publication: 4452 - 4460
• a: 8.155 ± 0.0003 Å
• b: 17.8774 ± 0.0008 Å
• c: 14.0589 ± 0.0006 Å
• α: 90°
• β: 103.905 ± 0.002°
• γ: 90°
• Cell volume: 1989.59 ± 0.14 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0552
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0781
• Weighted residual factors for all reflections included in the refinement: 0.0871
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No