Information card for entry 7104186

Structure parameters

• Formula: C19 H29 Cl7 P2 Zn
• Calculated formula: C19 H29 Cl7 P2 Zn
• SMILES: [Zn](Cl)(Cl)([Cl-])[Cl-].ClC(Cl)Cl.[P+](C)(C)(C)c1ccccc1.[P+](C)(C)(C)c1ccccc1
• Title of publication: Facile dichloromethane activation and phosphine methylation. Isolation of unprecedented zwitterionic organozinc and organocobalt intermediates.
• Authors of publication: Pattacini, Roberto; Jie, Suyun; Braunstein, Pierre
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 8
• Pages of publication: 890 - 892
• a: 9.3861 ± 0.0003 Å
• b: 15.8823 ± 0.0008 Å
• c: 19.1608 ± 0.0009 Å
• α: 90°
• β: 97.869 ± 0.002°
• γ: 90°
• Cell volume: 2829.5 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.0732
• Residual factor for significantly intense reflections: 0.0385
• Weighted residual factors for significantly intense reflections: 0.0667
• Weighted residual factors for all reflections included in the refinement: 0.0752
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No