Information card for entry 7031947

Structure parameters

• Chemical name: dichlorobis(1,2-bis(dimethylphosphino)benzene)aluminium(III) tetrachloroaluminate
• Formula: C20 H32 Al2 Cl6 P4
• Calculated formula: C20 H32 Al2 Cl6 P4
• SMILES: c12c(cccc1)[P]([Al]1([P]2(C)C)([P](c2c(cccc2)[P]1(C)C)(C)C)(Cl)Cl)(C)C.[Al](Cl)(Cl)(Cl)[Cl-]
• Title of publication: Phosphine complexes of aluminium(iii) halides - preparation and structural and spectroscopic systematics.
• Authors of publication: Burt, Jennifer; Levason, William; Light, Mark E.; Reid, Gillian
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 39
• Pages of publication: 14600 - 14611
• a: 13.278 ± 0.004 Å
• b: 14.545 ± 0.004 Å
• c: 16.554 ± 0.005 Å
• α: 90°
• β: 104.126 ± 0.006°
• γ: 90°
• Cell volume: 3100.4 ± 1.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0352
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for significantly intense reflections: 0.0648
• Weighted residual factors for all reflections included in the refinement: 0.0671
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No