Information card for entry 2239582

Structure parameters

• Chemical name: Bis(μ~2~-diphenylphosphinamide-κ^2^<i>O</i>:<i>O</i>)bis[bis(diphenylphosphinamide-κ<i>O</i>)lithium] dichloride acetonitrile disolvate
• Formula: C76 H78 Cl2 Li2 N8 O6 P6
• Calculated formula: C76 H78 Cl2 Li2 N8 O6 P6
• SMILES: [Li]1([O]=P(c2ccccc2)(N)c2ccccc2)([O]=P(c2ccccc2)(N)c2ccccc2)[O](=P(c2ccccc2)(N)c2ccccc2)[Li]([O]=P(c2ccccc2)(N)c2ccccc2)([O]=P(c2ccccc2)(N)c2ccccc2)[O]1=P(c1ccccc1)(N)c1ccccc1.N#CC.[Cl-].N#CC.[Cl-]
• Title of publication: Bis(μ~2~-diphenylphosphinamide-κ^2^<i>O</i>:<i>O</i>)bis[bis(diphenylphosphinamide-κ<i>O</i>)lithium] dichloride acetonitrile disolvate
• Authors of publication: Li, Ai-Hong; Han, Jun-Ping; Li, Jing
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 6
• Pages of publication: m224
• a: 11.5625 ± 0.0007 Å
• b: 12.5552 ± 0.0008 Å
• c: 13.7686 ± 0.0009 Å
• α: 82.559 ± 0.001°
• β: 76.515 ± 0.001°
• γ: 89.897 ± 0.001°
• Cell volume: 1926.5 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.052
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0834
• Weighted residual factors for all reflections included in the refinement: 0.0931
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes