Information card for entry 7121873

Structure parameters

• Formula: C28 H39 Cl2 I2 N2 P
• Calculated formula: C27 H37 I2 N2 P
• Title of publication: Isolable N-heterocyclic carbene adducts of the elusive diiodophosphine.
• Authors of publication: Cicač-Hudi, M; Schlindwein, S. H.; Feil, C. M.; Nieger, M.; Gudat, D.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 55
• Pages of publication: 7645 - 7648
• a: 10.7558 ± 0.0006 Å
• b: 18.7258 ± 0.0011 Å
• c: 16.3345 ± 0.0009 Å
• α: 90°
• β: 102.309 ± 0.003°
• γ: 90°
• Cell volume: 3214.3 ± 0.3 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 6
• 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: 0.0388
• Residual factor for significantly intense reflections: 0.0278
• Weighted residual factors for significantly intense reflections: 0.0605
• Weighted residual factors for all reflections included in the refinement: 0.0642
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No