Information card for entry 2200150

Structure parameters

• Common name: 1-(dicyclohexylthiophosphinoyl)-N-phenylthioformamide
• Formula: C19 H28 N P S2
• Calculated formula: C19 H28 N P S2
• SMILES: S=C(P(=S)(C1CCCCC1)C1CCCCC1)Nc1ccccc1
• Title of publication: Monoclinic form of 1-(dicyclohexylthiophosphinoyl)-<i>N</i>-phenylthioformamide
• Authors of publication: Horn, E.; Kurosawa, K.; Tiekink, E. R. T.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 4
• Pages of publication: o321 - o322
• a: 10.074 ± 0.001 Å
• b: 18.139 ± 0.002 Å
• c: 11.3858 ± 0.0009 Å
• α: 90°
• β: 105.426 ± 0.008°
• γ: 90°
• Cell volume: 2005.6 ± 0.3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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 significantly intense reflections: 0.04
• Weighted residual factors for all reflections included in the refinement: 0.028
• Goodness-of-fit parameter for all reflections included in the refinement: 1.688
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes