Information card for entry 4074747

Structure parameters

• Formula: C24 H12 Au F15 N3 P
• Calculated formula: C24 H12 Au F15 N3 P
• SMILES: [Au]([P]12CN3CN(C1)CN(C2)C3)(c1c(F)c(F)c(F)c(F)c1F)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F
• Title of publication: Organometallic Gold(I) and Gold(III) Complexes Containing 1,3,5-Triaza-7-phosphaadamantane (TPA): Examples of Water-Soluble Organometallic Gold Compounds
• Authors of publication: Mohr, Fabian; Cerrada, Elena; Laguna, Mariano
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 3
• Pages of publication: 644
• a: 10.256 ± 0.002 Å
• b: 13.206 ± 0.003 Å
• c: 20.794 ± 0.004 Å
• α: 79.12 ± 0.03°
• β: 76.88 ± 0.03°
• γ: 71.28 ± 0.03°
• Cell volume: 2577.1 ± 1.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0224
• Residual factor for significantly intense reflections: 0.018
• Weighted residual factors for significantly intense reflections: 0.0393
• Weighted residual factors for all reflections included in the refinement: 0.0403
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No