Information card for entry 7109056

Structure parameters

• Chemical name: (mu-2-(2,3-bis(diisopropylamino)cycloprop-1(3)-en-2-ylium-1-yl- (2,4,6-triisopropyl-phenyl)-phosphanide)-dichloro-di-gold diethylether solute
• Formula: C34 H61 Au2 Cl2 N2 O P
• Calculated formula: C34 H61 Au2 Cl2 N2 O P
• SMILES: [Au](Cl)[P]([Au]Cl)(C1=C(C1=[N+](C(C)C)C(C)C)N(C(C)C)C(C)C)c1c(cc(cc1C(C)C)C(C)C)C(C)C.C(C)OCC
• Title of publication: Chiral heterobimetallic complexes of carbodiphosphoranes and phosphinidene_carbene adducts
• Authors of publication: Manuel Alcarazo; Karin Radkowski; Gerlinde Mehler; Richard Goddard; Alois Furstner
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 3140
• a: 12.2004 ± 0.0015 Å
• b: 18.01 ± 0.002 Å
• c: 17.84 ± 0.002 Å
• α: 90°
• β: 96.719 ± 0.002°
• γ: 90°
• Cell volume: 3893 ± 0.8 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• 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: 0.0191
• Residual factor for significantly intense reflections: 0.0148
• Weighted residual factors for significantly intense reflections: 0.0336
• Weighted residual factors for all reflections included in the refinement: 0.0351
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No