Information card for entry 7109057

Structure parameters

• Chemical name: chloro-(1-(cyclooctadienyl-rhodium-chloride)(2,4,6-triisopropyl-phenyl)- phosphino-2,3-bis(diisopropylamino)cyclopropenium-P)-gold
• Formula: C38 H63 Au Cl2 N2 P Rh
• Calculated formula: C38 H63 Au Cl2 N2 P Rh
• SMILES: [Au](Cl)[P]([Rh]123(Cl)[CH]4=[CH]1CC[CH]2=[CH]3CC4)(C1=C(N(C(C)C)C(C)C)C1=[N+](C(C)C)C(C)C)c1c(cc(cc1C(C)C)C(C)C)C(C)C
• 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: 24.58 ± 0.003 Å
• b: 26.348 ± 0.004 Å
• c: 15.25 ± 0.002 Å
• α: 90°
• β: 126.81 ± 0.002°
• γ: 90°
• Cell volume: 7907.3 ± 1.9 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0277
• Residual factor for significantly intense reflections: 0.02
• Weighted residual factors for significantly intense reflections: 0.0467
• Weighted residual factors for all reflections included in the refinement: 0.0491
• Goodness-of-fit parameter for all reflections included in the refinement: 1.228
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No