Information card for entry 4079788

Structure parameters

• Formula: C20 H29 Cl N4 Pt Si2
• Calculated formula: C20 H29 Cl N4 Pt Si2
• SMILES: C12N(C=CN1c1c3[Pt]=2(Cl)=C2N(C=CN2c3ccc1)C[Si](C)(C)C)C[Si](C)(C)C
• Title of publication: Synthesis, Characterization, Photoluminescence, and Simulations of a CCC-NHC-Supported Pt2Ag2Mixed-Metal Cluster Containing a PtAg2Metallacyclopropane
• Authors of publication: Zhang, Xiaofei; Cao, Bei; Valente, Edward J.; Hollis, T. Keith
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 3
• Pages of publication: 752
• a: 6.2984 ± 0.0002 Å
• b: 19.4917 ± 0.0006 Å
• c: 19.4312 ± 0.0007 Å
• α: 90°
• β: 91.865 ± 0.003°
• γ: 90°
• Cell volume: 2384.24 ± 0.14 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.029
• Residual factor for significantly intense reflections: 0.0208
• Weighted residual factors for significantly intense reflections: 0.0379
• Weighted residual factors for all reflections included in the refinement: 0.0385
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No