Information card for entry 4301742

Structure parameters

• Common name: [Cu2(μ-DEPYRG)2{μ-N(TMS)2}2]2 (4)
• Formula: C30 H72 Cu4 N8 Si4
• Calculated formula: C30 H72 Cu4 N8 Si4
• SMILES: C[Si](C)(C)[N]1([Cu]23[N](=C(N(CC)CC)N4CCCC4)[Cu]43[Cu]3([N]4([Si](C)(C)C)[Si](C)(C)C)[N](=C(N(CC)CC)N4CCCC4)[Cu]123)[Si](C)(C)C
• Title of publication: Synthesis and Characterization of Group 11 1,1,3,3-Tetraalkylguanidinate (TAG) Clusters: [M2(μ-TAG){μ-N(SiMe3)2}]2 (M = Cu, Ag, and Au)
• Authors of publication: Scott D. Bunge; Jennifer L. Steele
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 2701 - 2706
• a: 9.5504 ± 0.0017 Å
• b: 10.6284 ± 0.0017 Å
• c: 12.746 ± 0.003 Å
• α: 101.132 ± 0.007°
• β: 111.845 ± 0.004°
• γ: 104.196 ± 0.005°
• Cell volume: 1104.6 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0246
• Residual factor for significantly intense reflections: 0.0222
• Weighted residual factors for significantly intense reflections: 0.0786
• Weighted residual factors for all reflections included in the refinement: 0.0897
• Goodness-of-fit parameter for all reflections included in the refinement: 0.708
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No