Information card for entry 4346426

Structure parameters

• Formula: C60 H92 Cu3 Ge4 I3 N8 O2
• Calculated formula: C60 H92 Cu3 Ge4 I3 N8 O2
• SMILES: [I]12[Cu]34[I]5[Cu]61([I][Cu]256[Ge]1(O[Ge]23[N](=C3C=CC=CC=C3N2CC(C)C)CC(C)C)[N](CC(C)C)=C2C=CC=CC=C2N1CC(C)C)[Ge]1(O[Ge]24[N](=C3C=CC=CC=C3N2CC(C)C)CC(C)C)[N](=C2C=CC=CC=C2N1CC(C)C)CC(C)C
• Title of publication: Digermylene Oxide Stabilized Group 11 Metal Iodide Complexes.
• Authors of publication: Yadav, Dhirendra; Siwatch, Rahul Kumar; Sinhababu, Soumen; Karwasara, Surendar; Singh, Dharmendra; Rajaraman, Gopalan; Nagendran, Selvarajan
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 23
• Pages of publication: 11067 - 11076
• a: 12.2237 ± 0.0015 Å
• b: 18.375 ± 0.002 Å
• c: 18.579 ± 0.002 Å
• α: 77.751 ± 0.002°
• β: 88.857 ± 0.002°
• γ: 75.862 ± 0.002°
• Cell volume: 3952.3 ± 0.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0754
• Residual factor for significantly intense reflections: 0.0517
• Weighted residual factors for significantly intense reflections: 0.1323
• Weighted residual factors for all reflections included in the refinement: 0.1398
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No