Information card for entry 7004353

Structure parameters

• Formula: C34 H74 Cd2 N2 O6 S6 Si2
• Calculated formula: C34 H74 Cd2 N2 O6 S6 Si2
• SMILES: C(C)(C)(C)O[Si](OC(C)(C)C)(OC(C)(C)C)[S]1[Cd]2([S]=C(N(CC)CC)S2)[S]([Cd]21[S]=C(N(CC)CC)S2)[Si](OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C
• Title of publication: In search of molecular precursors for cadmium sulfide—new complexes with a sulfur-rich kernel: cadmium(ii) tri-tert-butoxysilanethiolates with additional diethyldithiocarbamato ligand
• Authors of publication: Kropidłowska, Anna; Chojnacki, Jarosław; Fahmi, Amir; Becker, Barbara
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 47
• Pages of publication: 6825 - 6831
• a: 10.673 ± 0.0014 Å
• b: 10.72 ± 0.0016 Å
• c: 12.452 ± 0.002 Å
• α: 65.199 ± 0.015°
• β: 73.677 ± 0.013°
• γ: 78.583 ± 0.012°
• Cell volume: 1235.9 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0539
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.1117
• Weighted residual factors for all reflections included in the refinement: 0.117
• Goodness-of-fit parameter for all reflections included in the refinement: 1.132
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No