Information card for entry 2213291

Structure parameters

• Chemical name: (μ~2~-4,4'-Bipyridyl-κ^2^N:N')bis[bis(tri-tert-butoxysilanothiolato- κ^2^S,O)cadmium(II)] tetrahydrofuran disolvate
• Formula: C66 H132 Cd2 N2 O14 S4 Si4
• Calculated formula: C66 H132 Cd2 N2 O14 S4 Si4
• SMILES: C(C)(C)(C)O[Si]1(OC(C)(C)C)[O](C(C)(C)C)[Cd]2([n]3ccc(c4cc[n](cc4)[Cd]45([O](C(C)(C)C)[Si](OC(C)(C)C)(OC(C)(C)C)S5)[O](C(C)(C)C)[Si](OC(C)(C)C)(OC(C)(C)C)S4)cc3)([O]([Si](OC(C)(C)C)(OC(C)(C)C)S2)C(C)(C)C)S1.O1CCCC1.O1CCCC1
• Title of publication: (μ~2~-4,4'-Bipyridyl-κ^2^<i>N</i>:<i>N</i>')bis[bis(tri-<i>tert</i>-butoxysilanothiolato-κ^2^<i>S</i>,<i>O</i>)cadmium(II)] tetrahydrofuran disolvate
• Authors of publication: Pladzyk, Agnieszka; Dołęga, Anna; Baranowska, Katarzyna
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 5
• Pages of publication: m1434 - m1436
• a: 9.8474 ± 0.0004 Å
• b: 20.4025 ± 0.0008 Å
• c: 21.6171 ± 0.0009 Å
• α: 90°
• β: 101.882 ± 0.004°
• γ: 90°
• Cell volume: 4250.1 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.053
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.112
• Weighted residual factors for all reflections included in the refinement: 0.126
• Goodness-of-fit parameter for all reflections included in the refinement: 1.2
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes