Information card for entry 7032482

Structure parameters

• Formula: C30 H70 Li N5 O2 S Si2 Zn
• Calculated formula: C30 H70 Li N5 O2 S Si2 Zn
• SMILES: C(C)(C)([N]1=S2(=[N](C(C)(C)C)[Zn](N([Si](C)(C)C)[Si](C)(C)C)N2C(C)(C)C)N([Li]1([O]1CCCC1)[O]1CCCC1)C(C)(C)C)C
• Title of publication: Transition metal complexes containing the S(NtBu)4(2-) tetraimidosulfate dianion.
• Authors of publication: Matussek, Julia; Herbst-Irmer, Regine; Objartel, Ina; Stalke, Dietmar
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 42
• Pages of publication: 15944 - 15949
• a: 15.507 ± 0.003 Å
• b: 15.39 ± 0.003 Å
• c: 18.081 ± 0.003 Å
• α: 90°
• β: 113.09 ± 0.01°
• γ: 90°
• Cell volume: 3969.4 ± 1.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• 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: 0.0438
• Residual factor for significantly intense reflections: 0.0308
• Weighted residual factors for significantly intense reflections: 0.0742
• Weighted residual factors for all reflections included in the refinement: 0.0797
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No