Information card for entry 4348470

Structure parameters

• Formula: C20 H34 Cl2 N Na O9 Pt S5 Zn
• Calculated formula: C20 H34 Cl2 N Na O9 Pt S5 Zn
• SMILES: C1(O[Zn]234(N=C=[S][Na]5678[O]9CC[O]5CC[O]6CC[O]7CC[O]8CC9)OC(=[S][Pt]4([S]=1)([S]=C(O2)C)[S]=C(O3)C)C)C.C(Cl)Cl
• Title of publication: Thiocyanate-Ligated Heterobimetallic {PtM} Lantern Complexes Including a Ferromagnetically Coupled 1D Coordination Polymer.
• Authors of publication: Guillet, Jesse L.; Bhowmick, Indrani; Shores, Matthew P.; Daley, Christopher J. A.; Gembicky, Milan; Golen, James A.; Rheingold, Arnold L.; Doerrer, Linda H.
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 16
• Pages of publication: 8099 - 8109
• a: 11.8803 ± 0.0008 Å
• b: 12.0317 ± 0.0008 Å
• c: 13.1799 ± 0.0006 Å
• α: 75.236 ± 0.002°
• β: 72.781 ± 0.001°
• γ: 78.363 ± 0.001°
• Cell volume: 1723.75 ± 0.18 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0457
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.0912
• Weighted residual factors for all reflections included in the refinement: 0.0972
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No