Information card for entry 2242757

Structure parameters

• Chemical name: Bis{μ~2~-6,6'-dimethoxy-2,2'-[phenylene-1,2-diylbis(nitrilomethanylylidene)]diphenolato}-1κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>':2κ^3^<i>O</i>,<i>O</i>',<i>O</i>^6^;2κ^3^<i>O</i>,<i>O</i>',<i>O</i>^6^:3κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'-bis(dimethylformamide-2κ<i>O</i>)dithiocyanato-1κ<i>N</i>,3κ<i>N</i>-2-samarium(III)-1,3-dizinc(II) {μ~2~-6,6'-dimethoxy-2,2'-[phenylene-1,2-diylbis(nitrilomethanylylidene)]diphenolato-1κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>':2κ^2^<i>O</i>,<i>O</i>'}trithiocyanato-1κ<i>N</i>;2κ^2^<i>N</i>,<i>N</i>-dizinc(II) dimethylformamide monosolvate 1.32-hydrate
• Formula: C80 H75.64 N14 O15.32 S5 Sm Zn4
• Calculated formula: C80 H75.64 N14 O15.32 S5 Sm Zn4
• Title of publication: A new co-crystal dinuclear/trinuclear Zn^II^‒Zn^II^/Zn^II^‒Sm^III^‒Zn^II^ complex with a salen-type Schiff base ligand
• Authors of publication: Sarr, Mamour; Diop, Mayoro; Thiam, Elhadj Ibrahima; Gaye, Mohamed; Barry, Aliou Hamady; Orton, James B.; Coles, Simon J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2018
• Journal volume: 74
• Journal issue: 12
• Pages of publication: 1862 - 1866
• a: 14.76937 ± 0.00009 Å
• b: 15.57623 ± 0.0001 Å
• c: 19.28129 ± 0.00013 Å
• α: 94.7754 ± 0.0005°
• β: 104.2 ± 0.0006°
• γ: 100.929 ± 0.0005°
• Cell volume: 4182.75 ± 0.05 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: 0.0254
• Residual factor for significantly intense reflections: 0.0242
• Weighted residual factors for significantly intense reflections: 0.0567
• Weighted residual factors for all reflections included in the refinement: 0.0572
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes