Information card for entry 1565740

Structure parameters

• Formula: C42 H54 La2 N10 O4 S8
• Calculated formula: C42 H54 La2 N10 O4 S8
• SMILES: c1cccc2C3=N[N](=Cc4ccccc4)[La]4567([O]3[La]389([n]12)(OCC)([S]=C(S3)N(C)C)([S]=C(N(C)C)S9)[N](=Cc1ccccc1)N=C(c1cccc[n]41)[O]58)(OCC)([S]=C(N(C)C)S6)[S]=C(N(C)C)S7
• Title of publication: Dinuclear lanthanoid(III) dithiocarbamato complexes bridged by (E)-N-benzylidenepicolinohydrazonate: Syntheses, crystal structures and spectroscopic properties
• Authors of publication: Yakubu, Abdallah; Suzuki, Takayoshi; Kita, Masakazu
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2019
• Journal volume: 498
• Pages of publication: 119124
• a: 10.5657 ± 0.0011 Å
• b: 22.305 ± 0.002 Å
• c: 11.9038 ± 0.0013 Å
• α: 90°
• β: 106.86 ± 0.003°
• γ: 90°
• Cell volume: 2684.8 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1348
• Residual factor for significantly intense reflections: 0.0731
• Weighted residual factors for significantly intense reflections: 0.169
• Weighted residual factors for all reflections included in the refinement: 0.2216
• Goodness-of-fit parameter for all reflections included in the refinement: 1.112
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No