Information card for entry 1565743

Structure parameters

• Formula: C50 H62 N10 O4 Pr2 S8
• Calculated formula: C50 H62 N10 O4 Pr2 S8
• SMILES: c1cccc2C3=N[N](=Cc4ccccc4)[Pr]4567([O]3[Pr]389([n]12)(OCC)(SC(=[S]3)N1CCCC1)(SC(=[S]8)N1CCCC1)[N](=Cc1ccccc1)N=C(c1cccc[n]41)[O]59)(OCC)([S]=C(N1CCCC1)S6)[S]=C(N1CCCC1)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: 10.8569 ± 0.0008 Å
• b: 11.5007 ± 0.0008 Å
• c: 12.4732 ± 0.0008 Å
• α: 79.695 ± 0.003°
• β: 87.949 ± 0.004°
• γ: 73.625 ± 0.005°
• Cell volume: 1469.97 ± 0.18 ų
• Cell temperature: 188 ± 2 K
• Ambient diffraction temperature: 188 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1002
• Residual factor for significantly intense reflections: 0.0526
• Weighted residual factors for significantly intense reflections: 0.1145
• Weighted residual factors for all reflections included in the refinement: 0.1601
• Goodness-of-fit parameter for all reflections included in the refinement: 1.121
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No