Information card for entry 7042305

Structure parameters

• Formula: C19 H18 N Ni O3 S2
• Calculated formula: C19 H18 N Ni O3 S2
• Title of publication: Quasi-1D chains of dinickel lantern complexes and their magnetic properties.
• Authors of publication: Nimthong-Roldán, Arunpatcha; Guillet, Jesse L.; McNeely, James; Ozumerzifon, Tarik J.; Shores, Matthew P.; Golen, James A.; Rheingold, Arnold L.; Doerrer, Linda H.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 17
• Pages of publication: 5546 - 5557
• a: 27.62 ± 0.006 Å
• b: 9.63 ± 0.002 Å
• c: 18.507 ± 0.004 Å
• α: 90 ± 0.03°
• β: 127.04 ± 0.03°
• γ: 90 ± 0.03°
• Cell volume: 3929 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0893
• Residual factor for significantly intense reflections: 0.0691
• Weighted residual factors for significantly intense reflections: 0.1844
• Weighted residual factors for all reflections included in the refinement: 0.2071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No