Information card for entry 4308493

Structure parameters

• Formula: C42.5 H60.5 N2.5 Na3 Nd O9 S12
• Calculated formula: C42.5 H58 N2.5 Na3 Nd O9 S12
• Title of publication: Tris(dithiolene) Complexes of Neodymium and Cerium: Mononuclear Species, Chains, and Honeycomb Networks
• Authors of publication: Mathieu Roger; Thérèse Arliguie; Pierre Thuéry; Marc Fourmigué; Michel Ephritikhine
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 584 - 593
• a: 14.2753 ± 0.0009 Å
• b: 14.8237 ± 0.0007 Å
• c: 17.0518 ± 0.001 Å
• α: 114.415 ± 0.003°
• β: 91.86 ± 0.003°
• γ: 116.398 ± 0.003°
• Cell volume: 2837.8 ± 0.3 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: 0.0922
• Residual factor for significantly intense reflections: 0.0591
• Weighted residual factors for significantly intense reflections: 0.1295
• Weighted residual factors for all reflections included in the refinement: 0.1456
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No