Information card for entry 4304984

Structure parameters

• Formula: C26 H30 N13 Ni O2.5 W
• Calculated formula: C26 H30 N13 Ni O2.5 W
• Title of publication: Tetranuclear [{Ni(HL3)}{W(CN)8}]2 Square: A Case of Antiferromagnetic {NiIIWV} Interactions
• Authors of publication: Thengarai S. Venkatakrishnan; Cédric Desplanches; Raghunathan Rajamani; Philippe Guionneau; Laurent Ducasse; S. Ramasesha; Jean-Pascal Sutter
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 4854 - 4860
• a: 11.476 ± 0.005 Å
• b: 20.003 ± 0.005 Å
• c: 14.785 ± 0.005 Å
• α: 90 ± 0.005°
• β: 92.887 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 3390 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0537
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.0934
• Weighted residual factors for all reflections included in the refinement: 0.1038
• Goodness-of-fit parameter for all reflections included in the refinement: 0.995
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No