Information card for entry 4306539

Structure parameters

• Formula: C17 H21 N O6 P Re W
• Calculated formula: C17 H21 N O6 P Re W
• Title of publication: Low-Temperature N-O Bond Cleavage of Nitrogen Monoxide in Heterometallic Carbonyl Complexes. An Experimental and Theoretical Study
• Authors of publication: M. Esther García; Sonia Melón; Miguel A. Ruiz; Ramón López; Tomás Sordo; Luciano Marchiò; Antonio Tiripicchio
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 10644 - 10655
• a: 9.864 ± 0.005 Å
• b: 14.541 ± 0.006 Å
• c: 8.105 ± 0.005 Å
• α: 92.99 ± 0.02°
• β: 113.68 ± 0.02°
• γ: 97.68 ± 0.02°
• Cell volume: 1047.9 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1647
• Residual factor for significantly intense reflections: 0.0507
• Weighted residual factors for significantly intense reflections: 0.1024
• Weighted residual factors for all reflections included in the refinement: 0.1578
• Goodness-of-fit parameter for all reflections included in the refinement: 1.186
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No