Information card for entry 4322700

Structure parameters

• Formula: C22 H32 B I N6 O4 W
• Calculated formula: C22 H28 B I N6 O4 W
• Title of publication: Halocarbonyltungsten(II) Complexes Containing Tripodal Tris(pyrazolyl)borate Ligands
• Authors of publication: Charles G. Young; Simon Thomas; Robert W. Gable
• Journal of publication: Inorganic Chemistry
• Year of publication: 1998
• Journal volume: 37
• Pages of publication: 1299 - 1306
• a: 11.779 ± 0.002 Å
• b: 15.975 ± 0.004 Å
• c: 29.476 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5546.5 ± 1.8 ų
• Cell temperature: 293 ± 1 K
• Ambient diffraction temperature: 293 ± 1 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0962
• Residual factor for significantly intense reflections: 0.0379
• Weighted residual factors for all reflections: 0.0948
• Weighted residual factors for significantly intense reflections: 0.0797
• Goodness-of-fit parameter for all reflections: 1.031
• Goodness-of-fit parameter for significantly intense reflections: 1.1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No