Information card for entry 7029879

Structure parameters

• Common name: (trop)2W(CO)(MeN=CH(tol))
• Formula: C100 H94 N4 O21 W4
• Calculated formula: C100 H94 N4 O21 W4
• Title of publication: Bis-tropolonate complexes of tungsten: scaffolds for selective side-on binding of nitriles, imines and ketones.
• Authors of publication: Becica, Joseph; Jackson, Andrew B.; Dougherty, William G.; Kassel, W. Scott; West, Nathan M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 23
• Pages of publication: 8738 - 8748
• a: 36.265 ± 0.007 Å
• b: 14.093 ± 0.003 Å
• c: 19.302 ± 0.004 Å
• α: 90°
• β: 110.04 ± 0.03°
• γ: 90°
• Cell volume: 9268 ± 4 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• 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: 0.0886
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.0551
• Weighted residual factors for all reflections included in the refinement: 0.0679
• Goodness-of-fit parameter for all reflections included in the refinement: 0.995
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No