Information card for entry 7711904

Structure parameters

• Chemical name: Carbonyl-eta2-diphenylphosphanylethyne-fluorido-hydrido{tris(3,4,5-trimethylpyrazolyl)borato}-tungsten(II)
• Formula: C33 H39 B F N6 O1.03 P W
• Calculated formula: C33 H39 B F N6 O1.033 P W
• Title of publication: Tuning the potential of redox-active diphosphine ligands based on the alkyne complexes [Tp*W(CO)L{η²-C₂(PPh₂)₂}].
• Authors of publication: Ludwig, Stephan; Hamann, Friederike M.; Helmdach, Kai; Villinger, Alexander; Seidel, Wolfram W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 52
• Journal issue: 2
• Pages of publication: 326 - 337
• a: 9.0234 ± 0.0008 Å
• b: 10.1907 ± 0.0009 Å
• c: 19.5548 ± 0.0018 Å
• α: 88.57 ± 0.004°
• β: 77.444 ± 0.005°
• γ: 69.035 ± 0.004°
• Cell volume: 1636.2 ± 0.3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0445
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.0798
• Weighted residual factors for all reflections included in the refinement: 0.0836
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No