Information card for entry 4340251

Structure parameters

• Common name: [W2(hpp)4][TFPB]2
• Chemical name: Bis(tetra(3,5-bis(trifluoromethyl)phenyl)borate)[W2(hpp)4]
• Formula: C92 H72 B2 F48 N12 W2
• Calculated formula: C92 H72 B2 F48 N12 W2
• Title of publication: Facilitating access to the most easily ionized molecule: an improved synthesis of the key intermediate, W2(hpp)4Cl2, and related compounds.
• Authors of publication: Cotton, F. Albert; Donahue, James P.; Gruhn, Nadine E.; Lichtenberger, Dennis L.; Murillo, Carlos A.; Timmons, Daren J.; Van Dorn, Laura O.; Villagrán, Dino; Wang, Xiaoping
• Journal of publication: Inorganic chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 1
• Pages of publication: 201 - 213
• a: 13.2005 ± 0.0017 Å
• b: 14.863 ± 0.002 Å
• c: 26.035 ± 0.003 Å
• α: 87.365 ± 0.002°
• β: 88.944 ± 0.002°
• γ: 76.617 ± 0.002°
• Cell volume: 4963.9 ± 1.1 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0553
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.0955
• Weighted residual factors for all reflections included in the refinement: 0.1054
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No