Information card for entry 4337248

Structure parameters

• Common name: (H2TMhpp)2[W2(¦Ì-O)2(¦Ì-TMhpp)2Cl4]
• Formula: C46 H88 Cl8 N12 O2 W2
• Calculated formula: C46 H88 Cl8 N12 O2 W2
• Title of publication: A Strong Metal-to-Metal Interaction in an Edge-Sharing Bioctahedral Compound that Leads to a Very Short Tungsten-Tungsten Double Bond.
• Authors of publication: Chiarella, Gina M.; Cotton, F. Albert; Murillo, Carlos A.; Zhao, Qinliang
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 4
• Pages of publication: 2288 - 2295
• a: 17.952 ± 0.007 Å
• b: 19.56 ± 0.007 Å
• c: 17.598 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6179 ± 4 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 6
• 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: 0.1077
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.1088
• Weighted residual factors for all reflections included in the refinement: 0.1321
• Goodness-of-fit parameter for all reflections included in the refinement: 1.193
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No