Information card for entry 7102754

Structure parameters

• Formula: C40 H56 B2 Hg N12 O10 S6 W2
• Calculated formula: C40 H56 B2 Hg N12 O10 S6 W2
• Title of publication: A mercury bis(tricarbido) complex: [Hg{C triple bond C-C triple bond W(CO)2Tp}2(dmso)4](dmso)2 (Tp = hydrotrispyrazolylborate).
• Authors of publication: Dewhurst, Rian D; Hill, Anthony F; Willis, Anthony C
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2004
• Journal issue: 24
• Pages of publication: 2826 - 2827
• a: 9.3324 ± 0.0002 Å
• b: 12.464 ± 0.0002 Å
• c: 13.5127 ± 0.0002 Å
• α: 66.7946 ± 0.0008°
• β: 84.4796 ± 0.0007°
• γ: 86.4672 ± 0.0008°
• Cell volume: 1437.44 ± 0.04 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 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: 0.0446
• Residual factor for significantly intense reflections: 0.0262
• Weighted residual factors for all reflections: 0.0433
• Weighted residual factors for significantly intense reflections: 0.0288
• Weighted residual factors for all reflections included in the refinement: 0.0288
• Goodness-of-fit parameter for all reflections included in the refinement: 1.127
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No