Information card for entry 7009498

Structure parameters

• Common name: C6F4Hg2Cl2-THF-0.5benzene
• Formula: C13 H11 Cl2 F4 Hg2 O
• Calculated formula: C13 H11 Cl2 F4 Hg2 O
• Title of publication: Interaction of benzene and 1,2-bis(chloromercurio)tetrafluorobenzene. Supramolecular frameworks based on Hg · · · Cl, Hg · · · F, Hg · · · π and π‒π interactions
• Authors of publication: Gardinier, James R.; Gabbaï, François P.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 16
• Pages of publication: 2861
• a: 29.042 ± 0.002 Å
• b: 7.1266 ± 0.0006 Å
• c: 20.5464 ± 0.0017 Å
• α: 90°
• β: 124.922 ± 0.001°
• γ: 90°
• Cell volume: 3486.8 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0637
• Residual factor for significantly intense reflections: 0.0546
• Weighted residual factors for significantly intense reflections: 0.1312
• Weighted residual factors for all reflections included in the refinement: 0.1377
• Goodness-of-fit parameter for all reflections included in the refinement: 0.943
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No