Information card for entry 7223798

Structure parameters

• Chemical name: bis(2-Iodo)-diiodo-bis(phenazine)-di-mercury
• Formula: C26 H18 Hg2 I4 N2
• Calculated formula: C26 H18 Hg2 I4 N2
• SMILES: c12ccccc2cc2ccccc2[n]1[Hg]1([I][Hg]([I]1)(I)[n]1c2ccccc2cc2ccccc12)I
• Title of publication: Structures and trends of one-dimensional halide-bridged polymers of five-coordinate cadmium(ii) and mercury(ii) with benzopyridine and -pyrazine-type N-donor ligands
• Authors of publication: Slabbert, C.; Rademeyer, M.
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 47
• Pages of publication: 9070
• a: 8.1694 ± 0.0004 Å
• b: 9.1306 ± 0.0004 Å
• c: 9.9609 ± 0.0005 Å
• α: 84.347 ± 0.002°
• β: 70.877 ± 0.002°
• γ: 77.262 ± 0.002°
• Cell volume: 684.44 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0257
• Residual factor for significantly intense reflections: 0.0256
• Weighted residual factors for significantly intense reflections: 0.0677
• Weighted residual factors for all reflections included in the refinement: 0.0678
• Goodness-of-fit parameter for all reflections included in the refinement: 1.207
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No