Information card for entry 7223797

Structure parameters

• Chemical name: bis(2-Iodo)-diiodo-bis(quinoline)-di-mercury
• Formula: C18 H14 Hg2 I4 N2
• Calculated formula: C18 H14 Hg2 I4 N2
• SMILES: c1ccc2c(cccc2)[n]1[Hg]1([I][Hg]([I]1)(I)[n]1cccc2c1cccc2)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: 8.0024 ± 0.0005 Å
• b: 8.7714 ± 0.0006 Å
• c: 9.5211 ± 0.0006 Å
• α: 86.141 ± 0.002°
• β: 67.909 ± 0.002°
• γ: 71.203 ± 0.002°
• Cell volume: 585.11 ± 0.07 ų
• Cell temperature: 569 ± 2 K
• Ambient diffraction temperature: 569 ± 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: 0.0629
• Residual factor for significantly intense reflections: 0.0553
• Weighted residual factors for significantly intense reflections: 0.1415
• Weighted residual factors for all reflections included in the refinement: 0.1483
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No