Information card for entry 2313064

Structure parameters

• Chemical name: <i>catena</i>-Poly[[[aqua(2,3-dimethylpyrazine-κ<i>N</i>)cadmium(II)]-di-μ-bromido] 2,3-dimethylpyrazine monosolvate hemihydrate]
• Formula: C12 H19 Br2 Cd N4 O1.5
• Calculated formula: C12 H19 Br2 Cd N4 O1.5
• Title of publication: Synthesis and crystal structure of <i>catena</i>-poly[[[aqua-(2,3-di-methyl-pyrazine-κ<i>N</i>)cadmium(II)]-di-μ-bromido] 2,3-di-methyl-pyrazine monosolvate hemihydrate].
• Authors of publication: Näther, Christian
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2026
• Journal volume: 82
• Journal issue: Pt 6
• Pages of publication: 743 - 746
• a: 7.7459 ± 0.0004 Å
• b: 15.4368 ± 0.0005 Å
• c: 14.1867 ± 0.0007 Å
• α: 90°
• β: 90.621 ± 0.004°
• γ: 90°
• Cell volume: 1696.23 ± 0.13 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.043
• Residual factor for significantly intense reflections: 0.0325
• Weighted residual factors for significantly intense reflections: 0.0842
• Weighted residual factors for all reflections included in the refinement: 0.0885
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No