Information card for entry 2023576

Structure parameters

• Chemical name: <i>catena</i>-Poly[[[bis(2,3-dimethylpyrazine-κ<i>N</i>^1^)cadmium(II)]-di-μ-chlorido] monohydrate]
• Formula: C12 H18 Cd Cl2 N4 O
• Calculated formula: C12 H18 Cd Cl2 N4 O
• Title of publication: Synthesis, crystal structure and thermal properties of catena-poly[[[bis(2,3-dimethylpyrazine-κN 1)cadmium(II)]-di-μ-chlorido] monohydrate]
• Authors of publication: Näther, Christian
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2026
• Journal volume: 82
• Journal issue: 10
• Pages of publication: 1230 - 1234
• a: 30.6316 ± 0.0015 Å
• b: 7.4391 ± 0.0003 Å
• c: 16.3857 ± 0.0008 Å
• α: 90°
• β: 121.538 ± 0.003°
• γ: 90°
• Cell volume: 3182.3 ± 0.3 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 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: 0.0628
• Residual factor for significantly intense reflections: 0.0469
• Weighted residual factors for significantly intense reflections: 0.1305
• Weighted residual factors for all reflections included in the refinement: 0.1433
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No