Information card for entry 2023342

Structure parameters

• Chemical name: <i>catena</i>-Poly[[(1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>^1^,<i>N</i>^4^,<i>N</i>^8^,<i>N</i>^11^)nickel(II)]-μ~2~-sulfato-κ^2^<i>O</i>^3^:<i>O</i>^4^]
• Formula: C10 H24 N4 Ni O4 S
• Calculated formula: C10 H24 N4 Ni O4 S
• Title of publication: Syntheses and structures of two coordination polymers formed by Ni(cyclam)2+ cations and sulfate anions
• Authors of publication: Tsymbal, Liudmyla V.; Andriichuk, Irina L.; Bahrin, Lucian G.; Lampeka, Yaroslaw D.
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2025
• Journal volume: 81
• Journal issue: 2
• a: 7.9935 ± 0.0006 Å
• b: 8.3181 ± 0.0006 Å
• c: 12.1998 ± 0.0009 Å
• α: 108.308 ± 0.007°
• β: 102.767 ± 0.007°
• γ: 99.145 ± 0.006°
• Cell volume: 727.87 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.053
• Residual factor for significantly intense reflections: 0.0379
• Weighted residual factors for significantly intense reflections: 0.0716
• Weighted residual factors for all reflections included in the refinement: 0.0795
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No