Information card for entry 2243899

Structure parameters

• Chemical name: μ-Aqua-1:2κ^2^<i>O</i>:<i>O</i>-heptaaqua-1κ^3^<i>O</i>,2κ^2^<i>O</i>,3κ^2^<i>O</i>-bis(μ-4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-olato)-1:2κ^2^<i>O</i>^2^:<i>N</i>^1^;2:3κ^2^<i>N</i>^1^:<i>O</i>^2^-bis(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-olato)-1κ<i>O</i>^2^,3κ<i>O</i>^2^-2-cadmium-1,3-disodium
• Formula: C12 H24 Cd N12 Na2 O20
• Calculated formula: C12 H24 Cd N12 Na2 O20
• Title of publication: Synthesis and crystal structure of a heterobimetallic cadmium‒sodium complex of 1,3,5-triazine-2,4,6-trione, [CdNa~2~(C~3~H~2~N~3~O~3~)~4~(H~2~O)~8~]
• Authors of publication: Divya, R.; Bijini, B. R.; Dhanya, V. S.; Babu, K. Rajendra; Sithambaresan, M.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2021
• Journal volume: 77
• Journal issue: 9
• a: 7.0501 ± 0.0003 Å
• b: 10.0314 ± 0.0005 Å
• c: 19.5058 ± 0.0009 Å
• α: 101.023 ± 0.001°
• β: 90.468 ± 0.001°
• γ: 97.233 ± 0.001°
• Cell volume: 1342.53 ± 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: 0.028
• Residual factor for significantly intense reflections: 0.0243
• Weighted residual factors for significantly intense reflections: 0.0614
• Weighted residual factors for all reflections included in the refinement: 0.0633
• Goodness-of-fit parameter for all reflections included in the refinement: 1.2
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes