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Crystal data of NaI3O8: Mr, 531.69 g mol-1, colorless square-prismatic crystal (0.2 x 0.3 x 0.3 mm3, tetragonal, space group P4 (no. 81, a, 8.082(1, c, 5.741(1) Å, V, 375.0(1) Å3, Z, 2, ρcalcd, 4.709 g cm-3, μ, 6.654 mm-1. NONIUS κ-CCD diffractometer, AgKα radiation (λ, 0.56087 Å, T, 293 K, 2θmax, 42.8°, 5444 measured and 830 independent reflections, R int, 0.027, R1, 0.017 (821 data with I > 2σ(I) and wR2, 0.039 (all 5444 data) for 55 refined parameters, GOF, 1.241, max./min. residual electron density 0.743/-0.828, Flack parameter 0.05(8, Corrections for Lorentz and polarization effects and empirical absorption correction (SADABS) were carried out. Structure was solved by direct methods with the SIR
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2, using the Shelxl software through the WinGX program suite. The refinement was performed with anisotropic thermal parameters for all atoms. Further details on the crystal structure investigations may be obtained from the Fachinformationszentrum Karlsruhe, 76344 Eggenstein-Leopoldshafen, Germany (fax: (+49)7247-808-666; e-mail: crysdata@fiz-karlsruhe.de), on quoting the depository number CSD-418336. A. Altomare, M. Cascarano, C. Giacovazzo, A. Guagliardi, J. Appl. Crystallogr. 1993, 26, 343;
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