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Acta Cryst. (2007). E63, m360-m362  [ doi:10.1107/S160053680605553X ]

Calcium anilate hexahydrate

M. U. Schmidt, T. Schmiermund and M. Bolte

Abstract: Anilic acid or 2,5-dianilinoterephthalic acid, C20H16N2O4, is an intermediate in the industrial synthesis of quinacridone pigments. The title calcium aniloate compound, namely di-[mu]-aqua-[kappa]4O1:O1'-bis([mu]-2,5-dianilinoterephthalo-[kappa]2O:O')bis[triaquacalcium(II)] tetrahydrate, [Ca2(C20H14N2O4)2(H2O)8]·4H2O, is a dimeric complex of two aniloate anions, two Ca2+ cations and eight water molecules, with a further four uncoordinated water molecules. The complex is situated on a crystallographic twofold axis, with two water O atoms lying on the rotation axis.

Online 10 January 2007


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