Acta Crystallographica Section B

Structural Science

Volume 64, Part 6 (December 2008)


research papers



Acta Cryst. (2008). B64, 780-790    [ doi:10.1107/S0108768108034526 ]

Chiral carboxylic acids and their effects on melting-point behaviour in co-crystals with isonicotinamide

A. Lemmerer, N. B. Báthori and S. A. Bourne

Abstract: The crystal structures of co-crystals of two systems of chiral carboxylic acids, optically active and racemic 2-phenylpropionic acid and 2-phenylbutyric acid, with isonicotinamide are reported to investigate the effects of the chirality of the chiral carboxylic acids on the melting point of the co-crystal complexes. It was found that the racemic co-crystal has a higher melting point than the optically active co-crystal, which correlates with the denser packing arrangement inherent in centrosymmetric space groups.

Keywords: co-crystals; chirality; Wallach's Rule; carboxylic acids; melting-point behaviour.


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X-ray diffraction patterns and DSC traces


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[ doi:10.1107/S0108768108034526/bs5070IVsup11.pdf ]
Raw XRD data fo IV


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[ doi:10.1107/S0108768108034526/bs5070Vsup12.pdf ]
Raw XRD data for V


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[ doi:10.1107/S0108768108034526/bs5070VIsup13.pdf ]
Raw XRD data for VI


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[ doi:10.1107/S0108768108034526/bs5070VIIsup14.pdf ]
Raw XRD data for VII


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[ doi:10.1107/S0108768108034526/bs5070VIIIsup15.pdf ]
Raw XRD data for VIII


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[ doi:10.1107/S0108768108034526/bs5070IXsup16.pdf ]
Raw XRD data for IX


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