The isolation of a metastable conglomerate using a combined computational and controlled crystallization approach

Roger J. Davey; Ghazala Sadiq; Kevin Back; Laura Wilkinson; Colin C. Seaton

doi:10.1039/c1cc16173c

The isolation of a metastable conglomerate using a combined computational and controlled crystallization approach

Roger J. Davey, Ghazala Sadiq, Kevin Back, Laura Wilkinson, Colin C. Seaton

Research output: Contribution to journal › Article › peer-review

Abstract

While the use of additives to control the crystallization of polymorphs is well known, similar methodology to promote the crystallization of a metastable conglomerate over a stable racemic compound in enantiomeric systems has not been reported. Here we demonstrate this phenomenon in the case of 2-chloromandelic acid. © 2012 The Royal Society of Chemistry.

Original language	English
Pages (from-to)	1976-1978
Number of pages	2
Journal	Chemical Communications
Volume	48
Issue number	14
DOIs	https://doi.org/10.1039/c1cc16173c
Publication status	Published - 14 Feb 2012

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10.1039/c1cc16173c

CCDC 838590: Experimental Crystal Structure Determination
Davey, R. (Contributor), Sadiq, G. (Contributor), Back, K. (Contributor), Wilkinson, L. (Contributor) & Seaton, C. C. (Contributor), Cambridge Crystallographic Data Centre, 1 Jan 2012
DOI: 10.5517/ccx4m9y, http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccx4m9y&sid=DataCite
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title = "The isolation of a metastable conglomerate using a combined computational and controlled crystallization approach",

abstract = "While the use of additives to control the crystallization of polymorphs is well known, similar methodology to promote the crystallization of a metastable conglomerate over a stable racemic compound in enantiomeric systems has not been reported. Here we demonstrate this phenomenon in the case of 2-chloromandelic acid. {\textcopyright} 2012 The Royal Society of Chemistry.",

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AU - Davey, Roger J.

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AU - Seaton, Colin C.

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N2 - While the use of additives to control the crystallization of polymorphs is well known, similar methodology to promote the crystallization of a metastable conglomerate over a stable racemic compound in enantiomeric systems has not been reported. Here we demonstrate this phenomenon in the case of 2-chloromandelic acid. © 2012 The Royal Society of Chemistry.

AB - While the use of additives to control the crystallization of polymorphs is well known, similar methodology to promote the crystallization of a metastable conglomerate over a stable racemic compound in enantiomeric systems has not been reported. Here we demonstrate this phenomenon in the case of 2-chloromandelic acid. © 2012 The Royal Society of Chemistry.

U2 - 10.1039/c1cc16173c

DO - 10.1039/c1cc16173c

M3 - Article

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SP - 1976

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JO - Chemical Communications

JF - Chemical Communications

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The isolation of a metastable conglomerate using a combined computational and controlled crystallization approach

Abstract

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CCDC 838590: Experimental Crystal Structure Determination

Cite this