Dipole-Induced Polymorphs of trans-2-Hydroxycycloheptanecarboxylic Acid with Virtually the Same Unit Cell

The polymorphs of trans-2-hydroxycycloheptanecarboxylic acid have exactly the same lattice parameters and thus mimic isomorphism. They differ only in their space group:  Pna21 versus Pn21 a. In form II, the screw axes turn the 18-membered rings of hydrogen-bonded tetramers around the b axis. In this...

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Veröffentlicht in:Journal of the American Chemical Society 2003-01, Vol.125 (1), p.34-35
Hauptverfasser: Kálmán, Alajos, Fábián, László, Argay, Gyula, Bernáth, Gábor, Gyarmati, Zsuzsanna
Format: Artikel
Sprache:eng
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Zusammenfassung:The polymorphs of trans-2-hydroxycycloheptanecarboxylic acid have exactly the same lattice parameters and thus mimic isomorphism. They differ only in their space group:  Pna21 versus Pn21 a. In form II, the screw axes turn the 18-membered rings of hydrogen-bonded tetramers around the b axis. In this way, the stacking of the layers becomes antiparallel, which cancels out the dipoles within the unit cell. In form I, the same turn around the c axis leaves the stacking of the layers parallel. Thus, the dipoles are canceled out by antiparallel domains in the crystals. Between the antiparallel domains of I, each frontier is a double layer of II. This implies that (a) a pure form of I cannot be isolated and (b) the percentage of II in I may alter from crystal to crystal.
ISSN:0002-7863
1520-5126
DOI:10.1021/ja0289447