| Literature DB >> 17105251 |
Kacey Claborn1, Javier Herreros Cedres, Christine Isborn, Alexey Zozulya, Edgar Weckert, Werner Kaminsky, Bart Kahr.
Abstract
The optical rotatory power of achiral crystals of achiral pentaerythritol molecules was measured. The maximum rotations were found to be +/-6 degrees /mm. The quantum mechanically computed rotation of pentaerythritol molecules using linear response theory was 6 times larger although the experimental and theoretical tensors were similarly oriented to within 5 degrees .Entities:
Year: 2006 PMID: 17105251 DOI: 10.1021/ja064631q
Source DB: PubMed Journal: J Am Chem Soc ISSN: 0002-7863 Impact factor: 15.419