Water Clusters in Crystal: Beyond the “Hydrogen-Bonding Graphs”
✍ Scribed by Konstantin A. Lyssenko; Yulia V. Nelyubina; R. G. Kostyanovsky; Mikhail Yu. Antipin
- Publisher
- John Wiley and Sons
- Year
- 2006
- Tongue
- English
- Weight
- 148 KB
- Volume
- 7
- Category
- Article
- ISSN
- 1439-4235
No coin nor oath required. For personal study only.
📜 SIMILAR VOLUMES
The crystal structure of raffinose pentahydrate, O-alpha-D-galactopyranosyl-(1----6)-O-alpha-D-glucopyranosyl-(1----2)- beta-D- fructofuranose pentahydrate, C18H32O16.5H2O, has been redetermined using low-temperature, 119 K, CuK alpha X-ray data. All hydrogen atoms were unambiguously located on diff
The crystal structure of panose, O-alpha-D-glucopyranosyl-(1----6)-O-alpha-D-glucopyranosyl-(1----4)-D-gl ucose, C18H32O16, has been refined using low-temperature, 123 K, CuK alpha X-ray data. Difference syntheses and least-squares refinement showed a 16% substitution of alpha-panose by the beta ano
Fifteen different structures of the water hexamer found ab initio within ## Ž . the 6-311G d, p basis set in the interval of 1.75 kcalrmol above the global minimum represent an unprecedented wide range of conformational plasticity of liquid water. The present work also provides the first ab initi