FLUORESCENCE OF CYSTEINE AND CYSTINE

Citation
Hf. Hameka et al., FLUORESCENCE OF CYSTEINE AND CYSTINE, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 102(2), 1998, pp. 361-367
Citations number
15
Categorie Soggetti
Chemistry Physical
ISSN journal
10895639
Volume
102
Issue
2
Year of publication
1998
Pages
361 - 367
Database
ISI
SICI code
1089-5639(1998)102:2<361:FOCAC>2.0.ZU;2-Z
Abstract
We interpret the UV absorption and fluorescence of cysteine and cystin e from ab initio calculations of the ground states and lowest excited singlet states of the two molecules. We derive the optimized energies and geometry parameters from HF/6-31G computations on the ground state and CIS/6-31G computations of the excited state. We present vibration al frequencies of the ground and excited states and quantitative predi ctions for UV absorption and fluorescence. We also show experimental m easurements of cystine fluorescence. Cystine is shown to fluoresce at 700 nm.