Vibrational properties of L-cysteine hydrochloride monohydrate crystal under high-pressure

• Published in: Vibrational spectroscopy 2018-09, Vol.98, p.92-97
• Main Authors: Silva Junior, J.F., Souza, G.D.S., Lima, C.L., Freire, P.T.C., Pinheiro, G.S.
• Format: Article
• Language: English
• Subjects: Amino acid; Amino acids; Ammonia; Chloride ions; Crystal structure; Cysteine; Diamond anvil cells; Diamonds; High-pressure; Hydrochloric acid; Hydrogen bonds; Raman spectra; Raman spectroscopy; Stability; Structural stability; Unit cell; Vibration analysis; Water chemistry
• ISSN: 0924-2031; 1873-3697
• DOI: 10.1016/j.vibspec.2018.07.003

•Raman spectroscopy investigation on L-cysteine hydrochloride monohydrate crystal under high pressure was carried out.•The crystal is stable under hydrostatic pressure up to 6.2 GPa.•No evidence of cracking of the crystalline sample or amorphization was observed. L-cysteine hydrochloride monohydrate crystals, C3H7NO2S·HCl·H2O, were studied by Raman spectroscopy as a function of pressure in a diamond anvil cell up to 6.2 GPa in the spectral range 3500−30 cm−1. From the analysis of the results, we inferred that the crystal is structurally stable in this pressure range. Some changes on the Raman spectra were observed for bands related to vibrational modes of the SH, NH3+, CH2, CCN, OH and COH units. These modifications were associated with conformational changes of the molecules in the unit cell undergone at high pressures. Comparing this behavior with those of L-cysteine, DL-cysteine and L-cysteine hydrochloride crystals in the same pressure range, we note greater stability for the hydrochloride monohydrate form. In the L-cysteine hydrochloride monohydrate crystal, the chloride ion and water molecule play an essential role in increasing the number of the hydrogen bonds, improving the structural stability of the crystal.