Research output: Contribution to journal › Article › peer-review
L-Cysteine halogenides : A new family of salts with an l-cysteine"l-cysteinium dimeric cation. / Ghazaryan, V. V.; Minkov, V. S.; Boldyreva, E. V. et al.
In: Journal of Molecular Structure, Vol. 1121, 05.10.2016, p. 60-69.Research output: Contribution to journal › Article › peer-review
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TY - JOUR
T1 - L-Cysteine halogenides
T2 - A new family of salts with an l-cysteine"l-cysteinium dimeric cation
AU - Ghazaryan, V. V.
AU - Minkov, V. S.
AU - Boldyreva, E. V.
AU - Petrosyan, A. M.
PY - 2016/10/5
Y1 - 2016/10/5
N2 - Two l-cysteinium-halogenides with (l-cysteine···l-cysteinium) dimeric cations have been obtained, (l-Cys"l-Cys+)·Cl-, and (l-Cys"l-Cys+)·Br-. Both salts crystallize in monoclinic space group P21. Although these salts have the same dimeric cations and isotypical halogen anions, crystal packing is different. The main difference between the two salts rests in the conformation of (l-Cys"l-Cys+) dimeric cation, which also differs from that of the dimeric cation in the previously reported compound l-Cys+(l-Cys"l-Cys+)·F-·(F-"HF). The dimeric cation is formed by a very short O-H"O hydrogen bond with d(O···O) of 2.449(2) Å and 2.435(11) Å in the chloride and bromide, respectively. In addition to crystal structure analysis, Infrared and Raman spectra have been registered and discussed with a particular focus on intermolecular interactions. The l-Cys+·Br-·H2O salt with a simple l-cysteinium cation was also obtained and the crystal structure solved. It resembles its chloride analogue, l-Cys+·Cl-·H2O.
AB - Two l-cysteinium-halogenides with (l-cysteine···l-cysteinium) dimeric cations have been obtained, (l-Cys"l-Cys+)·Cl-, and (l-Cys"l-Cys+)·Br-. Both salts crystallize in monoclinic space group P21. Although these salts have the same dimeric cations and isotypical halogen anions, crystal packing is different. The main difference between the two salts rests in the conformation of (l-Cys"l-Cys+) dimeric cation, which also differs from that of the dimeric cation in the previously reported compound l-Cys+(l-Cys"l-Cys+)·F-·(F-"HF). The dimeric cation is formed by a very short O-H"O hydrogen bond with d(O···O) of 2.449(2) Å and 2.435(11) Å in the chloride and bromide, respectively. In addition to crystal structure analysis, Infrared and Raman spectra have been registered and discussed with a particular focus on intermolecular interactions. The l-Cys+·Br-·H2O salt with a simple l-cysteinium cation was also obtained and the crystal structure solved. It resembles its chloride analogue, l-Cys+·Cl-·H2O.
KW - Crystal structure
KW - Dimeric cation
KW - Halogenides
KW - L-cysteine
KW - Short hydrogen bond
KW - Vibrational spectra
UR - http://www.scopus.com/inward/record.url?scp=84971539081&partnerID=8YFLogxK
U2 - 10.1016/j.molstruc.2016.05.049
DO - 10.1016/j.molstruc.2016.05.049
M3 - Article
AN - SCOPUS:84971539081
VL - 1121
SP - 60
EP - 69
JO - Journal of Molecular Structure
JF - Journal of Molecular Structure
SN - 0022-2860
ER -
ID: 25462065