Minkov Vasily S, Boldyreva Elena V
REC-008, Novosibirsk State University, Pirogov str. 2, Novosibirsk 630090, Russian Federation.
Acta Crystallogr C. 2009 May;65(Pt 5):o245-7. doi: 10.1107/S010827010901350X. Epub 2009 Apr 25.
Two chiral counterparts (L- and D-cysteinium cations related by an inversion centre) are present in the structure of the title compound, C(3)H(8)NO(2)S(+).C(2)HO(4)(-), with a 1:1 cation-anion ratio. The carboxy group of the cysteinium cation is protonated in the trans position relative to the amino group. The crystal structure is built up of double layers, in which dimers of cysteinium cations are connected to each other not directly, but via bridges of twisted semioxalate anions linked to each other via O-H...O hydrogen bonds forming infinite chains. An interesting feature of the crystal structure is the absence of either S-H...S or S-H...O hydrogen bonds.
标题化合物C(3)H(8)NO(2)S(+).C(2)HO(4)(-)的结构中存在两个手性对应物(通过对称中心相关的L-和D-半胱氨酸阳离子),阳离子与阴离子的比例为1:1。半胱氨酸阳离子的羧基在相对于氨基的反式位置被质子化。晶体结构由双层组成,其中半胱氨酸阳离子二聚体并非直接相互连接,而是通过扭曲的半草酸盐阴离子桥相互连接,这些阴离子通过O-H...O氢键相互连接形成无限链。晶体结构的一个有趣特征是不存在S-H...S或S-H...O氢键。