化学
两性离子
氢键
精氨酸
质子化
分子间力
亚胺离子
冰毒-
半水合物
立体化学
甜菜碱
结晶学
氨基酸
生物信息学
药物化学
分子
离子
有机化学
单体
聚合物
生物化学
古生物学
石膏
丙烯酸酯
生物
作者
M. Sethuram,G. Bhargavi,M. Dhandapani,G. Amirthaganesan,M. NizamMohideen
标识
DOI:10.1107/s1600536813019727
摘要
The title compound, C14H20N4O4·0.5H2O [systematic name: (2S)-5-{[amino-(iminium-yl)meth-yl]amino}-2-{[(1Z)-4-meth-oxy-2-oxido-benzyl-idene]aza-nium-yl}penta-noate hemihydrate], has been synthesized by the reaction of l-arginine and 4-meth-oxy-salicyl-aldehyde and crystallizes with two independent substituted l-arginine mol-ecules and one water mol-ecule of solvation in the asymmetric unit. Each mol-ecule exists as a zwitterion and adopts a Z configuration about the central C=N. The mol-ecular conformation is stabilized by strong intra-molecular N-H⋯O hydrogen bonds that generate S(6) and S(10) ring motifs. Inter-molecular N-H⋯O and O-H⋯O hydrogen bonds involving also the water mol-ecule and weak inter-molecular C-H⋯Owater inter-actions link the mol-ecules into an infinite one-dimensional ribbon structure extending along the b axis. The known (2S) absolute configuration for l-arginine was invoked. Weak intermolecular C-H⋯π interactions are also present.
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