左乙拉西坦
氢键
单斜晶系
结晶学
晶体结构
Crystal(编程语言)
材料科学
粉末衍射
结晶
红外光谱学
化学计量学
化学
分子
有机化学
医学
精神科
程序设计语言
计算机科学
癫痫
作者
Lingling Shi,Zhengguo Chen,Hany Kafafy,Zhaoxia Zhang,Guocheng Zhu,Juming Yao,Guoqing Zhang
出处
期刊:Powder Diffraction
[Cambridge University Press]
日期:2023-10-16
卷期号:38 (4): 244-252
被引量:2
标识
DOI:10.1017/s0885715623000374
摘要
( S )-α-Ethyl-2-oxo-1-pyrrolidineacetamide (trade name levetiracetam), a derivative of piracetam, is used clinically as an add-on treatment for partial-onset seizures. In this study, we report the solid-state structure of a new drug co-crystal produced from levetiracetam and 3,5-dinitrosalicylic acid through cooling crystallization. This compound was further characterized by infrared spectroscopy, powder X-ray diffraction, and single-crystal X-ray diffraction. The new co-crystals show a 1:1 stoichiometry and crystallize in the monoclinic system, space group P 2 1 , with cell parameters: a = 9.7709(3) Å, b = 6.2202(2) Å, c = 14.7280(4) Å, α = 90°, β = 96.0340(10)°, γ = 90°, V = 890.16(5) Å 3 , and Z = 2. It is identified that hydrogen bonds are the main interactions between levetiracetam and 3,5-dinitrosalicylic acid, and the contribution of each hydrogen bond in maintaining the stability of the crystal structure was also quantified using Hirshfeld surface analysis.
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