| Semiempirical Quantum Calculations of Chiral Pillararene decorated with Alphahydroxyglycine for Enantioseparation of D-glucose and L-glucose |
| کد مقاله : 1241-PHYCHEM23 |
| نویسندگان |
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امیر فلاح لاله زاری1، آریا صبوری املشی1، عفت جمالیزاده *2 1دانشگاه شهید باهنر کرمان 2گروه شیمی- دانشکده علوم- دانشگاه شهید باهنر کرمان |
| چکیده مقاله |
| Glucose, consumed widely every day, has two L and D enantiomers. The semiempirical PM7 method was utilized to investigate enantiomer separation of glucose with different enantioselective pillararenes. Also, alpha-hydroxyglycinepillar[6]arene (AHGP6) has been introduced as a new glucose enantioselective molecule, and the separation of glucose enantiomers by differently decorated pillararene has been calculated. Also, the effect of pillararenes’ ring size on the enantioseparation has been investigated. |
| کلیدواژه ها |
| Enantiomer separation; Glucose; Pillararene; Semiempirical quantum calculations; PM7 |
| وضعیت: پذیرفته شده برای ارسال فایل های ارائه پوستر |