ポスター発表
- 第3日 5月21日（金） P1会場（Zoom）
-
3P-33 PDF
量子化学計算による結晶スポンジ-1,3-benzodioxole誘導体間の弱い相互作用評価とLDI-MS
Laser desorption ionization mass spectrometry (LDI-MS) was applied to the molecules encapsulated in the crystalline sponge (CS). The CS method has made it possible to investigate the presence of target molecules within the CS framework by single crystal X-ray analysis. In this study, DFT calculations were applied to 1,3-benzodioxole derivatives to investigate weak interactions among samples and the CS framework.