Hollenwäger Dirk, Leitz Dominik, Bockmair Valentin, Kornath Andreas J
Department Chemie, Ludwig-Maximilians Universität, Butenandtstrasse 5-13 (Haus D), D-81377 München, Germany.
Acta Crystallogr C Struct Chem. 2025 Feb 1;81(Pt 2):77-81. doi: 10.1107/S2053229624012452. Epub 2025 Jan 8.
The monoprotonated species of 2-aminomalonyl difluoride, namely, 1,3-difluoro-1,3-dioxopropan-2-aminium dihydrogen trifluoride, [CHFNO][HF], was synthesized from sulfur tetrafluoride in anhydrous hydrogen fluoride (aHF) with [NH][CHNO] as the starting material. The solvent was removed and the salt was dissolved in aHF and crystallized. In the solid state, the three-dimensional network is built by medium-strong N-H...F hydrogen bonds and C...F contacts. This is the first structure determination of an aminoacyl difluoride and the second of an aminoacyl fluoride.
以[NH][CHNO]为原料,在无水氟化氢(aHF)中由四氟化硫合成了2-氨基丙二酰二氟的单质子化物种,即1,3-二氟-1,3-二氧代丙烷-2-铵二氢三氟化物,[CHFNO][HF]。除去溶剂,将盐溶解在aHF中并结晶。在固态中,三维网络由中等强度的N-H...F氢键和C...F接触构建而成。这是首次对氨基酰基二氟化物进行结构测定,也是第二次对氨基酰基氟化物进行结构测定。