Realization of an Al≡Al Triple Bond in the Gas‐Phase Na3Al2− Cluster via Double Electronic Transmutation

Abstract

The discovery of homodinuclear multiple bonds composed of Group 13 elements represents one of the most challenging frontiers in modern chemistry. A classical triple bond such as N≡N and HC≡CH contains one σ bond and two π bonds constructed from the p orbitals perpendicular to the σ bond. However, the traditional textbook triple bond between two Al atoms has remained elusive. Here we report an Al≡Al triple bond in the designer Na3Al2− cluster predicted in silico, which was subsequently generated by pulsed arc discharge followed by mass spectrometry and photoelectron spectroscopy characterizations. Being effectively Al2− due to the electron donation from Na, the Al atoms in Na3Al2− undergo a double electronic transmutation into Group 15 elements, thus the Al2−≡Al2− kernel mimics the P≡P and N≡N molecules. We anticipate this work will stimulate more endeavors in discovering materials using Al2−≡Al2− as a building block in the gas phase and in the solid state.

Document Details

Document Type
Pub Defense Publication
Publication Date
Sep 21, 2018
Source ID
10.1002/ange.201806917

Entities

People

  • Alexander I. Boldyrev
  • Chaonan Mu
  • Hansgeorg Schnöckel
  • Haopeng Wang
  • Ivan A. Popov
  • Katie A. Lundell
  • Kit H Bowen
  • Wei Wang
  • Xinxing Zhang

Organizations

  • Air Force Office of Scientific Research
  • Johns Hopkins University
  • Karlsruhe Institute of Technology
  • Los Alamos National Laboratory
  • Nankai University
  • National Science Foundation
  • Utah State University

Tags

Readers

  • Organic Chemistry
  • Quantum Chemistry
  • Systems Analysis and Design

Technology Areas

  • Microelectronics
  • Space