Nucleus-independent chemical shifts (NICS) as an aromaticity criterion

Z Chen, CS Wannere, C Corminboeuf, R Puchta… - Chemical …, 2005 - ACS Publications
Few concepts are as frequently used as aromaticity in the current chemical literature. 1 This
may be quantified by ca. 300 000 papers dealing with the aromatic properties of chemical …

Organic azides: an exploding diversity of a unique class of compounds

S Bräse, C Gil, K Knepper… - Angewandte Chemie …, 2005 - Wiley Online Library
Since the discovery of organic azides by Peter Grieß more than 140 years ago, numerous
syntheses of these energy‐rich molecules have been developed. In more recent times in …

[图书][B] Molecular orbitals and organic chemical reactions

I Fleming - 2011 - books.google.com
Winner of the PROSE Award for Chemistry & Physics 2010 Acknowledging the very best in
professional and scholarly publishing, the annual PROSE Awards recognise publishers' and …

Teaching a neural network to attach and detach electrons from molecules

R Zubatyuk, JS Smith, BT Nebgen, S Tretiak… - Nature …, 2021 - nature.com
Interatomic potentials derived with Machine Learning algorithms such as Deep-Neural
Networks (DNNs), achieve the accuracy of high-fidelity quantum mechanical (QM) methods …

[图书][B] Modern acetylene chemistry

PJ Stang, F Diederich - 2008 - books.google.com
This comprehensive handbook presents the full potential of modern acetylene chemistry,
from organic synthesis through materials science to bioorganic chemistry. K. Houk, H. Hopf …

Topology in chemistry: designing Möbius molecules

R Herges - Chemical reviews, 2006 - ACS Publications
In 1747, Johann Sebastian Bach wrote a series of canons and fugues on the occasion of his
visit to King Frederick the Great of Prussia in Potsdam. His music of homage, the …

Organische Azide–explodierende Vielfalt bei einer einzigartigen Substanzklasse

S Bräse, C Gil, K Knepper… - Angewandte Chemie, 2005 - Wiley Online Library
Seit der Entdeckung der organischen Azide vor über einhundertvierzig Jahren durch Peter
Grieß wurde eine Reihe von Synthesen für diese energiereichen Moleküle entwickelt. In …

Möbius aromaticity and delocalization

HS Rzepa - Chemical reviews, 2005 - ACS Publications
The Möbius strip is named after the theoretical astronomer and mathematician August
Ferdinand Möbius (1790-1868). In a memoir, presented to the French Academie of …

Flash vacuum pyrolysis of azides, triazoles, and tetrazoles

C Wentrup - Chemical Reviews, 2017 - ACS Publications
Flash vacuum pyrolysis (FVP) of azides is an extremely valuable method of generating
nitrenes and studying their thermal rearrangements. The nitrenes can in many cases be …

Recent advances in the chemistry of indazoles

A Schmidt, A Beutler… - European Journal of …, 2008 - Wiley Online Library
Indazoles are of considerable interest due to the broad variety of their biological activities.
This overview summarizes structures of pharmacologically interesting indazoles published …