Ab initio calculations of the electronic structures of Dimethylnitrosamine (DMN) and its Metabolite Hydroxydimethylnitrosamine (HDMN): A possible intermediate in carcinogenesis by DMN

✍ Scribed by Anne Skancke; Colin Thomson

• Book ID: 104580588
• Publisher: John Wiley and Sons
• Year: 1982
• Tongue: English
• Weight: 617 KB
• Volume: 21
• Category: Article
• ISSN: 0020-7608
• DOI: 10.1002/qua.560210208

✦ Synopsis

Abstract

The structure of N,N'‐dimethylnitrosamine (DMN) and its α‐hydroxy derivative have been computed using the ab initio force method with a 4‐21 basis set. The results are compared with experiment for DMN.