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Home » DataWarrior » Bug Reports » Name to structure - Triple bonds are not parsed
Name to structure - Triple bonds are not parsed [message #149] Thu, 18 February 2016 12:38 Go to previous message
MaxPeters is currently offline  MaxPeters
Messages: 1
Registered: February 2016
Junior Member
Entering the SMILES for HCN:
C#N
in the web form results in
CH4.
The same is true for organic nitriles, they either result in terminal groups or parsing errors.
 
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