openmolecules.org Forum: Bug Reports » Indolizidine stereochemistry

Home » DataWarrior » Bug Reports » Indolizidine stereochemistry (Chiral molecules are seen as undefined configuration)

Show: Today's Messages :: Polls :: Message Navigator

Re: Indolizidine stereochemistry [message #2076 is a reply to message #2075]

Fri, 05 January 2024 13:46

thomas
Messages: 729
Registered: June 2014

Senior Member

Hi CMW,

many thanks for the observation. This is indeed a bug, because the nitrogen atom was wrongly considered having a fixed pyramidal geometry due to the bi-cyclic structure. That will be fixed in the next update...

Thomas

Report message to a moderator

[Message index]

		Indolizidine stereochemistry By: cmw77 on Fri, 05 January 2024 11:31
		Re: Indolizidine stereochemistry By: thomas on Fri, 05 January 2024 13:46

Previous Topic:	MacOS (Sonoma) crash on start
Next Topic:	"Show Column Group Only" functionality not working in 6.0.0

Goto Forum:

-=] Back to Top [=-

[ Syndicate this forum (XML) ] [

] [

]

Current Time: Fri Apr 18 10:51:31 CEST 2025

Total time taken to generate the page: 0.03235 seconds