Geometry & MOs

Info

ID:	356335
PubChem CID:	127291408
Reduced:	SO2N5C17H27 (1)
Stoich.:	AB2C5D17E27 (1)
Weight, g/mol:	349.157246
ΔH_f, kcal/mol:	-75.41
Dipole, Da:	3.22
IP(EA), eV:	-9.38(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(cyclobutanecarbonyl)-N-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)C3CSCN3C(=O)CC(C)(C)C

DOS

IR

Vibrations