Geometry & MOs

Info

ID:	367158
PubChem CID:	127323574
Reduced:	O2N5C21H27 (1)
Stoich.:	A2B5C21D27 (1)
Weight, g/mol:	337.157246
ΔH_f, kcal/mol:	-42.23
Dipole, Da:	5.0
IP(EA), eV:	-9.47(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=NN2CC(CCC2=N1)NC(=O)C(C3=CC=CC=C3)N4CCCCC4=O

DOS

IR

Vibrations