Geometry & MOs

Info

ID:	367442
PubChem CID:	127324625
Reduced:	ClON5C17H20 (1)
Stoich.:	ABC5D17E20 (1)
Weight, g/mol:	369.216475
ΔH_f, kcal/mol:	2.14
Dipole, Da:	3.06
IP(EA), eV:	-8.94(-0.25)
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-(4-methoxyphenyl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=NN2CC(CCC2=N1)NC(=O)N3CCC4=C3C=C(C=C4)Cl

DOS

IR

Vibrations