Geometry & MOs

Info

ID:	367904
PubChem CID:	127326077
Reduced:	FON5C19H24 (1)
Stoich.:	ABC5D19E24 (1)
Weight, g/mol:	339.20591
ΔH_f, kcal/mol:	-33.75
Dipole, Da:	8.54
IP(EA), eV:	-9.19(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]-1-phenylpiperidin-2-one

Drug info:

PubChemData

Smile

CCC1=NN2CC(CCC2=N1)NC3CCCN(C3=O)C4=CC(=CC=C4)F

DOS

IR

Vibrations