Geometry & MOs

Info

ID:	388391
PubChem CID:	134989028
Reduced:	NOC15H17 (1)
Stoich.:	ABC15D17 (1)
Weight, g/mol:	170.118104
ΔH_f, kcal/mol:	29.74
Dipole, Da:	5.18
IP(EA), eV:	-8.48(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

6-ethoxy-1-ethyl-4,5-dihydro-3H-pyridin-1-ium-2-one

Drug info:

PubChemData

Smile

C1CCCN2C(=CC3=CC=CC=C3C2=O)CC1

DOS

IR

Vibrations