Geometry & MOs

Info

ID:	191964
PubChem CID:	78208358
Reduced:	NOC11H16 (2)
Stoich.:	ABC11D16 (2)
Weight, g/mol:	356.246378
ΔH_f, kcal/mol:	-113.11
Dipole, Da:	8.41
IP(EA), eV:	-9.16(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-[(6-ethyl-2-oxo-3,4,4a,5,6,7,8,8a-octahydro-1H-quinolin-3-yl)methyl]propanamide

Drug info:

PubChemData

Smile

CCC1CCC2C(C1)CC(C(=O)N2)CN(CC3=CC=C(C=C3)C)C(=O)C

DOS

IR

Vibrations