Geometry & MOs

Info

ID:	191209
PubChem CID:	78118027
Reduced:	N4O5C17H22 (1)
Stoich.:	A4B5C17D22 (1)
Weight, g/mol:	273.172879
ΔH_f, kcal/mol:	-184.41
Dipole, Da:	4.5
IP(EA), eV:	-8.97(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-4-methyl-3-phenyl-3,4,4a,5,6,7,8,8a-octahydro-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CC1CN(C(=O)N(C1=O)C(=NC2=CC=CC=C2)N)C3CC(C(O3)CO)O

DOS

IR

Vibrations