Geometry & MOs

Info

ID:	405318
PubChem CID:	135073471
Reduced:	NOC18H27 (1)
Stoich.:	ABC18D27 (1)
Weight, g/mol:	331.157229
ΔH_f, kcal/mol:	-46.54
Dipole, Da:	0.72
IP(EA), eV:	-9.29(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-methoxynaphthalen-2-yl)-6,6-dimethyl-7,8-dihydroquinolin-5-one

Drug info:

PubChemData

Smile

CCC(CC)(CCC1=NC(CO1)(C)C)C2=CC=CC=C2

DOS

IR

Vibrations