Geometry & MOs

Info

ID:	438801
PubChem CID:	135228558
Reduced:	ON2C33H42 (1)
Stoich.:	AB2C33D42 (1)
Weight, g/mol:	392.129156
ΔH_f, kcal/mol:	-10.67
Dipole, Da:	8.47
IP(EA), eV:	-7.88(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4,6-dimethyl-6-(5-phenylmethoxypyridin-2-yl)-7,8-dihydroquinolin-5-one

Drug info:

PubChemData

Smile

CCCC(=C)C1=CN2C(CC3=CC(=C(C=C3C2=CC1=O)CC)C4=CN(C(=C)C=C4)C(C)C)C(C)(C)C

DOS

IR

Vibrations