Geometry & MOs

Info

ID:	402974
PubChem CID:	135058130
Reduced:	PO2S3H21C24 (1)
Stoich.:	AB2C3D21E24 (1)
Weight, g/mol:	265.146664
ΔH_f, kcal/mol:	-4.27
Dipole, Da:	4.37
IP(EA), eV:	-9.0(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[8-(4-methylphenyl)-3,4-dihydro-2H-quinolin-1-yl]ethanone

Drug info:

PubChemData

Smile

CCOC(=S)S/C(=C/P(=S)(C1=CC=CC=C1)C2=CC=CC=C2)/C3=CC=C(C=C3)C=O

DOS

IR

Vibrations