Geometry & MOs

Info

ID:	301889
PubChem CID:	123099352
Reduced:	SN2O3C21H24 (1)
Stoich.:	AB2C3D21E24 (1)
Weight, g/mol:	416.140593
ΔH_f, kcal/mol:	-88.26
Dipole, Da:	7.26
IP(EA), eV:	-8.36(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfinyl-N-(2,4-dimethoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=O)CS(=O)CC(=O)N2CCCC3=CC=CC=C32

DOS

IR

Vibrations