Geometry & MOs

Info

ID:	301891
PubChem CID:	123099364
Reduced:	SN2O3C23H28 (1)
Stoich.:	AB2C3D23E28 (1)
Weight, g/mol:	384.150764
ΔH_f, kcal/mol:	-97.66
Dipole, Da:	6.72
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-(2,6-dimethylphenyl)acetamide

Drug info:

PubChemData

Smile

CCCCC1=CC=C(C=C1)NC(=O)CS(=O)CC(=O)N2CCCC3=CC=CC=C32

DOS

IR

Vibrations