Geometry & MOs

Info

ID:	131304
PubChem CID:	51188381
Reduced:	SO2N3C13H13 (1)
Stoich.:	AB2C3D13E13 (1)
Weight, g/mol:	354.120213
ΔH_f, kcal/mol:	-41.95
Dipole, Da:	5.01
IP(EA), eV:	-8.48(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-fluorophenyl)ethyl]-2-quinolin-8-ylsulfanylpropanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC(=O)N)SC1=CC=CC2=C1N=CC=C2

DOS

IR

Vibrations