Geometry & MOs

Info

ID:	438317
PubChem CID:	135228050
Reduced:	FOSN2C16H17 (1)
Stoich.:	ABCD2E16F17 (1)
Weight, g/mol:	320.135863
ΔH_f, kcal/mol:	-20.04
Dipole, Da:	4.4
IP(EA), eV:	-8.43(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-fluoropyridin-2-yl)-1-phenylethyl]-2-methylpropane-2-sulfinamide

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C(NS1=O)(C)C3=C(C=CC=N3)F)C

DOS

IR

Vibrations