Geometry & MOs

Info

ID:	149049
PubChem CID:	53788720
Reduced:	SN2F3O6C18H19 (1)
Stoich.:	AB2C3D6E18F19 (1)
Weight, g/mol:	483.182792
ΔH_f, kcal/mol:	-333.02
Dipole, Da:	2.15
IP(EA), eV:	-8.59(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dimethylphenoxy)-N-[4-methoxy-3-(4-methylanilino)sulfinamoyloxyphenyl]propanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1OC)OC)OS(=O)(=O)NNC2=C(C=C(C=C2)C(=O)C)C(F)(F)F

DOS

IR

Vibrations