Geometry & MOs

Info

ID:	160556
PubChem CID:	57389035
Reduced:	SN2F3O4C18H19 (1)
Stoich.:	AB2C3D4E18F19 (1)
Weight, g/mol:	462.089484
ΔH_f, kcal/mol:	-274.06
Dipole, Da:	4.3
IP(EA), eV:	-9.08(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-methoxyphenyl)sulfanylethyl]-2-methyl-2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylpropanamide

Drug info:

PubChemData

Smile

CC(C)(C(=O)NCCOC1=CC=CC=C1)S(=O)(=O)C2=NC=C(C=C2)C(F)(F)F

DOS

IR

Vibrations