Geometry & MOs

Info

ID:	35289
PubChem CID:	7979634
Reduced:	SN3O5C20H21 (1)
Stoich.:	AB3C5D20E21 (1)
Weight, g/mol:	325.092578
ΔH_f, kcal/mol:	-134.64
Dipole, Da:	9.89
IP(EA), eV:	-10.21(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylphenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide

Drug info:

PubChemData

Smile

CC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)NCC(=O)OCC2=CC=C(C=C2)C#N

DOS

IR

Vibrations