Geometry & MOs

Info

ID:	24494
PubChem CID:	610604
Reduced:	NO2F3H14C21 (1)
Stoich.:	AB2C3D14E21 (1)
Weight, g/mol:	369.097663
ΔH_f, kcal/mol:	-158.5
Dipole, Da:	5.45
IP(EA), eV:	-9.35(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenyl-3-[3-(trifluoromethyl)anilino]-2-benzofuran-1-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)NC4=CC=CC(=C4)C(F)(F)F

DOS

IR

Vibrations