Geometry & MOs

Info

ID:	195842
PubChem CID:	78742352
Reduced:	OF3N3C21H24 (1)
Stoich.:	AB3C3D21E24 (1)
Weight, g/mol:	377.107479
ΔH_f, kcal/mol:	-136.97
Dipole, Da:	2.36
IP(EA), eV:	-8.88(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(3,4-difluoroanilino)-1-oxopropan-2-yl] 2-(4-acetylphenoxy)acetate

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)F)F)NCC(=O)N2CCN(CC2)CC3=CC=CC=C3F

DOS

IR

Vibrations