Geometry & MOs

Info

ID:	268715
PubChem CID:	103600591
Reduced:	NF2O3C12H13 (1)
Stoich.:	AB2C3D12E13 (1)
Weight, g/mol:	243.0707
ΔH_f, kcal/mol:	-188.44
Dipole, Da:	2.27
IP(EA), eV:	-8.92(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[(2,2-difluoroacetyl)amino]benzoate

Drug info:

PubChemData

Smile

CN(CC1COC2=CC=CC=C2O1)C(=O)C(F)F

DOS

IR

Vibrations