Geometry & MOs

Info

ID:	38660
PubChem CID:	8137362
Reduced:	F2N2O5H14C18 (1)
Stoich.:	A2B2C5D14E18 (1)
Weight, g/mol:	374.107813
ΔH_f, kcal/mol:	-171.37
Dipole, Da:	2.17
IP(EA), eV:	-9.07(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-[4-(2-oxopyrrolidin-1-yl)anilino]ethyl] 3,4-difluorobenzoate

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC(=C(C=C3)F)F)OC

DOS

IR

Vibrations