Geometry & MOs

Info

ID:	194442
PubChem CID:	78537088
Reduced:	ClN3O4C20H22 (1)
Stoich.:	AB3C4D20E22 (1)
Weight, g/mol:	305.08635
ΔH_f, kcal/mol:	-152.38
Dipole, Da:	4.09
IP(EA), eV:	-8.74(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-fluoroanilino)-1-oxopropan-2-yl] 3-fluorobenzoate

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=O)COC(=O)CC(C2=CC=CC=C2Cl)NC(=O)N

DOS

IR

Vibrations