Geometry & MOs

Info

ID:	34348
PubChem CID:	7890870
Reduced:	N2O3C17H18 (1)
Stoich.:	A2B3C17D18 (1)
Weight, g/mol:	333.076099
ΔH_f, kcal/mol:	-99.0
Dipole, Da:	7.35
IP(EA), eV:	-8.28(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-fluoro-3-nitroanilino)-2-oxoethyl] 4-aminobenzoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)COC(=O)C2=CC=C(C=C2)N)C

DOS

IR

Vibrations