Geometry & MOs

Info

ID:	278809
PubChem CID:	103838516
Reduced:	ClN4O5C10H11 (1)
Stoich.:	AB4C5D10E11 (1)
Weight, g/mol:	285.076099
ΔH_f, kcal/mol:	-101.76
Dipole, Da:	4.36
IP(EA), eV:	-10.28(-1.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-amino-2-oxoethoxy)ethyl]-3-fluoro-4-nitrobenzamide

Drug info:

PubChemData

Smile

C1=CN=C(C(=C1C(=O)NCCOCC(=O)N)[N+](=O)[O-])Cl

DOS

IR

Vibrations