Geometry & MOs

Info

ID:	276000
PubChem CID:	103819848
Reduced:	ClO3N4C10H13 (1)
Stoich.:	AB3C4D10E13 (1)
Weight, g/mol:	296.11207
ΔH_f, kcal/mol:	-104.04
Dipole, Da:	1.52
IP(EA), eV:	-9.49(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-amino-2-oxoethoxy)ethyl]-2-(methylamino)-5-nitrobenzamide

Drug info:

PubChemData

Smile

C1=C(C=C(N=C1N)Cl)C(=O)NCCOCC(=O)N

DOS

IR

Vibrations