Geometry & MOs

Info

ID:	23121
PubChem CID:	602112
Reduced:	ON2C5H7 (2)
Stoich.:	AB2C5D7 (2)
Weight, g/mol:	222.111676
ΔH_f, kcal/mol:	10.26
Dipole, Da:	7.44
IP(EA), eV:	-8.96(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-nitro-5-piperazin-1-ylaniline

Drug info:

PubChemData

Smile

C1CN(CCN1)C2=CC(=C(C=C2)[N+](=O)[O-])N

DOS

IR

Vibrations