Geometry & MOs

Info

ID:	6585
PubChem CID:	69070
Reduced:	N3O4H5C6 (1)
Stoich.:	A3B4C5D6 (1)
Weight, g/mol:	183.028006
ΔH_f, kcal/mol:	4.89
Dipole, Da:	2.15
IP(EA), eV:	-10.05(-2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dinitroaniline

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)[N+](=O)[O-])N)[N+](=O)[O-]

DOS

IR

Vibrations