Geometry & MOs

Info

ID:	4700
PubChem CID:	11887
Reduced:	N2O5C8H8 (1)
Stoich.:	A2B5C8D8 (1)
Weight, g/mol:	212.043321
ΔH_f, kcal/mol:	-31.1
Dipole, Da:	8.02
IP(EA), eV:	-10.48(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethoxy-2,4-dinitrobenzene

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations