Geometry & MOs

Info

ID:	124422
PubChem CID:	50882976
Reduced:	NO6C11H13 (1)
Stoich.:	AB6C11D13 (1)
Weight, g/mol:	208.048407
ΔH_f, kcal/mol:	-144.08
Dipole, Da:	7.11
IP(EA), eV:	-9.6(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dimethoxy-3-nitrobenzonitrile

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations