Geometry & MOs

Info

ID:	21917
PubChem CID:	593789
Reduced:	ClNO3H6C7 (1)
Stoich.:	ABC3D6E7 (1)
Weight, g/mol:	187.003621
ΔH_f, kcal/mol:	-31.07
Dipole, Da:	7.2
IP(EA), eV:	-10.01(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-methoxy-1-nitrobenzene

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)[N+](=O)[O-])Cl

DOS

IR

Vibrations