Geometry & MOs

Info

ID:	23908
PubChem CID:	607058
Reduced:	NO6H7C8 (1)
Stoich.:	AB6C7D8 (1)
Weight, g/mol:	213.027337
ΔH_f, kcal/mol:	-148.26
Dipole, Da:	3.47
IP(EA), eV:	-9.74(-2.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-5-methoxy-3-nitrobenzoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations