Geometry & MOs

Info

ID:	13500
PubChem CID:	238770
Reduced:	NO5C9H11 (1)
Stoich.:	AB5C9D11 (1)
Weight, g/mol:	213.063722
ΔH_f, kcal/mol:	-93.26
Dipole, Da:	7.02
IP(EA), eV:	-9.09(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2,3-trimethoxy-5-nitrobenzene

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)OC)[N+](=O)[O-]

DOS

IR

Vibrations