Geometry & MOs

Info

ID:	232022
PubChem CID:	87575162
Reduced:	NO2C6H8 (2)
Stoich.:	AB2C6D8 (2)
Weight, g/mol:	325.925638
ΔH_f, kcal/mol:	-25.67
Dipole, Da:	9.28
IP(EA), eV:	-9.79(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-benzotellurophene-6-sulfonate

Drug info:

PubChemData

Smile

C[N+]1(CCC[C@@H]([C@]1(C2=CC=CC=C2)[N+](=O)[O-])O)[O-]

DOS

IR

Vibrations