Geometry & MOs

Info

ID:	8025
PubChem CID:	74762
Reduced:	SN2O4H10C12 (1)
Stoich.:	AB2C4D10E12 (1)
Weight, g/mol:	278.036128
ΔH_f, kcal/mol:	-34.36
Dipole, Da:	8.72
IP(EA), eV:	-9.39(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-nitrophenyl)sulfonylaniline

Drug info:

PubChemData

Smile

C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations