Geometry & MOs

Info

ID:	339060
PubChem CID:	127260071
Reduced:	NCl2S2O5H9C12 (1)
Stoich.:	AB2C2D5E9F12 (1)
Weight, g/mol:	307.051444
ΔH_f, kcal/mol:	-152.12
Dipole, Da:	7.64
IP(EA), eV:	-9.56(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-ethyl-3-nitrophenyl) benzenesulfonate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)S(=O)(=O)OC2=CC(=C(C=C2Cl)Cl)S(=O)(=O)N

DOS

IR

Vibrations