Geometry & MOs

Info

ID:	234483
PubChem CID:	92298530
Reduced:	ClSN3O3H10C16 (1)
Stoich.:	ABC3D3E10F16 (1)
Weight, g/mol:	303.077658
ΔH_f, kcal/mol:	42.39
Dipole, Da:	6.5
IP(EA), eV:	-9.34(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[4-(2-hydroxyethylsulfamoyl)-2-methylphenoxy]acetate

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/2\C(=O)N=C(S2)NC3=CC=C(C=C3)Cl

DOS

IR

Vibrations