Geometry & MOs

Info

ID:	178051
PubChem CID:	76269575
Reduced:	ClNS2O5C17H20 (1)
Stoich.:	ABC2D5E17F20 (1)
Weight, g/mol:	424.085971
ΔH_f, kcal/mol:	-170.26
Dipole, Da:	4.19
IP(EA), eV:	-9.66(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3-ethylanilino)-2-oxoethyl] 2-[(4-chlorophenyl)sulfonylamino]propanoate

Drug info:

PubChemData

Smile

CC(C)C(C(=O)OCC1=CC=C(S1)Cl)NS(=O)(=O)C2=CC=C(C=C2)OC

DOS

IR

Vibrations