Geometry & MOs

Info

ID:	192539
PubChem CID:	78283997
Reduced:	ClSN2O5C20H23 (1)
Stoich.:	ABC2D5E20F23 (1)
Weight, g/mol:	486.02603
ΔH_f, kcal/mol:	-178.96
Dipole, Da:	3.64
IP(EA), eV:	-9.52(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-bromo-2-fluoroanilino)-2-oxoethyl] 2-(benzenesulfonamido)-3-methylbutanoate

Drug info:

PubChemData

Smile

CC(C)C(C(=O)OCC(=O)NCC1=CC=CC=C1Cl)NS(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations