Geometry & MOs

Info

ID:	247948
PubChem CID:	103077703
Reduced:	BrClFN2O2S2C11H15 (1)
Stoich.:	ABCD2E2F2G11H15 (1)
Weight, g/mol:	386.94553
ΔH_f, kcal/mol:	-117.28
Dipole, Da:	5.7
IP(EA), eV:	-8.74(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-amino-4-bromo-5-chloro-2-fluorophenyl)sulfonylamino]butanamide

Drug info:

PubChemData

Smile

CCSCC(C)NS(=O)(=O)C1=CC(=C(C(=C1F)N)Br)Cl

DOS

IR

Vibrations