Geometry & MOs

Info

ID:	247945
PubChem CID:	103077691
Reduced:	BrClFN2S2O3C11H15 (1)
Stoich.:	ABCD2E2F3G11H15 (1)
Weight, g/mol:	403.94309
ΔH_f, kcal/mol:	-141.04
Dipole, Da:	2.82
IP(EA), eV:	-8.49(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-4-bromo-5-chloro-2-fluoro-N-(3-methylsulfanylbutyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC(CCNS(=O)(=O)C1=CC(=C(C(=C1F)N)Br)Cl)S(=O)C

DOS

IR

Vibrations