Geometry & MOs

Info

ID:	247908
PubChem CID:	103077449
Reduced:	BrClFSN2O3C12H15 (1)
Stoich.:	ABCDE2F3G12H15 (1)
Weight, g/mol:	399.96593
ΔH_f, kcal/mol:	-168.88
Dipole, Da:	5.35
IP(EA), eV:	-9.27(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-4-bromo-5-chloro-2-fluoro-N-[1-(hydroxymethyl)cyclopentyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1CCC(C(C1)NS(=O)(=O)C2=CC(=C(C(=C2F)N)Br)Cl)O

DOS

IR

Vibrations