Geometry & MOs

Info

ID:	247898
PubChem CID:	103077360
Reduced:	BrClFSN3O3C11H14 (1)
Stoich.:	ABCDE3F3G11H14 (1)
Weight, g/mol:	399.96593
ΔH_f, kcal/mol:	-153.47
Dipole, Da:	6.47
IP(EA), eV:	-9.46(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations