Geometry & MOs

Info

ID:	247918
PubChem CID:	103077491
Reduced:	BrClFSN2O3C12H17 (1)
Stoich.:	ABCDE2F3G12H17 (1)
Weight, g/mol:	400.00232
ΔH_f, kcal/mol:	-158.82
Dipole, Da:	3.46
IP(EA), eV:	-9.31(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-4-bromo-5-chloro-N-(3-ethylpentan-2-yl)-2-fluorobenzenesulfonamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations