Geometry & MOs

Info

ID:	43657
PubChem CID:	10321600
Reduced:	BrFNSO3H19C20 (1)
Stoich.:	ABCDE3F19G20 (1)
Weight, g/mol:	451.052418
ΔH_f, kcal/mol:	-144.33
Dipole, Da:	1.89
IP(EA), eV:	-8.79(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dichloro-2-hydroxy-N-[2,4,6-trimethyl-3-(pyridin-3-ylamino)phenyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCOC(=O)CC1C(=O)N(C2=C(S1)C=CC(=C2)C)CC3=C(C=C(C=C3)Br)F

DOS

IR

Vibrations