Geometry & MOs

Info

ID:	182284
PubChem CID:	76870670
Reduced:	FSO3N4H21C24 (1)
Stoich.:	ABC3D4E21F24 (1)
Weight, g/mol:	452.04054
ΔH_f, kcal/mol:	-59.06
Dipole, Da:	2.97
IP(EA), eV:	-8.6(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(4-bromophenyl)sulfamoyl]-4-methoxyphenyl]-2-methylpent-2-enamide

Drug info:

PubChemData

Smile

CNS(=O)(=O)C1=CC=C(C=C1)C=CC(=O)NC2=CC3=C(C=C2)N=C(N3)CC4=CC=CC=C4F

DOS

IR

Vibrations