Geometry & MOs

Info

ID:	122172
PubChem CID:	50796813
Reduced:	ClSN3O3C18H20 (1)
Stoich.:	ABC3D3E18F20 (1)
Weight, g/mol:	409.00958
ΔH_f, kcal/mol:	-98.76
Dipole, Da:	5.54
IP(EA), eV:	-8.48(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(1,3,6-trimethyl-2-oxobenzimidazol-5-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1C)S(=O)(=O)NC2=CC3=C(C=C2Cl)N(C(=O)N3C)C)C

DOS

IR

Vibrations