Geometry & MOs

Info

ID:	326860
PubChem CID:	126688437
Reduced:	F3O3N4H21C23 (1)
Stoich.:	A3B3C4D21E23 (1)
Weight, g/mol:	487.152555
ΔH_f, kcal/mol:	-200.64
Dipole, Da:	5.64
IP(EA), eV:	-8.67(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-hydroxypropyl)-5-(3-oxomorpholin-4-yl)benzimidazol-2-yl]-3-(methylsulfamoyl)benzamide

Drug info:

PubChemData

Smile

C1CC(C1)N2C3=C(C=C(C=C3)N4CCCOC4=O)N=C2NC(=O)C5=CC(=CC=C5)C(F)(F)F

DOS

IR

Vibrations