Geometry & MOs

Info

ID:	68809
PubChem CID:	46509134
Reduced:	SO2N4C24H24 (1)
Stoich.:	AB2C4D24E24 (1)
Weight, g/mol:	496.138068
ΔH_f, kcal/mol:	11.06
Dipole, Da:	5.86
IP(EA), eV:	-8.87(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[3-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]phenyl]-3,4-difluorobenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=NC(=CS1)COC2=CC=CC(=C2)C(=O)N3CCCC(C3)C4=NC5=CC=CC=C5N4

DOS

IR

Vibrations