Geometry & MOs

Info

ID:	360571
PubChem CID:	127301216
Reduced:	SO2N5C20H21 (1)
Stoich.:	AB2C5D20E21 (1)
Weight, g/mol:	367.169605
ΔH_f, kcal/mol:	6.97
Dipole, Da:	8.89
IP(EA), eV:	-9.15(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]piperidin-4-yl]-1H-benzimidazole

Drug info:

PubChemData

Smile

C1CN(CCC1C2=NC3=CC=CC=C3N2)CC4=NS(=O)(=O)C5=CC=CC=C5N4

DOS

IR

Vibrations