Geometry & MOs

Info

ID:	64473
PubChem CID:	29201095
Reduced:	FSN2O5C23H27 (1)
Stoich.:	ABC2D5E23F27 (1)
Weight, g/mol:	393.229051
ΔH_f, kcal/mol:	-206.94
Dipole, Da:	7.43
IP(EA), eV:	-9.03(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

4-methoxy-N-[1-methyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]benzimidazol-5-yl]benzamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)OCC4=CC=CC=C4F

DOS

IR

Vibrations