Geometry & MOs

Info

ID:	140523
PubChem CID:	52714998
Reduced:	FO2N3C19H20 (1)
Stoich.:	AB2C3D19E20 (1)
Weight, g/mol:	353.197751
ΔH_f, kcal/mol:	-79.32
Dipole, Da:	3.11
IP(EA), eV:	-8.94(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-[2-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]phenoxy]ethyl-dimethylazanium

Drug info:

PubChemData

Smile

C[C@H](C1=NC2=CC=CC=C2N1)NC(=O)CCCOC3=CC(=CC=C3)F

DOS

IR

Vibrations