Geometry & MOs

Info

ID:	156721
PubChem CID:	56371903
Reduced:	NO2C12H19 (2)
Stoich.:	AB2C12D19 (2)
Weight, g/mol:	441.216475
ΔH_f, kcal/mol:	-145.03
Dipole, Da:	3.9
IP(EA), eV:	-8.49(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-ethylbenzimidazol-2-yl)-N-[6-(4-methylphenoxy)pyridin-3-yl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

C/C=C/C1=CC(=C(C=C1)OCC(CN2CCC(CC2)CCN3CCOCC3)O)OC

DOS

IR

Vibrations