Geometry & MOs

Info

ID:	304477
PubChem CID:	124753011
Reduced:	ON4C20H22 (1)
Stoich.:	AB4C20D22 (1)
Weight, g/mol:	334.179361
ΔH_f, kcal/mol:	47.29
Dipole, Da:	7.02
IP(EA), eV:	-8.85(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R)-1-[2-(benzimidazol-1-yl)ethyl]piperidin-3-yl]-pyridin-2-ylmethanone

Drug info:

PubChemData

Smile

C1C[C@@H](CN(C1)CCN2C=NC3=CC=CC=C32)C(=O)C4=CC=CC=N4

DOS

IR

Vibrations