Geometry & MOs

Info

ID:	360588
PubChem CID:	127301233
Reduced:	OSN4C21H24 (1)
Stoich.:	ABC4D21E24 (1)
Weight, g/mol:	381.252861
ΔH_f, kcal/mol:	26.09
Dipole, Da:	2.92
IP(EA), eV:	-8.94(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-(1-cyclopropylpiperidin-4-yl)acetamide

Drug info:

PubChemData

Smile

C1CN(CCC1C2=NC3=CC=CC=C3N2)CC(=O)N4CCC5=C(C4)C=CS5

DOS

IR

Vibrations