Geometry & MOs

Info

ID:	323220
PubChem CID:	126673709
Reduced:	OCl2N4C14H20 (1)
Stoich.:	AB2C4D14E20 (1)
Weight, g/mol:	358.132717
ΔH_f, kcal/mol:	-81.67
Dipole, Da:	9.2
IP(EA), eV:	-9.2(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-propylpiperidin-3-yl)-1H-benzimidazole-4-carboxamide;dihydrochloride

Drug info:

PubChemData

Smile

CN1CCCC(C1)C2=NC3=C(C=CC=C3N2)C(=O)N.Cl.Cl

DOS

IR

Vibrations