Geometry & MOs

Info

ID:	452
PubChem CID:	2782
Reduced:	ClN3C19H20 (1)
Stoich.:	AB3C19D20 (1)
Weight, g/mol:	325.134575
ΔH_f, kcal/mol:	58.45
Dipole, Da:	3.49
IP(EA), eV:	-8.82(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-chlorophenyl)methyl]-2-(pyrrolidin-1-ylmethyl)benzimidazole

Drug info:

PubChemData

Smile

C1CCN(C1)CC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)Cl

DOS

IR

Vibrations