Geometry & MOs

Info

ID:	28640
PubChem CID:	828726
Reduced:	N3C17H27 (1)
Stoich.:	A3B17C27 (1)
Weight, g/mol:	227.105862
ΔH_f, kcal/mol:	12.33
Dipole, Da:	3.24
IP(EA), eV:	-8.32(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(furan-2-ylmethyl)-1-methylbenzimidazol-2-amine

Drug info:

PubChemData

Smile

C[C@H]1CCCC[C@@H]1N2CCN(CC2)CC3=CC=NC=C3

DOS

IR

Vibrations