Geometry & MOs

Info

ID:	295414
PubChem CID:	117528324
Reduced:	ON3H11C13 (1)
Stoich.:	AB3C11D13 (1)
Weight, g/mol:	248.106196
ΔH_f, kcal/mol:	39.58
Dipole, Da:	3.97
IP(EA), eV:	-8.69(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methyl-2-pyridin-2-ylbenzimidazol-5-yl)acetonitrile

Drug info:

PubChemData

Smile

CN1C2=C(C=CC(=C2)O)N=C1C3=CN=CC=C3

DOS

IR

Vibrations