Geometry & MOs

Info

ID:	374036
PubChem CID:	131322804
Reduced:	ON3H7C9 (1)
Stoich.:	AB3C7D9 (1)
Weight, g/mol:	173.058912
ΔH_f, kcal/mol:	26.85
Dipole, Da:	1.91
IP(EA), eV:	-8.54(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(7-hydroxybenzimidazol-1-yl)acetonitrile

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)O)C(=C(N2)C#N)N

DOS

IR

Vibrations