Geometry & MOs

Info

ID:	242493
PubChem CID:	96107462
Reduced:	ON3C15H15 (1)
Stoich.:	AB3C15D15 (1)
Weight, g/mol:	253.121512
ΔH_f, kcal/mol:	29.71
Dipole, Da:	3.57
IP(EA), eV:	-9.06(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[1-(pyridin-3-ylmethyl)benzimidazol-2-yl]ethanol

Drug info:

PubChemData

Smile

C[C@@H](C1=NC2=CC=CC=C2N1CC3=CN=CC=C3)O

DOS

IR

Vibrations