Geometry & MOs

Info

ID:	242492
PubChem CID:	96107456
Reduced:	FON2H15C16 (1)
Stoich.:	ABC2D15E16 (1)
Weight, g/mol:	253.121512
ΔH_f, kcal/mol:	-24.89
Dipole, Da:	2.93
IP(EA), eV:	-8.93(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@@H](C1=NC2=C(N1CC3=CC=CC=C3)C(=CC=C2)F)O

DOS

IR

Vibrations