Geometry & MOs

Info

ID:	242503
PubChem CID:	96107544
Reduced:	FON3H14C15 (1)
Stoich.:	ABC3D14E15 (1)
Weight, g/mol:	274.122989
ΔH_f, kcal/mol:	-29.74
Dipole, Da:	3.88
IP(EA), eV:	-8.97(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[6-fluoro-1-[(1-methylimidazol-2-yl)methyl]benzimidazol-2-yl]ethanol

Drug info:

PubChemData

Smile

C[C@@H](C1=NC2=C(N1C3=CC=CC(=C3)N)C=C(C=C2)F)O

DOS

IR

Vibrations