Geometry & MOs

Info

ID:	242502
PubChem CID:	96107542
Reduced:	FON3H14C15 (1)
Stoich.:	ABC3D14E15 (1)
Weight, g/mol:	271.11209
ΔH_f, kcal/mol:	-27.16
Dipole, Da:	2.87
IP(EA), eV:	-8.77(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[1-(3-aminophenyl)-6-fluorobenzimidazol-2-yl]ethanol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations