Geometry & MOs

Info

ID:	242167
PubChem CID:	96079449
Reduced:	FN3H14C15 (1)
Stoich.:	AB3C14D15 (1)
Weight, g/mol:	257.09644
ΔH_f, kcal/mol:	25.75
Dipole, Da:	3.48
IP(EA), eV:	-8.37(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(S)-(2-fluorophenyl)-(1-hydroxybenzimidazol-2-yl)methanamine

Drug info:

PubChemData

Smile

CC1=C2C=CC=CN2C(=N1)[C@@H](C3=CC=CC=C3F)N

DOS

IR

Vibrations