Geometry & MOs

Info

ID:	242184
PubChem CID:	96079557
Reduced:	FON2H9C10 (1)
Stoich.:	ABC2D9E10 (1)
Weight, g/mol:	192.069891
ΔH_f, kcal/mol:	-24.94
Dipole, Da:	3.11
IP(EA), eV:	-9.62(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(S)-(2-fluorophenyl)-(1H-pyrazol-4-yl)methanol

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)[C@@H](C2=CNN=C2)O)F

DOS

IR

Vibrations