Geometry & MOs

Info

ID:	89699
PubChem CID:	49963880
Reduced:	FNOSH18C21 (1)
Stoich.:	ABCDE18F21 (1)
Weight, g/mol:	222.051464
ΔH_f, kcal/mol:	-18.0
Dipole, Da:	3.45
IP(EA), eV:	-8.44(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-fluorophenyl)-(4-methylthiophen-2-yl)methanol

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2SC3=CC=CC(=C31)C(C4=CC=C(C=C4)F)O

DOS

IR

Vibrations