Geometry & MOs

Info

ID:	374500
PubChem CID:	131330558
Reduced:	O2F4H8C9 (1)
Stoich.:	A2B4C8D9 (1)
Weight, g/mol:	186.051464
ΔH_f, kcal/mol:	-275.56
Dipole, Da:	6.31
IP(EA), eV:	-9.89(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-fluoro-3-methyl-2-methylsulfanylphenyl)methanol

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1CO)C(F)(F)F)F

DOS

IR

Vibrations