Geometry & MOs

Info

ID:	89564
PubChem CID:	49962689
Reduced:	FOSH11C12 (1)
Stoich.:	ABCD11E12 (1)
Weight, g/mol:	246.107836
ΔH_f, kcal/mol:	-52.81
Dipole, Da:	3.84
IP(EA), eV:	-9.3(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-methylthiophen-2-yl)-(2,4,6-trimethylphenyl)methanol

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C(C2=CC(=CC=C2)F)O

DOS

IR

Vibrations