Geometry & MOs

Info

ID:	398170
PubChem CID:	135032137
Reduced:	OC20H24 (1)
Stoich.:	AB20C24 (1)
Weight, g/mol:	300.064257
ΔH_f, kcal/mol:	-22.35
Dipole, Da:	1.63
IP(EA), eV:	-8.79(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[bis(5-methylthiophen-2-yl)methyl]phenol

Drug info:

PubChemData

Smile

C1CC2CCC3=C4C2C5C1CCC6C5C4=C(CC6O)C=C3

DOS

IR

Vibrations