Geometry & MOs

Info

ID:	89561
PubChem CID:	49962683
Reduced:	OSN2H14C15 (1)
Stoich.:	ABC2D14E15 (1)
Weight, g/mol:	224.032957
ΔH_f, kcal/mol:	46.59
Dipole, Da:	1.56
IP(EA), eV:	-8.63(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methylthiophen-2-yl)-(5-methylthiophen-2-yl)methanol

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C(C2=CC=CC=C2N3C=CC=N3)O

DOS

IR

Vibrations