Geometry & MOs

Info

ID:	89574
PubChem CID:	49962798
Reduced:	OSC14H16 (1)
Stoich.:	ABC14D16 (1)
Weight, g/mol:	232.092186
ΔH_f, kcal/mol:	-19.61
Dipole, Da:	1.67
IP(EA), eV:	-8.85(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,5-dimethylphenyl)-(3-methylthiophen-2-yl)methanol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)C(C2=C(C=CS2)C)O

DOS

IR

Vibrations