Geometry & MOs

Info

ID:	7222
PubChem CID:	71620
Reduced:	OC10H13 (2)
Stoich.:	AB10C13 (2)
Weight, g/mol:	298.19328
ΔH_f, kcal/mol:	-86.09
Dipole, Da:	0.56
IP(EA), eV:	-8.55(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(4-hydroxy-3-methylphenyl)hexan-3-yl]-2-methylphenol

Drug info:

PubChemData

Smile

CCC(C1=CC(=C(C=C1)O)C)C(CC)C2=CC(=C(C=C2)O)C

DOS

IR

Vibrations