Geometry & MOs

Info

ID:	316000
PubChem CID:	126629596
Reduced:	O2C9H11 (2)
Stoich.:	A2B9C11 (2)
Weight, g/mol:	258.125594
ΔH_f, kcal/mol:	-128.17
Dipole, Da:	1.93
IP(EA), eV:	-8.12(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-(3-methoxy-4-methylphenyl)ethyl]benzene-1,3-diol

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CCC2=CC(=C(C(=C2)OC)OC)O)OC

DOS

IR

Vibrations