Geometry & MOs

Info

ID:	287097
PubChem CID:	104231776
Reduced:	O3C16H18 (1)
Stoich.:	A3B16C18 (1)
Weight, g/mol:	258.125594
ΔH_f, kcal/mol:	-85.11
Dipole, Da:	3.84
IP(EA), eV:	-8.78(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[2-methoxy-6-(4-methylphenoxy)phenyl]ethanol

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OC2=CC=CC(=C2C(C)O)OC

DOS

IR

Vibrations