Geometry & MOs

Info

ID:	9530
PubChem CID:	90602
Reduced:	O4C17H20 (1)
Stoich.:	A4B17C20 (1)
Weight, g/mol:	288.136159
ΔH_f, kcal/mol:	-133.03
Dipole, Da:	2.66
IP(EA), eV:	-8.46(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(4-hydroxy-3-methoxyphenyl)propyl]-2-methoxyphenol

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)CCCC2=CC(=C(C=C2)O)OC)O

DOS

IR

Vibrations