Geometry & MOs

Info

ID:	287078
PubChem CID:	104231757
Reduced:	O3C17H20 (1)
Stoich.:	A3B17C20 (1)
Weight, g/mol:	292.086622
ΔH_f, kcal/mol:	-96.82
Dipole, Da:	4.75
IP(EA), eV:	-9.01(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-chloro-3-methylphenoxy)-6-methoxyphenyl]ethanol

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)OC2=CC=CC(=C2[C@@H](C)O)OC

DOS

IR

Vibrations