Geometry & MOs

Info

ID:	86519
PubChem CID:	49886570
Reduced:	O2H7C8 (2)
Stoich.:	A2B7C8 (2)
Weight, g/mol:	208.109944
ΔH_f, kcal/mol:	-105.09
Dipole, Da:	5.63
IP(EA), eV:	-9.53(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-hydroxy-6-propoxyphenyl)propan-1-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC2=CC(=C(C=C2)OCC(=O)O)C=O

DOS

IR

Vibrations