Geometry & MOs

Info

ID:	8809
PubChem CID:	81789
Reduced:	O3C15H22 (1)
Stoich.:	A3B15C22 (1)
Weight, g/mol:	250.156895
ΔH_f, kcal/mol:	-130.81
Dipole, Da:	3.88
IP(EA), eV:	-8.84(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,5-dihydroxyphenyl)nonan-1-one

Drug info:

PubChemData

Smile

CCCCCCCCC(=O)C1=C(C=CC(=C1)O)O

DOS

IR

Vibrations