Geometry & MOs

Info

ID:	382884
PubChem CID:	134974292
Reduced:	O2C13H18 (1)
Stoich.:	A2B13C18 (1)
Weight, g/mol:	306.089209
ΔH_f, kcal/mol:	-88.3
Dipole, Da:	1.68
IP(EA), eV:	-9.44(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-3-(3-oxo-3-phenylpropyl)naphthalene-1,2-dione

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations