Geometry & MOs

Info

ID:	386909
PubChem CID:	134983341
Reduced:	O4C15H18 (1)
Stoich.:	A4B15C18 (1)
Weight, g/mol:	382.156895
ΔH_f, kcal/mol:	-146.42
Dipole, Da:	5.02
IP(EA), eV:	-8.98(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[2-(4-acetylphenyl)-3-hydroxy-3-methylinden-1-yl]phenyl]ethanone

Drug info:

PubChemData

Smile

CC(C)C1=C(C(C2=C1C=CC(=C2)OC)O)C(=O)OC

DOS

IR

Vibrations