Geometry & MOs

Info

ID:	164589
PubChem CID:	74422307
Reduced:	ClO3H15C19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	306.125594
ΔH_f, kcal/mol:	-53.58
Dipole, Da:	2.21
IP(EA), eV:	-9.14(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-hydroxyphenyl)-7-(4-methylphenyl)hepta-1,6-diene-3,5-dione

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C=CC(=O)CC(=O)C=CC2=CC=C(C=C2)Cl)O

DOS

IR

Vibrations