Geometry & MOs

Info

ID:	194676
PubChem CID:	78573820
Reduced:	OF5H9C16 (1)
Stoich.:	AB5C9D16 (1)
Weight, g/mol:	328.131074
ΔH_f, kcal/mol:	-222.73
Dipole, Da:	1.59
IP(EA), eV:	-10.32(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-dimethoxyphenyl)-3-(3,5-dimethoxyphenyl)prop-2-en-1-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations