Geometry & MOs

Info

ID:	162265
PubChem CID:	57394110
Reduced:	ClO2H12C14 (2)
Stoich.:	AB2C12D14 (2)
Weight, g/mol:	458.189338
ΔH_f, kcal/mol:	-61.24
Dipole, Da:	3.82
IP(EA), eV:	-8.58(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1E,4E)-1-[2,4-dimethoxy-6-[(E)-2-(4-methoxyphenyl)ethenyl]phenyl]-5-(3-fluoro-2-methylphenyl)penta-1,4-dien-3-one

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)/C=C/C2=C(C(=CC(=C2)OC)OC)/C=C/C(=O)/C=C/C3=CC(=C(C=C3)Cl)Cl

DOS

IR

Vibrations