Geometry & MOs

Info

ID:	412803
PubChem CID:	135085732
Reduced:	SO2C12H14 (1)
Stoich.:	AB2C12D14 (1)
Weight, g/mol:	230.13068
ΔH_f, kcal/mol:	-3.65
Dipole, Da:	1.56
IP(EA), eV:	-8.04(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-methyl-1-phenyloct-2-ene-1,7-dione

Drug info:

PubChemData

Smile

CCSC#CC1=CC(=C(C=C1)OC)OC

DOS

IR

Vibrations