Geometry & MOs

Info

ID:	393858
PubChem CID:	135021834
Reduced:	OH9C11 (2)
Stoich.:	AB9C11 (2)
Weight, g/mol:	342.16198
ΔH_f, kcal/mol:	42.12
Dipole, Da:	3.69
IP(EA), eV:	-9.44(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-bis[(E)-1-(4-methylphenyl)prop-1-en-2-yl]cyclobut-3-ene-1,2-dione

Drug info:

PubChemData

Smile

C/C(=C\C1=CC=CC=C1)/C2=C(C(=O)C2=O)/C(=C/C3=CC=CC=C3)/C

DOS

IR

Vibrations