Geometry & MOs

Info

ID:	385753
PubChem CID:	134979903
Reduced:	O3C25H34 (1)
Stoich.:	A3B25C34 (1)
Weight, g/mol:	332.250401
ΔH_f, kcal/mol:	-84.48
Dipole, Da:	1.98
IP(EA), eV:	-8.55(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1E,3E,5E,7Z,9E,11E)-11-methyloctadeca-1,3,5,7,9,11-hexaenyl]benzene

Drug info:

PubChemData

Smile

COC1COC(OC1)CCCCCC/C=C\C=C\C=C\C=C\C2=CC=CC=C2

DOS

IR

Vibrations