Geometry & MOs

Info

ID:	149484
PubChem CID:	53789157
Reduced:	SO2C22H22 (1)
Stoich.:	AB2C22D22 (1)
Weight, g/mol:	638.436882
ΔH_f, kcal/mol:	49.12
Dipole, Da:	1.6
IP(EA), eV:	-8.7(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

icosa-5,8,11,14-tetraenoyloxysulfanyl icosa-5,8,11,14-tetraenoate

Drug info:

PubChemData

Smile

CC(C)C(C1=CC2=CC=CC=C2S1)C(=O)OC(C#C)C(=CCC#C)C

DOS

IR

Vibrations