Geometry & MOs

Info

ID:	160070
PubChem CID:	57304597
Reduced:	OSN4C17H24 (1)
Stoich.:	ABC4D17E24 (1)
Weight, g/mol:	338.24571
ΔH_f, kcal/mol:	14.58
Dipole, Da:	6.79
IP(EA), eV:	-8.78(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

icosa-8,11-dienedioic acid

Drug info:

PubChemData

Smile

C1CC(=O)CN(C1C2=CC=C(S2)CCCCCN3C=CN=C3)N

DOS

IR

Vibrations