Geometry & MOs

Info

ID:	653
PubChem CID:	3146
Reduced:	OC11H19 (2)
Stoich.:	AB11C19 (2)
Weight, g/mol:	334.28718
ΔH_f, kcal/mol:	-122.21
Dipole, Da:	5.62
IP(EA), eV:	-9.73(0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

docosa-13,16,19-trienoic acid

Drug info:

PubChemData

Smile

CCC=CCC=CCC=CCCCCCCCCCCCC(=O)O

DOS

IR

Vibrations