Geometry & MOs

Info

ID:	12246
PubChem CID:	133471
Reduced:	O3C10H15 (2)
Stoich.:	A3B10C15 (2)
Weight, g/mol:	366.204239
ΔH_f, kcal/mol:	-263.24
Dipole, Da:	5.17
IP(EA), eV:	-9.36(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S,12R)-5,12-dihydroxyicosa-6,8,10,14-tetraenedioic acid

Drug info:

PubChemData

Smile

C(CCC(=O)O)CC=CC[C@H](C=CC=CC=C[C@H](CCCC(=O)O)O)O

DOS

IR

Vibrations