Geometry & MOs

Info

ID:	59560
PubChem CID:	24875302
Reduced:	O3C20H30 (1)
Stoich.:	A3B20C30 (1)
Weight, g/mol:	376.207216
ΔH_f, kcal/mol:	-107.79
Dipole, Da:	3.52
IP(EA), eV:	-9.3(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6E,8R,10Z,13Z,16Z,19Z)-4-oxo-8-sulfanyldocosa-6,10,13,16,19-pentaenoic acid

Drug info:

PubChemData

Smile

CC/C=C\C/C=C\C/C=C\C/C=C\C=C\[C@@H](CCCC(=O)O)O

DOS

IR

Vibrations