Geometry & MOs

Info

ID:	181416
PubChem CID:	76745575
Reduced:	SO4C23H38 (1)
Stoich.:	AB4C23D38 (1)
Weight, g/mol:	512.459331
ΔH_f, kcal/mol:	-144.2
Dipole, Da:	3.26
IP(EA), eV:	-9.02(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pentatriaconta-20,23,26,29,32-pentaenoic acid

Drug info:

PubChemData

Smile

CCC=CCC=CCC=CCC=CCC=CCC(C(CCCOC)O)S(=O)O

DOS

IR

Vibrations