Geometry & MOs

Info

ID:	1733
PubChem CID:	4960
Reduced:	O5C21H34 (1)
Stoich.:	A5B21C34 (1)
Weight, g/mol:	366.240624
ΔH_f, kcal/mol:	-256.63
Dipole, Da:	5.58
IP(EA), eV:	-8.96(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[5-hydroxy-4-(3-hydroxyoct-1-enyl)-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-ylidene]hexanoic acid

Drug info:

PubChemData

Smile

CCCCCC(C=CC1C(CC2C1CC(=CCCCCC(=O)O)O2)O)O

DOS

IR

Vibrations