Geometry & MOs

Info

ID:	532
PubChem CID:	2937
Reduced:	O2C10H15 (2)
Stoich.:	A2B10C15 (2)
Weight, g/mol:	334.214409
ΔH_f, kcal/mol:	-174.46
Dipole, Da:	5.56
IP(EA), eV:	-10.05(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[5-(3-hydroxyoctylidene)-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid

Drug info:

PubChemData

Smile

CCCCCC(CC=C1C(C=CC1=O)CC=CCCCC(=O)O)O

DOS

IR

Vibrations