Geometry & MOs

Info

ID:	189601
PubChem CID:	77879334
Reduced:	O2C23H34 (1)
Stoich.:	A2B23C34 (1)
Weight, g/mol:	336.23006
ΔH_f, kcal/mol:	-120.42
Dipole, Da:	6.49
IP(EA), eV:	-9.63(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-3-(3-hydroxyoct-1-enyl)-2-(2-oxohept-5-enyl)cyclopentan-1-one

Drug info:

PubChemData

Smile

CC(C)C1CCC2C1(CCC3C2CCC4=CC(C=CC34C)C(=O)O)C

DOS

IR

Vibrations