Geometry & MOs

Info

ID:	389458
PubChem CID:	134993074
Reduced:	NS2O5C11H15 (1)
Stoich.:	AB2C5D11E15 (1)
Weight, g/mol:	254.151809
ΔH_f, kcal/mol:	-177.89
Dipole, Da:	2.68
IP(EA), eV:	-10.18(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 7-[(5S)-5-hydroxy-3-oxocyclopenten-1-yl]heptanoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)CCS(=O)(=O)CCS(=O)(=O)N

DOS

IR

Vibrations