Geometry & MOs

Info

ID:	1670
PubChem CID:	4851
Reduced:	KNO4C25H32 (1)
Stoich.:	ABC4D25E32 (1)
Weight, g/mol:	449.19684
ΔH_f, kcal/mol:	-194.3
Dipole, Da:	8.99
IP(EA), eV:	-8.05(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

potassium;4-[5-hydroxy-4-(3-hydroxyoct-1-enyl)-1-phenyl-5,6-dihydro-4H-cyclopenta[b]pyrrol-2-yl]butanoate

Drug info:

PubChemData

Smile

CCCCCC(C=CC1C(CC2=C1C=C(N2C3=CC=CC=C3)CCCC(=O)[O-])O)O.[K+]

DOS

IR

Vibrations