Geometry & MOs

Info

ID:	10785
PubChem CID:	107923
Reduced:	NO4C26H35 (1)
Stoich.:	AB4C26D35 (1)
Weight, g/mol:	425.256609
ΔH_f, kcal/mol:	-158.75
Dipole, Da:	3.64
IP(EA), eV:	-8.5(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4R,5R)-5-hydroxy-4-[(3S)-3-hydroxyoct-1-enyl]-1-phenyl-5,6-dihydro-4H-cyclopenta[b]pyrrol-2-yl]pentanoic acid

Drug info:

PubChemData

Smile

CCCCC[C@@H](C=C[C@H]1[C@@H](CC2=C1C=C(N2C3=CC=CC=C3)CCCCC(=O)O)O)O

DOS

IR

Vibrations