Geometry & MOs

Info

ID:	147600
PubChem CID:	53787256
Reduced:	O3N4C15H18 (1)
Stoich.:	A3B4C15D18 (1)
Weight, g/mol:	384.287574
ΔH_f, kcal/mol:	-85.16
Dipole, Da:	4.54
IP(EA), eV:	-9.16(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(3R,5S)-3,5-dihydroxy-2-(3-hydroxyundec-1-enyl)cyclopentyl]hexanoic acid

Drug info:

PubChemData

Smile

CC1CC(=O)NN=C1C2=CC=C(C=C2)N(C(=O)C)C(=O)CN

DOS

IR

Vibrations