Geometry & MOs

Info

ID:	432215
PubChem CID:	135172347
Reduced:	N3C6H13 (1)
Stoich.:	A3B6C13 (1)
Weight, g/mol:	366.240624
ΔH_f, kcal/mol:	40.39
Dipole, Da:	3.27
IP(EA), eV:	-8.79(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-7-[(1R,2R,3R)-3-hydroxy-5-oxo-2-(4-oxononyl)cyclopentyl]hept-5-enoic acid

Drug info:

PubChemData

Smile

CCN=C(C)N(C)N=C

DOS

IR

Vibrations