Geometry & MOs

Info

ID:	151262
PubChem CID:	53790962
Reduced:	NC12H14 (2)
Stoich.:	AB12C14 (2)
Weight, g/mol:	296.235145
ΔH_f, kcal/mol:	90.85
Dipole, Da:	2.26
IP(EA), eV:	-8.89(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[(2S,3R)-3-oct-2-enyloxiran-2-yl]octanoic acid

Drug info:

PubChemData

Smile

CC=CCCC1=CC=C(C=C1)C=NN=CC2=CC=C(C=C2)CCC=CC

DOS

IR

Vibrations