Geometry & MOs

Info

ID:	25156
PubChem CID:	619761
Reduced:	OC6H8 (4)
Stoich.:	AB6C8 (4)
Weight, g/mol:	326.282095
ΔH_f, kcal/mol:	-156.59
Dipole, Da:	2.24
IP(EA), eV:	-9.02(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-oxooctadecanoate

Drug info:

PubChemData

Smile

CCOCCCC1(C=CC(C2=CC3=CC=CC=C3C=C21)(CCCOCC)O)O

DOS

IR

Vibrations