Geometry & MOs

Info

ID:	32311
PubChem CID:	6436472
Reduced:	NOC12H21 (1)
Stoich.:	ABC12D21 (1)
Weight, g/mol:	532.521931
ΔH_f, kcal/mol:	-44.57
Dipole, Da:	1.83
IP(EA), eV:	-8.32(1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

octadecyl (9Z,12Z)-octadeca-9,12-dienoate

Drug info:

PubChemData

Smile

C1CCC/C(=C\CC1)/N2CCOCC2

DOS

IR

Vibrations