Geometry & MOs

Info

ID:	6100
PubChem CID:	66966
Reduced:	NOC19H36 (2)
Stoich.:	ABC19D36 (2)
Weight, g/mol:	588.55938
ΔH_f, kcal/mol:	-212.35
Dipole, Da:	6.34
IP(EA), eV:	-9.19(0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(octadec-9-enoylamino)ethyl]octadec-9-enamide

Drug info:

PubChemData

Smile

CCCCCCCCC=CCCCCCCCC(=O)NCCNC(=O)CCCCCCCC=CCCCCCCCC

DOS

IR

Vibrations