Geometry & MOs

Info

ID:	9995
PubChem CID:	95998
Reduced:	NOC36H71 (1)
Stoich.:	ABC36D71 (1)
Weight, g/mol:	533.553566
ΔH_f, kcal/mol:	-188.92
Dipole, Da:	4.01
IP(EA), eV:	-9.44(1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-octadecyloctadec-9-enamide

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCNC(=O)CCCCCCCC=CCCCCCCCC

DOS

IR

Vibrations