Geometry & MOs

Info

ID:	430547
PubChem CID:	135170613
Reduced:	ON2C8H10 (1)
Stoich.:	AB2C8D10 (1)
Weight, g/mol:	553.562023
ΔH_f, kcal/mol:	27.94
Dipole, Da:	0.63
IP(EA), eV:	-10.47(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-octadecylsulfanyloctadecan-1-amine

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C(C)(C)C#N

DOS

IR

Vibrations