Geometry & MOs

Info

ID:	9607
PubChem CID:	91486
Reduced:	NO2C18H39 (1)
Stoich.:	AB2C18D39 (1)
Weight, g/mol:	301.298079
ΔH_f, kcal/mol:	-174.41
Dipole, Da:	3.6
IP(EA), eV:	-9.48(2.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R)-2-aminooctadecane-1,3-diol

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCC[C@H]([C@H](CO)N)O

DOS

IR

Vibrations