Geometry & MOs

Info

ID:	1154
PubChem CID:	3865
Reduced:	NPO7C19H38 (1)
Stoich.:	ABC7D19E38 (1)
Weight, g/mol:	423.23859
ΔH_f, kcal/mol:	-453.2
Dipole, Da:	7.96
IP(EA), eV:	-10.79(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(hexadecanoylamino)-3-phosphonooxypropanoic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCC(=O)NC(COP(=O)(O)O)C(=O)O

DOS

IR

Vibrations