Geometry & MOs

Info

ID:	1774
PubChem CID:	5030
Reduced:	PN2O6C27H57 (1)
Stoich.:	AB2C6D27E57 (1)
Weight, g/mol:	536.395425
ΔH_f, kcal/mol:	-402.08
Dipole, Da:	13.82
IP(EA), eV:	-8.96(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-methoxy-3-(octadecanoylamino)propyl] 2-(trimethylazaniumyl)ethyl phosphate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCC(=O)NCC(COP(=O)([O-])OCC[N+](C)(C)C)OC

DOS

IR

Vibrations