Geometry & MOs

Info

ID:	148378
PubChem CID:	53788040
Reduced:	OSN3C23H27 (1)
Stoich.:	ABC3D23E27 (1)
Weight, g/mol:	883.594161
ΔH_f, kcal/mol:	39.94
Dipole, Da:	1.99
IP(EA), eV:	-8.53(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-[[2-aminoethoxy-[(2R)-3-hexadecanoyloxy-2-octadec-9-enoyloxypropoxy]phosphoryl]oxy-hydroxyphosphoryl]oxyethyl-trimethylazanium

Drug info:

PubChemData

Smile

CN([C@@H]1CCN(C[C@@H]1OC)CC=CC2=CC=CC=C2)C3=NC4=CC=CC=C4S3

DOS

IR

Vibrations