Geometry & MOs

Info

ID:	59296
PubChem CID:	24778800
Reduced:	NPO8C34H68 (1)
Stoich.:	ABC8D34E68 (1)
Weight, g/mol:	759.577806
ΔH_f, kcal/mol:	-525.08
Dipole, Da:	12.81
IP(EA), eV:	-9.85(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-2-[(Z)-hexadec-9-enoyl]oxy-3-octadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC

DOS

IR

Vibrations