Geometry & MOs

Info

ID:	308150
PubChem CID:	125317158
Reduced:	N3O3C21H25 (1)
Stoich.:	A3B3C21D25 (1)
Weight, g/mol:	789.551985
ΔH_f, kcal/mol:	-75.27
Dipole, Da:	4.65
IP(EA), eV:	-8.93(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-3-[hydroxy-[(2R)-3-octadecanoyloxy-2-[(E)-octadec-9-enoyl]oxypropoxy]phosphoryl]oxypropanoic acid

Drug info:

PubChemData

Smile

CC1([C@H]2C(=C3C=CC=CC3=N2)C[C@H]4N1C(=O)CN(C4=O)C[C@@H]5CCCO5)C

DOS

IR

Vibrations