Geometry & MOs

Info

ID:	169003
PubChem CID:	75054346
Reduced:	NaPN3O7C29H55 (1)
Stoich.:	ABC3D7E29F55 (1)
Weight, g/mol:	589.385588
ΔH_f, kcal/mol:	-380.41
Dipole, Da:	106.71
IP(EA), eV:	-6.91(-2.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxypropan-2-yl]oxymethyl-(3-octadecoxypropoxy)phosphinic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCOCCCOP(=O)(COC(CN1C=CC(=NC1=O)N)CO)[O-].[Na+]

DOS

IR

Vibrations