Geometry & MOs

Info

ID:

426907

PubChem CID:

135154481

Reduced:

PF3O4N8C25H32 (1)

Stoich.:

AB3C4D8E25F32 (1)

Weight, g/mol:

565.233317

ΔHf, kcal/mol:

-291.95

Dipole, Da:

3.88

IP(EA), eV:

 -9.04(-0.82)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

propyl 2-[[[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[[(1R)-1-(4-chlorophenyl)ethyl]-methylamino]phosphoryl]amino]-2-methylpropanoate

Drug info:

PubChemData

Smile

CCCOC(=O)C(C)(C)NP(=O)(COC(C)CN1C=NC2=C(N=CN=C21)N)N[C@H](C3=CC=C(C=C3)C#N)C(F)(F)F

DOS

IR

Vibrations