Geometry & MOs

Info

ID:

426903

PubChem CID:

135154475

Reduced:

PF3O5N7C26H37 (1)

Stoich.:

AB3C5D7E26F37 (1)

Weight, g/mol:

547.267204

ΔHf, kcal/mol:

-373.08

Dipole, Da:

6.98

IP(EA), eV:

 -8.91(-0.32)

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-methoxyphenyl)ethyl]amino]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)[C@H](C)C3=CC=C(C=C3)OC(F)(F)F

DOS

IR

Vibrations