Geometry & MOs

Info

ID:

426914

PubChem CID:

135154538

Reduced:

ClPO4N7C25H37 (1)

Stoich.:

ABC4D7E25F37 (1)

Weight, g/mol:

565.233317

ΔHf, kcal/mol:

-187.84

Dipole, Da:

4.53

IP(EA), eV:

 -8.74(-0.16)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

propan-2-yl 2-[[[(2S)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[2-(4-chlorophenyl)propan-2-ylamino]phosphoryl]amino]-2-methylpropanoate

Drug info:

PubChemData

Smile

C[C@H](CN1C=NC2=C(N=CN=C21)N)OCP(=O)(NC(C)(C)C3=CC=C(C=C3)Cl)NC(C)(C)C(=O)OC(C)C

DOS

IR

Vibrations