Geometry & MOs

Info

ID:

378281

PubChem CID:

134224357

Reduced:

O3N8C51H70 (1)

Stoich.:

A3B8C51D70 (1)

Weight, g/mol:

503.178115

ΔHf, kcal/mol:

-77.17

Dipole, Da:

7.05

IP(EA), eV:

 -8.6(-0.73)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[1-(6-aminopurin-9-yl)propan-2-yloxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphanyl]oxymethyl propan-2-yl carbonate

Drug info:

PubChemData

Smile

CCCCC(CC)COCC1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC=C(C=C3)CNC(C)(C)C)NC4=CC=C(C=C4)CNC5=CC=C(C=C5)C(=O)OCC(CC)CCCC

DOS

IR

Vibrations