Geometry & MOs

Info

ID:

394904

PubChem CID:

135024102

Reduced:

P2N7O11C18H27 (1)

Stoich.:

A2B7C11D18E27 (1)

Weight, g/mol:

623.114208

ΔHf, kcal/mol:

-536.95

Dipole, Da:

3.24

IP(EA), eV:

 -8.88(-0.71)

Spin(Sz, S2):

 None, None

Charge, e:

 -2

Chem-info

IUPAC name:

[(2S)-2-[(6-aminopurin-9-yl)methoxy]-3-[[(2R)-2-[(2,4-dioxopyrimidin-1-yl)methoxy]-3-methoxypropoxy]-oxidophosphoryl]oxypropyl] methyl phosphate

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)[C@H](COC)COP(=O)(O)OC[C@H](COP(=O)(O)OC)N2C=NC3=C(N=CN=C32)N

DOS

IR

Vibrations