Geometry & MOs

Info

ID:

375719

PubChem CID:

134220930

Reduced:

OSN2C22H36 (1)

Stoich.:

ABC2D22E36 (1)

Weight, g/mol:

499.1832

ΔHf, kcal/mol:

-44.5

Dipole, Da:

2.07

IP(EA), eV:

 -8.24(0.33)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

propan-2-yl 3-[[(2S,4aR,6R,7S,7aS)-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-yl]methoxy]propanoate

Drug info:

PubChemData

Smile

CCCCOC1=CC=C(CCC1)CC2(CCCCC2)C3=NSCCN3C

DOS

IR

Vibrations