Geometry & MOs

Info

ID:

435902

PubChem CID:

135192715

Reduced:

O4C23H36 (1)

Stoich.:

A4B23C36 (1)

Weight, g/mol:

716.25394

ΔHf, kcal/mol:

-205.99

Dipole, Da:

1.22

IP(EA), eV:

 -9.32(0.42)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

O-[(4S)-4-[[di(propan-2-yl)amino]-(prop-2-enylamino)oxyphosphanyl]oxy-5-methyl-2-[2-(2-methylpropanoylamino)-6-oxo-3H-purin-9-yl]oxolan-3-yl] 1,1-dioxo-1,4-thiazinane-4-carbothioate

Drug info:

PubChemData

Smile

CCC1C2C(OC1C(CC(C)C3=CC=CC=C3)COC(C)C)OC(O2)(C)C

DOS

IR

Vibrations