Geometry & MOs

Info

ID:

222870

PubChem CID:

85332822

Reduced:

NO2C18H22 (2)

Stoich.:

AB2C18D22 (2)

Weight, g/mol:

568.992553

ΔHf, kcal/mol:

-173.74

Dipole, Da:

6.17

IP(EA), eV:

 -9.03(0.05)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[[6-(2-amino-6-oxo-5H-purin-9-yl)-2,2-difluoro-7-hydroxy-5-oxaspiro[2.4]heptan-4-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)C1=C(C=CC2=C1CCCC2)CC(CC(CC3=CC=CC=C3)C(=O)NC4C(CC5=CC=CC=C45)O)O

DOS

IR

Vibrations