Geometry & MOs

Info

ID:

214896

PubChem CID:

85083812

Reduced:

NO10C34H53 (1)

Stoich.:

AB10C34D53 (1)

Weight, g/mol:

636.202735

ΔHf, kcal/mol:

-505.9

Dipole, Da:

7.84

IP(EA), eV:

 -9.96(0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[3-[3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]oxy-4,6-dimethyl-9-oxoimidazo[1,2-a]purin-7-yl]-2-(methoxycarbonylamino)butanoic acid

Drug info:

PubChemData

Smile

CC1C(C(C2C(O1)OC(O2)OC3CCC4(C(C3)CCC5C4CCC6(C5(CCC6C(C)NC(=O)C)O)C)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations