Geometry & MOs

Info

ID:	189272
PubChem CID:	77836165
Reduced:	NOC4H6 (4)
Stoich.:	ABC4D6 (4)
Weight, g/mol:	335.122969
ΔH_f, kcal/mol:	-146.53
Dipole, Da:	4.41
IP(EA), eV:	-8.92(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-acetyloxy-3-(2-amino-6-oxo-5H-purin-9-yl)cyclobutyl]methyl acetate

Drug info:

PubChemData

Smile

CC(C)C(=O)OCC1CCC(O1)N2C=CC(=NC2=O)N=CN(C)C

DOS

IR

Vibrations