Geometry & MOs

Info

ID:	221279
PubChem CID:	85267087
Reduced:	O2N3C21H43 (1)
Stoich.:	A2B3C21D43 (1)
Weight, g/mol:	369.083996
ΔH_f, kcal/mol:	-107.35
Dipole, Da:	5.84
IP(EA), eV:	-9.78(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-acetyloxy-5-(2-amino-6-chloropurin-9-yl)oxolan-2-yl]methyl acetate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCOCC(CN=[N+]=[N-])O

DOS

IR

Vibrations