Geometry & MOs

Info

ID:	20549
PubChem CID:	584564
Reduced:	SN6O6C12H18 (1)
Stoich.:	AB6C6D12E18 (1)
Weight, g/mol:	374.100854
ΔH_f, kcal/mol:	-179.28
Dipole, Da:	4.08
IP(EA), eV:	-9.08(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl N,N-dimethylsulfamate

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O

DOS

IR

Vibrations