Geometry & MOs

Info

ID:	57008
PubChem CID:	22395213
Reduced:	NOSC2H7 (1)
Stoich.:	ABCD2E7 (1)
Weight, g/mol:	253.081104
ΔH_f, kcal/mol:	-48.01
Dipole, Da:	2.89
IP(EA), eV:	-9.04(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-9-[3-hydroxy-4-(hydroxymethyl)oxetan-2-yl]-3H-purin-6-one

Drug info:

PubChemData

Smile

C(C(O)S)N

DOS

IR

Vibrations