Geometry & MOs

Info

ID:	15919
PubChem CID:	455227
Reduced:	ClO3N5C9H10 (1)
Stoich.:	AB3C5D9E10 (1)
Weight, g/mol:	271.047217
ΔH_f, kcal/mol:	-61.14
Dipole, Da:	3.06
IP(EA), eV:	-9.25(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,4R)-4-(6-amino-2-chloropurin-9-yl)-1,3-dioxolan-2-yl]methanol

Drug info:

PubChemData

Smile

C1[C@@H](O[C@H](O1)CO)N2C=NC3=C(N=C(N=C32)Cl)N

DOS

IR

Vibrations