Geometry & MOs

Info

ID:	20841
PubChem CID:	586070
Reduced:	O3N8C13H16 (1)
Stoich.:	A3B8C13D16 (1)
Weight, g/mol:	332.134536
ΔH_f, kcal/mol:	-2.59
Dipole, Da:	3.08
IP(EA), eV:	-9.36(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[6-(azidomethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purin-6-amine

Drug info:

PubChemData

Smile

CC1(OC2C(OC(C2O1)N3C=NC4=C(N=CN=C43)N)CN=[N+]=[N-])C

DOS

IR

Vibrations