Geometry & MOs

Info

ID:	15129
PubChem CID:	430252
Reduced:	PN5O7C10H14 (1)
Stoich.:	AB5C7D10E14 (1)
Weight, g/mol:	347.063085
ΔH_f, kcal/mol:	-289.34
Dipole, Da:	5.33
IP(EA), eV:	-8.86(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(6-aminopurin-3-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate

Drug info:

PubChemData

Smile

C1=NC2=C(N=CN(C2=N1)C3C(C(C(O3)COP(=O)(O)O)O)O)N

DOS

IR

Vibrations