Geometry & MOs

Info

ID:	189627
PubChem CID:	77882912
Reduced:	N2S2F3O8C14H15 (1)
Stoich.:	A2B2C3D8E14F15 (1)
Weight, g/mol:	350.06275
ΔH_f, kcal/mol:	-445.93
Dipole, Da:	5.05
IP(EA), eV:	-9.66(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7H-purine;(3,4,5-trihydroxyoxolan-2-yl)methyl dihydrogen phosphate

Drug info:

PubChemData

Smile

CC(=O)OC(C1=C(N2C(C(C2=O)NC(=O)CS(=O)C(F)(F)F)SC1)C(=O)O)OC

DOS

IR

Vibrations