Geometry & MOs

Info

ID:	16535
PubChem CID:	472221
Reduced:	PSN4O4C9H13 (1)
Stoich.:	ABC4D4E9F13 (1)
Weight, g/mol:	304.039513
ΔH_f, kcal/mol:	-150.86
Dipole, Da:	4.35
IP(EA), eV:	-8.7(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-methylsulfanylpurin-9-yl)ethoxymethylphosphonic acid

Drug info:

PubChemData

Smile

CSC1=NC=NC2=C1N=CN2CCOCP(=O)(O)O

DOS

IR

Vibrations