Geometry & MOs

Info

ID:	59033
PubChem CID:	24770427
Reduced:	O2C13H18 (1)
Stoich.:	A2B13C18 (1)
Weight, g/mol:	467.097101
ΔH_f, kcal/mol:	-56.54
Dipole, Da:	3.01
IP(EA), eV:	-8.23(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R)-2-(2-amino-6-cyclopropylpurin-9-yl)-3-hydroxy-4-(phosphonomethoxy)butoxy]methylphosphonic acid

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1OCC)CC=C

DOS

IR

Vibrations