Geometry & MOs

Info

ID:	187599
PubChem CID:	77595687
Reduced:	NO2C25H25 (1)
Stoich.:	AB2C25D25 (1)
Weight, g/mol:	539.138141
ΔH_f, kcal/mol:	79.51
Dipole, Da:	2.22
IP(EA), eV:	-8.04(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-aminopurin-9-yl)-5-[[6-(3,5-difluorophenyl)-4,4-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinin-2-yl]oxymethyl]-3-methyloxolane-3,4-diol

Drug info:

PubChemData

Smile

CC1=C2CCC3(CCC3)OC2=C(C(=CC=C4C=CC5C=CC=CC5=N4)C1=O)C

DOS

IR

Vibrations