Geometry & MOs

Info

ID:	219506
PubChem CID:	85148772
Reduced:	SO2F3N4C26H29 (1)
Stoich.:	AB2C3D4E26F29 (1)
Weight, g/mol:	519.181271
ΔH_f, kcal/mol:	-164.42
Dipole, Da:	5.25
IP(EA), eV:	-8.56(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(2-amino-6-oxo-5H-purin-9-yl)methoxy]-3-[2-(2-hydroxyethoxy)ethoxycarbonyloxy]propyl] 2-(2-hydroxyethoxy)ethyl carbonate

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)OC)NC(=O)C2=C(N=C(S2)C3=CC=CC=C3CN4CCN(CC4)C)C(F)(F)F

DOS

IR

Vibrations