Geometry & MOs

Info

ID:	214490
PubChem CID:	85083118
Reduced:	Si2O5C30H44 (1)
Stoich.:	A2B5C30D44 (1)
Weight, g/mol:	541.04583
ΔH_f, kcal/mol:	-232.58
Dipole, Da:	1.19
IP(EA), eV:	-8.63(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-[(3-iodophenyl)methylamino]purine-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OCCC(C=CC(=C[Si](C)(C)C1=CC=CC=C1)C2=CC3=C(C=C2)OCO3)OCOC

DOS

IR

Vibrations