Geometry & MOs

Info

ID:	169889
PubChem CID:	75163033
Reduced:	O3C11H16 (1)
Stoich.:	A3B11C16 (1)
Weight, g/mol:	727.235037
ΔH_f, kcal/mol:	-121.4
Dipole, Da:	1.72
IP(EA), eV:	-9.32(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[8-[2-(2-methylpropanoylamino)-6-oxo-5H-purin-9-yl]-2,2,4,4-tetra(propan-2-yl)-6a,8,9,9a-tetrahydro-6H-furo[3,2-f][1,3,5,2,4]trioxadisilocin-9-yl] trifluoromethanesulfonate

Drug info:

PubChemData

Smile

CC1CC(OC(O1)(C)C)C2=CC=CO2

DOS

IR

Vibrations