Geometry & MOs

Info

ID:

310326

PubChem CID:

126578830

Reduced:

O2C8H11 (2)

Stoich.:

A2B8C11 (2)

Weight, g/mol:

305.112404

ΔHf, kcal/mol:

-136.07

Dipole, Da:

2.78

IP(EA), eV:

-9.5(0.22)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(1R,3R,7R)-3-(6-aminopurin-9-yl)-1-(hydroxymethyl)spiro[2,5-dioxabicyclo[2.2.1]heptane-6,1'-cyclopropane]-7-ol

Drug info:

PubChemData

Smile

CC[C@@H]1C([C@H]2[C@H](O1)OC(O2)(C)C)OCC3=CC=CC=C3

DOS

IR

Vibrations