Geometry & MOs

Info

ID:

220112

PubChem CID:

85165256

Reduced:

O2S2C5H7 (4)

Stoich.:

A2B2C5D7 (4)

Weight, g/mol:

652.325613

ΔHf, kcal/mol:

-267.64

Dipole, Da:

6.8

IP(EA), eV:

 -7.9(-1.05)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N,N-dimethyl-N'-[6-oxo-9-[2,2,4,4-tetra(propan-2-yl)-9-trimethylsilyloxy-6a,8,9,9a-tetrahydro-6H-furo[3,2-f][1,3,5,2,4]trioxadisilocin-8-yl]-5H-purin-2-yl]methanimidamide

Drug info:

PubChemData

Smile

COCCOCOC1CSC2=C(SCC1O)SC(=C3SC4=C(S3)SC(C(S4)O)OCOCCOC)S2

DOS

IR

Vibrations