Geometry & MOs

Info

ID:

176365

PubChem CID:

76037824

Reduced:

O2N8C35H54 (1)

Stoich.:

A2B8C35D54 (1)

Weight, g/mol:

779.225956

ΔHf, kcal/mol:

-46.16

Dipole, Da:

6.91

IP(EA), eV:

 -9.0(-0.57)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9-[4-[tert-butyl(dimethyl)silyl]oxy-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]-6-phenylmethoxy-8-(2,4,6-trichlorophenoxy)purin-2-amine

Drug info:

PubChemData

Smile

CC1(CCN(CC1)C2=NC3(CCC(CC3)C(C)(C)C)N(C2=O)C(CCC(C)(C)C)C4=CC=C(C=C4)C(=O)NCC5=NNN=N5)C

DOS

IR

Vibrations