Geometry & MOs

Info

ID:

384305

PubChem CID:

134976728

Reduced:

PCl2C26H35 (1)

Stoich.:

AB2C26D35 (1)

Weight, g/mol:

1013.496548

ΔHf, kcal/mol:

6.43

Dipole, Da:

3.79

IP(EA), eV:

 -8.82(-0.05)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[(2R,3R,4R,5R)-4-[4-[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-hydroxyoxolan-3-yl]buta-1,3-diynyl]-3-[tert-butyl(dimethyl)silyl]oxy-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)[P@@]2[C@@H](C2(Cl)Cl)C3=CC=CC=C3)C(C)(C)C

DOS

IR

Vibrations