Geometry & MOs

Info

ID:

220222

PubChem CID:

85165379

Reduced:

SN5O6C36H45 (1)

Stoich.:

AB5C6D36E45 (1)

Weight, g/mol:

675.363608

ΔHf, kcal/mol:

-214.52

Dipole, Da:

3.94

IP(EA), eV:

 -9.19(-1.02)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-benzyl-9-[4-[tert-butyl(dimethyl)silyl]oxy-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]-6-phenylmethoxypurin-2-amine

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)C(=O)N2CSC(C2C(=O)NC(C)(C)C)(C)C)NC(=O)COC3=CC=CC4=C3C=CN=C4

DOS

IR

Vibrations