Geometry & MOs

Info

ID:	176931
PubChem CID:	76114753
Reduced:	NO5C29H35 (1)
Stoich.:	AB5C29D35 (1)
Weight, g/mol:	696.30916
ΔH_f, kcal/mol:	-152.05
Dipole, Da:	4.53
IP(EA), eV:	-9.43(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[9-[5-[[tert-butyl(diphenyl)silyl]-hydroxymethyl]-3-[2-(dimethylaminooxy)ethoxy]-4-hydroxyoxolan-2-yl]purin-6-yl]benzamide

Drug info:

PubChemData

Smile

CCCCCCC1CC1(C#N)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OC(=O)C(C)OCCC

DOS

IR

Vibrations