Geometry & MOs

Info

ID:	390743
PubChem CID:	135000678
Reduced:	NO2C28H33 (1)
Stoich.:	AB2C28D33 (1)
Weight, g/mol:	485.191688
ΔH_f, kcal/mol:	-44.9
Dipole, Da:	2.89
IP(EA), eV:	-8.88(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[tert-butyl(dimethyl)silyl]oxy-3-(6-methylsulfanylpurin-9-yl)butanoyl]benzamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)N(CC2=CC=CC=C2)C(CC(=O)OC(C)(C)C)C3=CC=CC=C3

DOS

IR

Vibrations