Geometry & MOs

Info

ID:	392632
PubChem CID:	135017423
Reduced:	O2N5C22H29 (1)
Stoich.:	A2B5C22D29 (1)
Weight, g/mol:	543.269708
ΔH_f, kcal/mol:	-55.13
Dipole, Da:	1.38
IP(EA), eV:	-9.1(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[9-[[3,5-bis[[tert-butyl(dimethyl)silyl]oxy]phenyl]methyl]-6-oxo-3H-purin-2-yl]acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=NC(=O)C2=C(N1)N=CN2CC3=CC(=CC(=C3)C(C)(C)C)C(C)(C)C

DOS

IR

Vibrations