Geometry & MOs

Info

ID:	44618
PubChem CID:	10504437
Reduced:	NO2H25C33 (1)
Stoich.:	AB2C25D33 (1)
Weight, g/mol:	467.236409
ΔH_f, kcal/mol:	53.49
Dipole, Da:	3.52
IP(EA), eV:	-8.95(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[(2R,3S,4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-fluoro-4-(oxan-2-yloxy)oxolan-2-yl]purin-6-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN(C(=O)C=C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=CC5=CC=CC=C54

DOS

IR

Vibrations