Geometry & MOs

Info

ID:	297356
PubChem CID:	117615866
Reduced:	NO6C14H25 (1)
Stoich.:	AB6C14D25 (1)
Weight, g/mol:	562.337987
ΔH_f, kcal/mol:	-290.67
Dipole, Da:	3.6
IP(EA), eV:	-9.59(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3R,4S)-2-(6-aminopurin-9-yl)-5-[[[3-[2-(6-tert-butyl-1H-benzimidazol-2-yl)ethyl]cyclobutyl]-propan-2-ylamino]methyl]oxolane-3,4-diol

Drug info:

PubChemData

Smile

CCOC(=O)CC(C(=O)OCC)NCCC(=O)CCCO

DOS

IR

Vibrations