Geometry & MOs

Info

ID:	382997
PubChem CID:	134974476
Reduced:	O4C9H16 (1)
Stoich.:	A4B9C16 (1)
Weight, g/mol:	663.22717
ΔH_f, kcal/mol:	-205.09
Dipole, Da:	3.42
IP(EA), eV:	-9.99(1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-bromo-9-[(2R,4R,5R)-4-[tert-butyl(dimethyl)silyl]oxy-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]-6-phenylmethoxypurin-2-amine

Drug info:

PubChemData

Smile

CC1(O[C@@H]2C[C@@H](C(C2O1)O)CO)C

DOS

IR

Vibrations