Geometry & MOs

Info

ID:	434268
PubChem CID:	135174565
Reduced:	O2N4C23H36 (1)
Stoich.:	A2B4C23D36 (1)
Weight, g/mol:	399.066332
ΔH_f, kcal/mol:	-102.78
Dipole, Da:	7.98
IP(EA), eV:	-8.67(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[(2R)-2-[[chloro-(4-fluorophenoxy)phosphoryl]methoxy]propyl]purin-6-amine

Drug info:

PubChemData

Smile

CC1CCN(CC1)C2CCN(CC2)CC(=O)NCCC3=CC=C(C=C3)CC(=O)N

DOS

IR

Vibrations