Geometry & MOs

Info

ID:	176499
PubChem CID:	76061093
Reduced:	N3O3C7H11 (1)
Stoich.:	A3B3C7D11 (1)
Weight, g/mol:	351.090797
ΔH_f, kcal/mol:	-125.4
Dipole, Da:	1.62
IP(EA), eV:	-10.2(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-(2-amino-6-oxo-5H-purin-9-yl)-1,1-difluorohexyl]phosphonic acid

Drug info:

PubChemData

Smile

C=CC(=O)NC(CC(=O)N)C(=O)N

DOS

IR

Vibrations