Geometry & MOs

Info

ID:	222348
PubChem CID:	85297138
Reduced:	NSF4O6H11C14 (1)
Stoich.:	ABC4D6E11F14 (1)
Weight, g/mol:	397.187891
ΔH_f, kcal/mol:	-302.91
Dipole, Da:	4.71
IP(EA), eV:	-10.63(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[3-[di(propan-2-yloxy)phosphorylmethoxy]cyclopentyl]purin-6-amine

Drug info:

PubChemData

Smile

CCOS(=O)(=O)OC1C2C=CC(C2[N+](=O)[O-])C3=C1C(=C(C(=C3F)F)F)F

DOS

IR

Vibrations