Geometry & MOs

Info

ID:	446014
PubChem CID:	135271512
Reduced:	FO3N6C28H29 (1)
Stoich.:	AB3C6D28E29 (1)
Weight, g/mol:	329.071148
ΔH_f, kcal/mol:	-77.86
Dipole, Da:	10.74
IP(EA), eV:	-8.53(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[3-(dihydroxyphosphinothioyloxymethyl)cyclopentyl]purin-6-amine

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)N2CCN3C=C(C4=CC(=CC(=C43)C2)F)CC(=O)NCC(=O)C5=CN=C6N5C=CC=C6

DOS

IR

Vibrations