Geometry & MOs

Info

ID:	190790
PubChem CID:	78057363
Reduced:	O2F3N5C22H28 (1)
Stoich.:	A2B3C5D22E28 (1)
Weight, g/mol:	383.19574
ΔH_f, kcal/mol:	-228.6
Dipole, Da:	6.65
IP(EA), eV:	-9.2(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-5-[6-(1-phenylpropylamino)purin-9-yl]oxolane-3,4-diol

Drug info:

PubChemData

Smile

C1CNC2C1C3C(CN2)C(=O)NC(=O)N3C4CCN(CC4)CC5=CC=C(C=C5)C(F)(F)F

DOS

IR

Vibrations