Geometry & MOs

Info

ID:	205712
PubChem CID:	80139483
Reduced:	ON5C13H17 (1)
Stoich.:	AB5C13D17 (1)
Weight, g/mol:	282.124739
ΔH_f, kcal/mol:	18.92
Dipole, Da:	0.88
IP(EA), eV:	-8.84(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(1-chloroethyl)-6-methoxy-9-pentan-3-ylpurine

Drug info:

PubChemData

Smile

CCOC1=NC=NC(=C1N)NCCC2=CC=CC=N2

DOS

IR

Vibrations