Geometry & MOs

Info

ID:	14733
PubChem CID:	419219
Reduced:	ON6C14H24 (1)
Stoich.:	AB6C14D24 (1)
Weight, g/mol:	292.201159
ΔH_f, kcal/mol:	20.63
Dipole, Da:	11.49
IP(EA), eV:	-8.94(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[5-(diethylamino)pentan-2-ylamino]-3H-purin-6-one

Drug info:

PubChemData

Smile

CCN(CC)CCCC(C)NN1C=NC2=C1NC=NC2=O

DOS

IR

Vibrations