Geometry & MOs

Info

ID:	387326
PubChem CID:	134984940
Reduced:	IN3C8H8 (1)
Stoich.:	AB3C8D8 (1)
Weight, g/mol:	266.123972
ΔH_f, kcal/mol:	108.42
Dipole, Da:	3.23
IP(EA), eV:	-9.74(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-8-[2-[ethyl(2-hydroxyethyl)amino]hydrazinyl]purin-2-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@H](CI)N=[N+]=[N-]

DOS

IR

Vibrations