Geometry & MOs

Info

ID:	4376
PubChem CID:	11311
Reduced:	O3N5C9H15 (1)
Stoich.:	A3B5C9D15 (1)
Weight, g/mol:	241.117489
ΔH_f, kcal/mol:	-96.41
Dipole, Da:	3.1
IP(EA), eV:	-9.5(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-aminoethanol;1,3-dimethyl-7H-purine-2,6-dione

Drug info:

PubChemData

Smile

CN1C2=C(C(=O)N(C1=O)C)NC=N2.C(CO)N

DOS

IR

Vibrations