Geometry & MOs

Info

ID:	247670
PubChem CID:	103072628
Reduced:	N4C13H24 (1)
Stoich.:	A4B13C24 (1)
Weight, g/mol:	205.09636
ΔH_f, kcal/mol:	24.56
Dipole, Da:	4.73
IP(EA), eV:	-9.27(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(aminomethyl)prop-2-enyl]-[1,2,4]triazolo[4,3-a]pyrazin-3-one

Drug info:

PubChemData

Smile

CCC1=NN(C(=N1)CC)CC(=C)CNC(C)C

DOS

IR

Vibrations