Geometry & MOs

Info

ID:	346660
PubChem CID:	127271164
Reduced:	N4C15H20 (1)
Stoich.:	A4B15C20 (1)
Weight, g/mol:	255.123243
ΔH_f, kcal/mol:	42.6
Dipole, Da:	5.3
IP(EA), eV:	-9.13(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)ethylamino]pyrazine-2-carbonitrile

Drug info:

PubChemData

Smile

C1CCC2CC(CCC2C1)NC3=NC=CN=C3C#N

DOS

IR

Vibrations