Geometry & MOs

Info

ID:	259478
PubChem CID:	103166420
Reduced:	N2C5H8 (2)
Stoich.:	A2B5C8 (2)
Weight, g/mol:	268.168797
ΔH_f, kcal/mol:	44.17
Dipole, Da:	6.43
IP(EA), eV:	-9.65(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(cyclobutylmethyl)-8-phenyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine

Drug info:

PubChemData

Smile

C1CC(C1)CC2=NN=C3N2CCNC3

DOS

IR

Vibrations