Geometry & MOs

Info

ID:	356487
PubChem CID:	127291634
Reduced:	ON5C20H29 (1)
Stoich.:	AB5C20D29 (1)
Weight, g/mol:	261.15896
ΔH_f, kcal/mol:	-8.61
Dipole, Da:	6.38
IP(EA), eV:	-9.53(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)acetamide

Drug info:

PubChemData

Smile

C1CC1C2=NN=C3N2CCN(C3)CC(=O)NC45CC6CC(C4)CC(C6)C5

DOS

IR

Vibrations