Geometry & MOs

Info

ID:	356494
PubChem CID:	127291641
Reduced:	N2C5H8 (2)
Stoich.:	A2B5C8 (2)
Weight, g/mol:	315.149538
ΔH_f, kcal/mol:	59.5
Dipole, Da:	6.62
IP(EA), eV:	-9.46(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN1CCN2C(=NN=C2C3CC3)C1

DOS

IR

Vibrations