Geometry & MOs

Info

ID:	356523
PubChem CID:	127291670
Reduced:	FON5C16H18 (1)
Stoich.:	ABC5D16E18 (1)
Weight, g/mol:	332.23246
ΔH_f, kcal/mol:	4.25
Dipole, Da:	5.27
IP(EA), eV:	-9.25(-0.47)
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-(1-ethylpiperidin-4-yl)acetamide

Drug info:

PubChemData

Smile

C1CC1C2=NN=C3N2CCN(C3)CC(=O)NC4=CC=CC=C4F

DOS

IR

Vibrations