Geometry & MOs

Info

ID:	356489
PubChem CID:	127291636
Reduced:	O3N5C19H23 (1)
Stoich.:	A3B5C19D23 (1)
Weight, g/mol:	351.20591
ΔH_f, kcal/mol:	-28.61
Dipole, Da:	4.58
IP(EA), eV:	-8.42(-0.08)
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-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide

Drug info:

PubChemData

Smile

C1COC2=C(C=C(C=C2)NC(=O)CN3CCN4C(=NN=C4C5CC5)C3)OC1

DOS

IR

Vibrations