Geometry & MOs

Info

ID:	355741
PubChem CID:	127290040
Reduced:	ON8C17H18 (1)
Stoich.:	AB8C17D18 (1)
Weight, g/mol:	371.19574
ΔH_f, kcal/mol:	91.78
Dipole, Da:	6.45
IP(EA), eV:	-9.25(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

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CCN1C(=O)C2=CC=CC=C2N3C1=NN=C3CN4CCN5C=NN=C5C4

DOS

IR

Vibrations