Geometry & MOs

Info

ID:	362768
PubChem CID:	127309316
Reduced:	ON5C19H25 (1)
Stoich.:	AB5C19D25 (1)
Weight, g/mol:	337.19026
ΔH_f, kcal/mol:	2.85
Dipole, Da:	9.3
IP(EA), eV:	-9.3(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)C1=NN=C2N1CCN(C2)C(=O)NC3CCC4=CC=CC=C4C3

DOS

IR

Vibrations