Geometry & MOs

Info

ID:	355373
PubChem CID:	127288434
Reduced:	ON4C14H22 (1)
Stoich.:	AB4C14D22 (1)
Weight, g/mol:	341.185175
ΔH_f, kcal/mol:	-20.87
Dipole, Da:	9.13
IP(EA), eV:	-9.64(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-2-(3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carbonyl)-1,5,6,7-tetrahydroindol-4-one

Drug info:

PubChemData

Smile

CC(C)C1=NN=C2N1CCN(C2)C(=O)C3CCCC3

DOS

IR

Vibrations