Geometry & MOs

Info

ID:	348554
PubChem CID:	127273665
Reduced:	FON5C20H26 (1)
Stoich.:	ABC5D20E26 (1)
Weight, g/mol:	392.159689
ΔH_f, kcal/mol:	-44.18
Dipole, Da:	5.96
IP(EA), eV:	-9.32(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,3-dioxo-4H-pyrazino[1,2-a]indol-2-yl)-N-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)C3CCCN(C3)CC4=CC(=CC=C4)F

DOS

IR

Vibrations