Geometry & MOs

Info

ID:	121780
PubChem CID:	50781097
Reduced:	ON3C12H13 (2)
Stoich.:	AB3C12D13 (2)
Weight, g/mol:	416.221226
ΔH_f, kcal/mol:	2.05
Dipole, Da:	5.7
IP(EA), eV:	-8.25(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-methyl-1H-indol-3-yl)ethyl]-3-(3,6,7-trimethyl-2-oxoquinoxalin-1-yl)propanamide

Drug info:

PubChemData

Smile

CN1C2=C(C=CC=N2)N=C(C1=O)N3CCC(CC3)C(=O)NCCC4=CNC5=CC=CC=C54

DOS

IR

Vibrations