Geometry & MOs

Info

ID:	446628
PubChem CID:	135276497
Reduced:	FO3N6C20H27 (1)
Stoich.:	AB3C6D20E27 (1)
Weight, g/mol:	524.322337
ΔH_f, kcal/mol:	-119.35
Dipole, Da:	3.13
IP(EA), eV:	-8.64(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(2-aminopropanoylamino)-3-methyl-N-[4-[(1-methyl-7-morpholin-4-ylimidazo[1,2-a]quinoxalin-4-yl)amino]butyl]butanamide

Drug info:

PubChemData

Smile

CC1=NN=C2N1C3=CC(=C(C=C3N=C2NCCCCNC(=O)OC(C)(C)C)OC)F

DOS

IR

Vibrations