Geometry & MOs

Info

ID:	188917
PubChem CID:	77786236
Reduced:	NO3C17H19 (1)
Stoich.:	AB3C17D19 (1)
Weight, g/mol:	444.190989
ΔH_f, kcal/mol:	-90.1
Dipole, Da:	4.05
IP(EA), eV:	-8.6(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[7-[1-(3-aminopropyl)-2-ethylindol-3-yl]-6-oxo-5,7-dihydroimidazo[4,5-g]quinoxalin-2-yl] acetate

Drug info:

PubChemData

Smile

CC1CC2C3CC4=C5C2(CCN3)C(C1=O)OC5=C(C=C4)O

DOS

IR

Vibrations