Geometry & MOs

Info

ID:	16300
PubChem CID:	463804
Reduced:	O2N3H21C25 (1)
Stoich.:	A2B3C21D25 (1)
Weight, g/mol:	395.163377
ΔH_f, kcal/mol:	19.9
Dipole, Da:	4.38
IP(EA), eV:	-8.4(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-methyl-3-(4-phenylpyrrolo[1,2-a]quinoxalin-2-yl)-1H-pyrrole-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C(=CN1)C)C2=CN3C4=CC=CC=C4N=C(C3=C2)C5=CC=CC=C5

DOS

IR

Vibrations