Geometry & MOs

Info

ID:	89331
PubChem CID:	49960529
Reduced:	NOC11H15 (2)
Stoich.:	ABC11D15 (2)
Weight, g/mol:	559.97693
ΔH_f, kcal/mol:	-92.94
Dipole, Da:	6.24
IP(EA), eV:	-8.38(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenoxy)-1-[4-[2-(4-bromophenoxy)acetyl]-2,3-dihydroquinoxalin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CCC(CC1)C(=O)N2CCN(C3=CC=CC=C32)C(=O)C4CCCCC4

DOS

IR

Vibrations