Geometry & MOs

Info

ID:	173172
PubChem CID:	75605778
Reduced:	ClON3H20C21 (1)
Stoich.:	ABC3D20E21 (1)
Weight, g/mol:	372.158626
ΔH_f, kcal/mol:	27.9
Dipole, Da:	1.91
IP(EA), eV:	-8.86(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-naphthalen-1-ylpyrazolidine-3-carbonyl)-1,3-dihydroquinoxalin-2-one

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C2CC(NN2)C3=CC=CC4=CC=CC=C43)Cl

DOS

IR

Vibrations