Geometry & MOs

Info

ID:	44208
PubChem CID:	10502026
Reduced:	N4O4H20C23 (1)
Stoich.:	A4B4C20D23 (1)
Weight, g/mol:	416.170922
ΔH_f, kcal/mol:	27.87
Dipole, Da:	7.03
IP(EA), eV:	-8.83(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-nitrophenyl)-2-(3-piperidin-1-ylpyridazino[4,3-b]quinoxalin-4-yl)hydrazine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N=C(C2=CC(=CC=C2)OC(=O)C)N/N=C/C3=CC=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations