Geometry & MOs

Info

ID:	51266
PubChem CID:	12013910
Reduced:	ClON4H23C33 (1)
Stoich.:	ABC4D23E33 (1)
Weight, g/mol:	526.156039
ΔH_f, kcal/mol:	161.2
Dipole, Da:	1.58
IP(EA), eV:	-8.94(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(4-chlorophenyl)diazenyl]-3,5-diphenylpyrazol-1-yl]-2-naphthalen-1-ylethanone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(C(=NN2C(=O)CC3=CC=CC4=CC=CC=C43)C5=CC=CC=C5)N=NC6=CC=CC=C6Cl

DOS

IR

Vibrations