Geometry & MOs

Info

ID:	51268
PubChem CID:	12013912
Reduced:	O3N4H24C34 (1)
Stoich.:	A3B4C24D34 (1)
Weight, g/mol:	536.184841
ΔH_f, kcal/mol:	86.22
Dipole, Da:	6.14
IP(EA), eV:	-9.03(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[1-(2-naphthalen-1-ylacetyl)-3,5-diphenylpyrazol-4-yl]diazenyl]benzoic acid

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=C6C(=O)O

DOS

IR

Vibrations