RefChem:887329

sodium;cobalt(3+);4-[4-[[3-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-3-methyl-5-oxopyrazol-1-yl]benzenesulfonamide;3-methyl-4-[(5-nitro-2-oxidophenyl)diazenyl]-1-(4-sulfamoylphenyl)pyrazol-5-olate

Also Known As: Cobaltate(1-), bis(3-(4,5-dihydro-4-(2-(2-(hydroxy-kappaO)-5-nitrophenyl)diazenyl-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, sodium (1:1)|2:1 Complex of 1-(3-aminosulfonylphenyl)-4-((2-hydroxy-5-nitrophenyl)azo)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol and cobalt, sodium salt|Cobaltate(1-), bis(3-(4,5-dihydro-4-((2-(hydroxy-kappaO)-5-nitrophenyl)azo-kappaN1)-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, sodium|Sodium bis(3-(4,5-dihydro-4-((2-hydroxy-5-nitrophenyl)azo)-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonamidato(2-))cobaltate(1-)|Cobaltate(1-), bis[3-[4,5-dihydro-4-[[2-(hydroxy-.kappa.O)-5-nitrophenyl]azo-.kappa.N1]-3-methyl-5-(oxo-.kappa.O)-1H-pyrazol-1-yl]benzenesulfonamidato(2-)]-, sodium|Sodium bis[3-[4,5-dihydro-4-[(2-hydroxy-5-nitrophenyl)azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulphonamidato(2-)]cobaltate(1-)|286-145-2|Cobalt(3+) sodium 2-{(E)-[3-methyl-5-oxo-1-(4-sulfamoylphenyl)-4,5-dihydro-1H-pyrazol-4-id-4-yl]diazenyl}-4-nitrophenolate (1/1/2)|Cobaltate(1-), bis[3-[4,5-dihydro-4-[(2-hydroxy-5-nitrophenyl)azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulfonamidato(2-)]-, sodium|sodium; cobalt(3+); 4-[4-[[3-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-3-methyl-5-oxopyrazol-1-yl]benzenesulfonamide; 5-methyl-4-[(5-nitro-2-oxidophenyl)diazenyl]-2-(4-sulfamoylphenyl)pyrazol-3-olate

Molecular Formula	C32H24CoN12NaO12S2
Molecular Weight	914.03076 g/mol
LogP	-1.52568
Topological Polar Surface Area	395.0 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	21
Rotatable Bonds	7
Exact Mass	914.03076
Monoisotopic Mass	914.03076
Heavy Atoms	60
Complexity	716.0

Chemical Identifiers

CAS Number	85187-58-2
SMILES	CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=C(C=C3)S(=O)(=O)N.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=C(C=C3)S(=O)(=O)N.[Na+].[Co+3]
InChIKey	JXHXPPJIUWWPNF-UHFFFAOYSA-L