Einecs 276-065-6

bis(1-(4-chlorophenyl)-3-methyl-4-[(2-oxido-5-sulfamoylphenyl)diazenyl]pyrazol-5-olate);chromium(3+);hexane-1,6-diamine;hydron

Also Known As: Chromate(1-), bis(3-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)-4-hydroxybenzenesulfonamidato(2-))-, hydrogen, compd. with 1,6-hexanediamine (1:1)|Chromate(1-), bis(3-(2-(1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-4-yl)diazenyl-kappaN1)-4-(hydroxy-kappaO)benzenesulfonamidato(2-))-, hydrogen, compd. with 1,6-hexanediamine (1:1:1)|Chromate(1-), bis[3-[[1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]azo]-4-hydroxybenzenesulfonamidato(2-)]-, hydrogen, compd. with 1,6-hexanediamine (1:1)|2-(4-chlorophenyl)-5-methyl-4-[(2-oxido-5-sulfamoylphenyl)diazenyl]pyrazol-3-olate; chromium(3+); hexane-1,6-diamine; hydron|Hydrogen bis(3-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)-4-hydroxybenzene-1-sulphonamidato(2-))chromate(1-) , compound with hexane-1,6-diamine (1:1)|Hydrogen bis[3-[[1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]azo]-4-hydroxybenzene-1-sulphonamidato(2-)]chromate(1-) , compound with hexane-1,6-diamine (1:1)

Molecular Formula	C38H41Cl2CrN12O8S2
Molecular Weight	979.1394 g/mol
LogP	4.66244
Topological Polar Surface Area	366.0 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	18
Rotatable Bonds	13
Exact Mass	979.1394
Monoisotopic Mass	979.1394
Heavy Atoms	63
Complexity	669.0

Chemical Identifiers

CAS Number	71839-79-7
SMILES	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)N)[O-])[O-])C3=CC=C(C=C3)Cl.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)N)[O-])[O-])C3=CC=C(C=C3)Cl.C(CCCN)CCN.[Cr+3]
InChIKey	WTMFXIIUDMCNAI-UHFFFAOYSA-K