Structures of five salt forms of disulfonated monoazo dyes

The structures of five s‐block metal salt forms of three disulfonated monoazo dyes are presented. These are poly[di‐μ‐aqua‐diaqua[μ4‐3,3′‐(diazane‐1,2‐diyl)bis(benzenesulfonato)]disodium(I)], [Na2(C12H8N2O6S2)(H2O)4]n, (I), catena‐poly[[tetraaquacalcium(II)]‐μ‐3,3′‐(diazane‐1,2‐diyl)bis(benzenesulfo...

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Veröffentlicht in:Acta crystallographica. Section C, Crystal structure communications Crystal structure communications, 2020-10, Vol.76 (10), p.972-981
Hauptverfasser: Gardner, Heather C., Kennedy, Alan R., McCarney, Karen M., Staunton, Edward, Stewart, Heather, Teat, Simon J.
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container_title Acta crystallographica. Section C, Crystal structure communications
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Kennedy, Alan R.
McCarney, Karen M.
Staunton, Edward
Stewart, Heather
Teat, Simon J.
description The structures of five s‐block metal salt forms of three disulfonated monoazo dyes are presented. These are poly[di‐μ‐aqua‐diaqua[μ4‐3,3′‐(diazane‐1,2‐diyl)bis(benzenesulfonato)]disodium(I)], [Na2(C12H8N2O6S2)(H2O)4]n, (I), catena‐poly[[tetraaquacalcium(II)]‐μ‐3,3′‐(diazane‐1,2‐diyl)bis(benzenesulfonato)], [Ca(C12H8N2O6S2)(H2O)4]n, (II), catena‐poly[[[diaquacalcium(II)]‐μ‐2‐(4‐amino‐3‐sulfonatophenyl)‐1‐(4‐sulfonatophenyl)diazenium] dihydrate], {[Na(C12H10N3O6S2)(H2O)2]·2H2O}n, (III), hexaaquamagnesium bis[2‐(4‐amino‐3‐sulfonatophenyl)‐1‐(4‐sulfonatophenyl)diazenium] octahydrate, [Mg(H2O)6](C12H10N3O6S2)2·8H2O, (IV), and poly[[{μ2‐4‐[2‐(4‐amino‐2‐methyl‐5‐methoxyphenyl)diazen‐1‐yl]benzene‐1,3‐disulfonato}di‐μ‐aqua‐diaquabarium(II)] dihydrate], {[Ba(C14H13N3O7S2)(H2O)4]·2H2O}n, (V). Compound (III) is that obtained on crystallizing the commercial dyestuff Acid Yellow 9 [74543‐21‐8]. The Mg species is a solvent‐separated ion‐pair structure and the others are all coordination polymers with bonds from the metal atoms to sulfonate groups. Compound (I) is a three‐dimensional coordination polymer, (V) is a two‐dimensional coordination polymer and both (II) and (III) are one‐dimensional coordination polymers. The coordination behaviour of the azo ligands and the water ligands, the dimensionality of the coordination polymers and the overall packing motifs of these five structures are contrasted to those of monosulfonate monoazo congers. It is found that (I) and (II) adopt similar structural types to those of monosulfonate species but that the other three structures do not. The structures of five s‐block metal salt forms of three disulfonated monoazo dyes are presented. The coordination behaviour of the azo ligands and the water ligands, the dimensionality of the coordination polymers and the overall packing motifs of these five structures are contrasted to those of monosulfonate monoazo congers. It is found that two of the compounds adopt similar structural types to those of monosulfonate species but that the other three structures do not.
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(LBNL), Berkeley, CA (United States)</creatorcontrib><description>The structures of five s‐block metal salt forms of three disulfonated monoazo dyes are presented. These are poly[di‐μ‐aqua‐diaqua[μ4‐3,3′‐(diazane‐1,2‐diyl)bis(benzenesulfonato)]disodium(I)], [Na2(C12H8N2O6S2)(H2O)4]n, (I), catena‐poly[[tetraaquacalcium(II)]‐μ‐3,3′‐(diazane‐1,2‐diyl)bis(benzenesulfonato)], [Ca(C12H8N2O6S2)(H2O)4]n, (II), catena‐poly[[[diaquacalcium(II)]‐μ‐2‐(4‐amino‐3‐sulfonatophenyl)‐1‐(4‐sulfonatophenyl)diazenium] dihydrate], {[Na(C12H10N3O6S2)(H2O)2]·2H2O}n, (III), hexaaquamagnesium bis[2‐(4‐amino‐3‐sulfonatophenyl)‐1‐(4‐sulfonatophenyl)diazenium] octahydrate, [Mg(H2O)6](C12H10N3O6S2)2·8H2O, (IV), and poly[[{μ2‐4‐[2‐(4‐amino‐2‐methyl‐5‐methoxyphenyl)diazen‐1‐yl]benzene‐1,3‐disulfonato}di‐μ‐aqua‐diaquabarium(II)] dihydrate], {[Ba(C14H13N3O7S2)(H2O)4]·2H2O}n, (V). Compound (III) is that obtained on crystallizing the commercial dyestuff Acid Yellow 9 [74543‐21‐8]. The Mg species is a solvent‐separated ion‐pair structure and the others are all coordination polymers with bonds from the metal atoms to sulfonate groups. Compound (I) is a three‐dimensional coordination polymer, (V) is a two‐dimensional coordination polymer and both (II) and (III) are one‐dimensional coordination polymers. The coordination behaviour of the azo ligands and the water ligands, the dimensionality of the coordination polymers and the overall packing motifs of these five structures are contrasted to those of monosulfonate monoazo congers. It is found that (I) and (II) adopt similar structural types to those of monosulfonate species but that the other three structures do not. The structures of five s‐block metal salt forms of three disulfonated monoazo dyes are presented. The coordination behaviour of the azo ligands and the water ligands, the dimensionality of the coordination polymers and the overall packing motifs of these five structures are contrasted to those of monosulfonate monoazo congers. 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(LBNL), Berkeley, CA (United States)</creatorcontrib><title>Structures of five salt forms of disulfonated monoazo dyes</title><title>Acta crystallographica. Section C, Crystal structure communications</title><addtitle>ACTA CRYSTALLOGR C</addtitle><description>The structures of five s‐block metal salt forms of three disulfonated monoazo dyes are presented. 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It is found that two of the compounds adopt similar structural types to those of monosulfonate species but that the other three structures do not.</description><subject>Benzene</subject><subject>Chemical bonds</subject><subject>Chemistry</subject><subject>Chemistry, Multidisciplinary</subject><subject>Coordination polymers</subject><subject>crystal structure</subject><subject>Crystallography</subject><subject>Dyes</subject><subject>INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY</subject><subject>Ligands</subject><subject>monoazo</subject><subject>Physical Sciences</subject><subject>Polymers</subject><subject>salt forms</subject><subject>Science &amp; Technology</subject><subject>sulfonates</subject><issn>2053-2296</issn><issn>0108-2701</issn><issn>2053-2296</issn><issn>1600-5759</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2020</creationdate><recordtype>article</recordtype><sourceid>24P</sourceid><sourceid>WIN</sourceid><sourceid>AOWDO</sourceid><recordid>eNqNkU1rFTEUhoMottT-AHeD3Qhya04mk-R2Vwb7AQUX1UVXIZM5wZS5SZtklOuvN3NvEakLXeVweJ7kDS8hb4GeAlD58ZbRrmVsLRilwGTbvSCHy2q17F7-MR-Q45zvaaWAdVLCa3LQthQEE-qQnN2WNNsyJ8xNdI3z37HJZiqNi2mzW40-z5OLwRQcm00M0fyMzbjF_Ia8cmbKePx0HpGvF5--9Ferm8-X1_35zcry-sTKUYYjHwdEN1A1uHFga8lrXiEARmm4ASUl62DgTA5KSENbwxkdQaJRMLRH5N3-3piL19n6gvabjSGgLRoktEyICr3fQw8pPs6Yi974bHGaTMA4Z804V4IDV11FT56h93FOoX5hR7FurXYU7CmbYs4JnX5IfmPSVgPVSwH6rwKqo_bODxyiq0kxWPzt1QY6BYtDl7H3xRQfQx_nUKr64f_VSq-faD_h9t_J9Pldz-4uqq7aX3_PpDo</recordid><startdate>202010</startdate><enddate>202010</enddate><creator>Gardner, Heather C.</creator><creator>Kennedy, Alan R.</creator><creator>McCarney, Karen M.</creator><creator>Staunton, Edward</creator><creator>Stewart, Heather</creator><creator>Teat, Simon J.</creator><general>International Union of Crystallography</general><general>Int Union Crystallography</general><general>Wiley Subscription Services, Inc</general><scope>24P</scope><scope>WIN</scope><scope>AOWDO</scope><scope>BLEPL</scope><scope>DTL</scope><scope>AAYXX</scope><scope>CITATION</scope><scope>7SR</scope><scope>7U5</scope><scope>8BQ</scope><scope>8FD</scope><scope>JG9</scope><scope>L7M</scope><scope>7X8</scope><scope>OIOZB</scope><scope>OTOTI</scope><orcidid>https://orcid.org/0000-0003-2319-3725</orcidid><orcidid>https://orcid.org/0000-0001-9515-2602</orcidid><orcidid>https://orcid.org/0000000195152602</orcidid><orcidid>https://orcid.org/0000000323193725</orcidid></search><sort><creationdate>202010</creationdate><title>Structures of five salt forms of disulfonated monoazo dyes</title><author>Gardner, Heather C. ; Kennedy, Alan R. ; McCarney, Karen M. ; Staunton, Edward ; Stewart, Heather ; Teat, Simon J.</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c4268-f02ed4dbeefb08bfdb29747356611d7a4a1877251b427b867a03a420d17ea81b3</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2020</creationdate><topic>Benzene</topic><topic>Chemical bonds</topic><topic>Chemistry</topic><topic>Chemistry, Multidisciplinary</topic><topic>Coordination polymers</topic><topic>crystal structure</topic><topic>Crystallography</topic><topic>Dyes</topic><topic>INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY</topic><topic>Ligands</topic><topic>monoazo</topic><topic>Physical Sciences</topic><topic>Polymers</topic><topic>salt forms</topic><topic>Science &amp; Technology</topic><topic>sulfonates</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Gardner, Heather C.</creatorcontrib><creatorcontrib>Kennedy, Alan R.</creatorcontrib><creatorcontrib>McCarney, Karen M.</creatorcontrib><creatorcontrib>Staunton, Edward</creatorcontrib><creatorcontrib>Stewart, Heather</creatorcontrib><creatorcontrib>Teat, Simon J.</creatorcontrib><creatorcontrib>Lawrence Berkeley National Lab. 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Section C, Crystal structure communications</jtitle><stitle>ACTA CRYSTALLOGR C</stitle><date>2020-10</date><risdate>2020</risdate><volume>76</volume><issue>10</issue><spage>972</spage><epage>981</epage><pages>972-981</pages><issn>2053-2296</issn><issn>0108-2701</issn><eissn>2053-2296</eissn><eissn>1600-5759</eissn><abstract>The structures of five s‐block metal salt forms of three disulfonated monoazo dyes are presented. These are poly[di‐μ‐aqua‐diaqua[μ4‐3,3′‐(diazane‐1,2‐diyl)bis(benzenesulfonato)]disodium(I)], [Na2(C12H8N2O6S2)(H2O)4]n, (I), catena‐poly[[tetraaquacalcium(II)]‐μ‐3,3′‐(diazane‐1,2‐diyl)bis(benzenesulfonato)], [Ca(C12H8N2O6S2)(H2O)4]n, (II), catena‐poly[[[diaquacalcium(II)]‐μ‐2‐(4‐amino‐3‐sulfonatophenyl)‐1‐(4‐sulfonatophenyl)diazenium] dihydrate], {[Na(C12H10N3O6S2)(H2O)2]·2H2O}n, (III), hexaaquamagnesium bis[2‐(4‐amino‐3‐sulfonatophenyl)‐1‐(4‐sulfonatophenyl)diazenium] octahydrate, [Mg(H2O)6](C12H10N3O6S2)2·8H2O, (IV), and poly[[{μ2‐4‐[2‐(4‐amino‐2‐methyl‐5‐methoxyphenyl)diazen‐1‐yl]benzene‐1,3‐disulfonato}di‐μ‐aqua‐diaquabarium(II)] dihydrate], {[Ba(C14H13N3O7S2)(H2O)4]·2H2O}n, (V). Compound (III) is that obtained on crystallizing the commercial dyestuff Acid Yellow 9 [74543‐21‐8]. The Mg species is a solvent‐separated ion‐pair structure and the others are all coordination polymers with bonds from the metal atoms to sulfonate groups. Compound (I) is a three‐dimensional coordination polymer, (V) is a two‐dimensional coordination polymer and both (II) and (III) are one‐dimensional coordination polymers. The coordination behaviour of the azo ligands and the water ligands, the dimensionality of the coordination polymers and the overall packing motifs of these five structures are contrasted to those of monosulfonate monoazo congers. It is found that (I) and (II) adopt similar structural types to those of monosulfonate species but that the other three structures do not. The structures of five s‐block metal salt forms of three disulfonated monoazo dyes are presented. The coordination behaviour of the azo ligands and the water ligands, the dimensionality of the coordination polymers and the overall packing motifs of these five structures are contrasted to those of monosulfonate monoazo congers. 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subjects Benzene
Chemical bonds
Chemistry
Chemistry, Multidisciplinary
Coordination polymers
crystal structure
Crystallography
Dyes
INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY
Ligands
monoazo
Physical Sciences
Polymers
salt forms
Science & Technology
sulfonates
title Structures of five salt forms of disulfonated monoazo dyes
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