EPR Evidence For Magnetic Exchange Through a Four-Carbon Aliphatic Bridge in a Binuclear Copper(II) Complex. Single Crystal X-Ray Structure of 7, 7′-(1, 4-Butanediyl)-Bis{2,12-Dimethyl-3,7,11,17-Tetraazabicyclo[11.3.1]Heptadeca-1(17),2,11,13,15-Pentaene)Nickel(II)} Perchlorate Monohydrate

The single crystal x-ray structure of the title, binuclear nickel(II) complex has been determined and the compound used as a host for EPR investigations of the analogous copper(II) complex. The impetus for this work was an earlier suggestion that magnetic exchange interactions detected by EPR spectr...

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Veröffentlicht in:Journal of coordination chemistry 1988-12, Vol.19 (1-3), p.123-137
Hauptverfasser: Foster, Keith A., Brown, David R., Timken, Mark D., Van Derveer, Donald G., Belford, R. Linn, Barefield, E. Kent
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container_end_page 137
container_issue 1-3
container_start_page 123
container_title Journal of coordination chemistry
container_volume 19
creator Foster, Keith A.
Brown, David R.
Timken, Mark D.
Van Derveer, Donald G.
Belford, R. Linn
Barefield, E. Kent
description The single crystal x-ray structure of the title, binuclear nickel(II) complex has been determined and the compound used as a host for EPR investigations of the analogous copper(II) complex. The impetus for this work was an earlier suggestion that magnetic exchange interactions detected by EPR spectroscopy on frozen solutions of the biscopper(II) complex were a result of a direct copper-copper interaction in a "closed" conformation of the binuclear species. Results reported here suggest that the complex exists in the open conformation where the distance between metal centres is maximized and that the magnetic exchange occurs by a super-exchange mechanism through the aliphatic chain. The │J│ value for the exchange interaction is greater than 0.018 cm -1 . Crystal data for [Ni 2 (C 34 H 50 N 8 ](CIO 4 ) 4 -H 2 O(298 K): monoclinic, space group P2 1 /n, a = 13.560(3), b = 11.678(2), c = 15.377(3) Å, β = 108.48(2)°, ρ caled = 1.588 g cm -3 for Z = 2 and M r = 1104.1, R = 0.068, R w = 0.076. The intramolecular Ni-Ni distance is 9.13 Å. The analogous copper complex is isomorphorus with the nickel complex.
doi_str_mv 10.1080/00958972.1988.9728150
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Single Crystal X-Ray Structure of 7, 7′-(1, 4-Butanediyl)-Bis{2,12-Dimethyl-3,7,11,17-Tetraazabicyclo[11.3.1]Heptadeca-1(17),2,11,13,15-Pentaene)Nickel(II)} Perchlorate Monohydrate</title><source>Taylor &amp; Francis</source><creator>Foster, Keith A. ; Brown, David R. ; Timken, Mark D. ; Van Derveer, Donald G. ; Belford, R. Linn ; Barefield, E. Kent</creator><creatorcontrib>Foster, Keith A. ; Brown, David R. ; Timken, Mark D. ; Van Derveer, Donald G. ; Belford, R. Linn ; Barefield, E. Kent</creatorcontrib><description>The single crystal x-ray structure of the title, binuclear nickel(II) complex has been determined and the compound used as a host for EPR investigations of the analogous copper(II) complex. The impetus for this work was an earlier suggestion that magnetic exchange interactions detected by EPR spectroscopy on frozen solutions of the biscopper(II) complex were a result of a direct copper-copper interaction in a "closed" conformation of the binuclear species. Results reported here suggest that the complex exists in the open conformation where the distance between metal centres is maximized and that the magnetic exchange occurs by a super-exchange mechanism through the aliphatic chain. The │J│ value for the exchange interaction is greater than 0.018 cm -1 . Crystal data for [Ni 2 (C 34 H 50 N 8 ](CIO 4 ) 4 -H 2 O(298 K): monoclinic, space group P2 1 /n, a = 13.560(3), b = 11.678(2), c = 15.377(3) Å, β = 108.48(2)°, ρ caled = 1.588 g cm -3 for Z = 2 and M r = 1104.1, R = 0.068, R w = 0.076. The intramolecular Ni-Ni distance is 9.13 Å. 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Linn</creatorcontrib><creatorcontrib>Barefield, E. Kent</creatorcontrib><title>EPR Evidence For Magnetic Exchange Through a Four-Carbon Aliphatic Bridge in a Binuclear Copper(II) Complex. Single Crystal X-Ray Structure of 7, 7′-(1, 4-Butanediyl)-Bis{2,12-Dimethyl-3,7,11,17-Tetraazabicyclo[11.3.1]Heptadeca-1(17),2,11,13,15-Pentaene)Nickel(II)} Perchlorate Monohydrate</title><title>Journal of coordination chemistry</title><description>The single crystal x-ray structure of the title, binuclear nickel(II) complex has been determined and the compound used as a host for EPR investigations of the analogous copper(II) complex. The impetus for this work was an earlier suggestion that magnetic exchange interactions detected by EPR spectroscopy on frozen solutions of the biscopper(II) complex were a result of a direct copper-copper interaction in a "closed" conformation of the binuclear species. Results reported here suggest that the complex exists in the open conformation where the distance between metal centres is maximized and that the magnetic exchange occurs by a super-exchange mechanism through the aliphatic chain. The │J│ value for the exchange interaction is greater than 0.018 cm -1 . Crystal data for [Ni 2 (C 34 H 50 N 8 ](CIO 4 ) 4 -H 2 O(298 K): monoclinic, space group P2 1 /n, a = 13.560(3), b = 11.678(2), c = 15.377(3) Å, β = 108.48(2)°, ρ caled = 1.588 g cm -3 for Z = 2 and M r = 1104.1, R = 0.068, R w = 0.076. The intramolecular Ni-Ni distance is 9.13 Å. The analogous copper complex is isomorphorus with the nickel complex.</description><subject>agnetic exchange</subject><subject>binuclear</subject><subject>Condensed matter: structure, mechanical and thermal properties</subject><subject>Copper(lI)</subject><subject>esr</subject><subject>Exact sciences and technology</subject><subject>Inorganic compounds</subject><subject>Metal complexes</subject><subject>NMR</subject><subject>Physics</subject><subject>Structure of solids and liquids; crystallography</subject><subject>Structure of specific crystalline solids</subject><subject>X-ray structure</subject><issn>0095-8972</issn><issn>1029-0389</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>1988</creationdate><recordtype>article</recordtype><recordid>eNp9kd-K1DAUxqsoOK4-ghDQixloatL0T3rnzjjrDuzqsDsXgkg5TdNpNJOWNNWtIvhMPpJPYuvseunV-eD8vvOHz_OeURJQwslLQrKYZ2kY0IzzYBScxuS-N6MkzDBhPHvgzSYGT9Aj73HXfSKEMhams3vP19srtP6iSmmERGeNRZewN9IpgdY3ogazl2hX26bf1wjGfm_xCmzRGHSqVVvDBC6tKkdMmZFYKtMLLcGiVdO20s43m8UoD62WNwG6VmavJVrZoXOg0Xt8BQO6drYXrrcSNRVKfZT-_vkLz6mPIrzsHRhZqkEv8FJ130Ofhvi1OkhXDxozP_Up9WmKd9JZgG9QKDEI3XygNGAB_XguWwelFIDpnKYLP_yLM5_GeCuNA2nk4q0Sn6WezvyBttKKWjcWnESXjWnqoZz0E-9hBbqTT2_ribc7W-9W5_ji3ZvN6vQCC0a5wzEHTouiAsLKpEygIDKO0hjKpOAFZYKlMiIRcJImWZakcVbRSlRFWIZRGApgJ158HCts03VWVnlr1QHskFOST0Hnd0HnU9D5bdCj78XR10InQFcWjFDdP3NKOYuSZMReHTFlqsYe4GtjdZk7GMaH7zzs_5v-ANZnuhc</recordid><startdate>19881201</startdate><enddate>19881201</enddate><creator>Foster, Keith A.</creator><creator>Brown, David R.</creator><creator>Timken, Mark D.</creator><creator>Van Derveer, Donald G.</creator><creator>Belford, R. Linn</creator><creator>Barefield, E. Kent</creator><general>Taylor &amp; Francis Group</general><general>Gordon and Breach</general><scope>IQODW</scope><scope>AAYXX</scope><scope>CITATION</scope></search><sort><creationdate>19881201</creationdate><title>EPR Evidence For Magnetic Exchange Through a Four-Carbon Aliphatic Bridge in a Binuclear Copper(II) Complex. Single Crystal X-Ray Structure of 7, 7′-(1, 4-Butanediyl)-Bis{2,12-Dimethyl-3,7,11,17-Tetraazabicyclo[11.3.1]Heptadeca-1(17),2,11,13,15-Pentaene)Nickel(II)} Perchlorate Monohydrate</title><author>Foster, Keith A. ; Brown, David R. ; Timken, Mark D. ; Van Derveer, Donald G. ; Belford, R. Linn ; Barefield, E. Kent</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c318t-58a81bbfa03d6d6ab0e5475ad6b8b13c37e404a8076996759f1fcfb2d2422ca3</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>1988</creationdate><topic>agnetic exchange</topic><topic>binuclear</topic><topic>Condensed matter: structure, mechanical and thermal properties</topic><topic>Copper(lI)</topic><topic>esr</topic><topic>Exact sciences and technology</topic><topic>Inorganic compounds</topic><topic>Metal complexes</topic><topic>NMR</topic><topic>Physics</topic><topic>Structure of solids and liquids; crystallography</topic><topic>Structure of specific crystalline solids</topic><topic>X-ray structure</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Foster, Keith A.</creatorcontrib><creatorcontrib>Brown, David R.</creatorcontrib><creatorcontrib>Timken, Mark D.</creatorcontrib><creatorcontrib>Van Derveer, Donald G.</creatorcontrib><creatorcontrib>Belford, R. 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Single Crystal X-Ray Structure of 7, 7′-(1, 4-Butanediyl)-Bis{2,12-Dimethyl-3,7,11,17-Tetraazabicyclo[11.3.1]Heptadeca-1(17),2,11,13,15-Pentaene)Nickel(II)} Perchlorate Monohydrate</atitle><jtitle>Journal of coordination chemistry</jtitle><date>1988-12-01</date><risdate>1988</risdate><volume>19</volume><issue>1-3</issue><spage>123</spage><epage>137</epage><pages>123-137</pages><issn>0095-8972</issn><eissn>1029-0389</eissn><coden>JCCMBQ</coden><abstract>The single crystal x-ray structure of the title, binuclear nickel(II) complex has been determined and the compound used as a host for EPR investigations of the analogous copper(II) complex. The impetus for this work was an earlier suggestion that magnetic exchange interactions detected by EPR spectroscopy on frozen solutions of the biscopper(II) complex were a result of a direct copper-copper interaction in a "closed" conformation of the binuclear species. Results reported here suggest that the complex exists in the open conformation where the distance between metal centres is maximized and that the magnetic exchange occurs by a super-exchange mechanism through the aliphatic chain. The │J│ value for the exchange interaction is greater than 0.018 cm -1 . Crystal data for [Ni 2 (C 34 H 50 N 8 ](CIO 4 ) 4 -H 2 O(298 K): monoclinic, space group P2 1 /n, a = 13.560(3), b = 11.678(2), c = 15.377(3) Å, β = 108.48(2)°, ρ caled = 1.588 g cm -3 for Z = 2 and M r = 1104.1, R = 0.068, R w = 0.076. The intramolecular Ni-Ni distance is 9.13 Å. The analogous copper complex is isomorphorus with the nickel complex.</abstract><cop>New York, NY</cop><pub>Taylor &amp; Francis Group</pub><doi>10.1080/00958972.1988.9728150</doi><tpages>15</tpages></addata></record>
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subjects agnetic exchange
binuclear
Condensed matter: structure, mechanical and thermal properties
Copper(lI)
esr
Exact sciences and technology
Inorganic compounds
Metal complexes
NMR
Physics
Structure of solids and liquids
crystallography
Structure of specific crystalline solids
X-ray structure
title EPR Evidence For Magnetic Exchange Through a Four-Carbon Aliphatic Bridge in a Binuclear Copper(II) Complex. Single Crystal X-Ray Structure of 7, 7′-(1, 4-Butanediyl)-Bis{2,12-Dimethyl-3,7,11,17-Tetraazabicyclo[11.3.1]Heptadeca-1(17),2,11,13,15-Pentaene)Nickel(II)} Perchlorate Monohydrate
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