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Gaussian Job Archive for C71H112N2Si3
Archive of work produced using the resources of the Imperial College High Performance Computing Service.
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InChI=1S/C71H113N2Si3/c1-39(2)55-31-59(43(9)10)67(60(32-55)44(11)12)74(68-61(45(13)14)33-56(40(3)4)34-62(68)46(15)16)76(70-65(49(21)22)37-58(42(7)8)38-66(70)50(23)24)75(71-72(51(25)26)53(29)54(30)73(71)52(27)28)69-63(47(17)18)35-57(41(5)6)36-64(69)48(19)2InChIKey=WLMHQYVSRFYJBQ-UHFFFAOYSA-N[Si]([Si]([Si](c1c(cc(cc1C(C)C)C(C)C)C(C)C)c1c(cc(cc1C(C)C)C(C)C)C(C)C)c1c(cc(cc1C(C)C)C(C)C)C(C)C)(c1c(cc(cc1C(C)C)C(C)C)C(C)C)[C@H]1N(C(=C(N1C(C)C)C)C)C(C)CC71H112N2Si3nmrM062x/genscrf=(cpcm,solvent=toluene)integral=grid=ultrafineOrganic Chemistry
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