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(1,10-PHENANTHROLINE)PD(3-ETA-CH(ET)C6H4-PARA-OCH3)+((CF3)2C6H3)4B-

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(1,10-PHENANTHROLINE)PD(3-ETA-CH(ET)C6H4-PARA-OCH3)+((CF3)2C6H3)4B-
SpectraBase Compound ID 38Y8jbz8jQ0
InChI InChI=1S/C32H12BF24.C12H8N2.C10H13O.Pd/c34-25(35,36)13-1-14(26(37,38)39)6-21(5-13)33(22-7-15(27(40,41)42)2-16(8-22)28(43,44)45,23-9-17(29(46,47)48)3-18(10-23)30(49,50)51)24-11-19(31(52,53)54)4-20(12-24)32(55,56)57;1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;1-3-4-9-5-7-10(11-2)8-6-9;/h1-12H;1-8H;4-8H,3H2,1-2H3;/q-1;;;+1
InChIKey WQRLAXONRFOCLQ-UHFFFAOYSA-N
Mol Weight 1299.1 g/mol
Molecular Formula C54H33BF24N2OPd
Exact Mass 1298.13375 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DR5NJGHHnUN
Name (1,10-PHENANTHROLINE)PD(3-ETA-CH(ET)C6H4-PARA-OCH3)+((CF3)2C6H3)4B-
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C54H33BF24N2OPd
InChI InChI=1S/C32H12BF24.C12H8N2.C10H13O.Pd/c34-25(35,36)13-1-14(26(37,38)39)6-21(5-13)33(22-7-15(27(40,41)42)2-16(8-22)28(43,44)45,23-9-17(29(46,47)48)3-18(10-23)30(49,50)51)24-11-19(31(52,53)54)4-20(12-24)32(55,56)57;1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;1-3-4-9-5-7-10(11-2)8-6-9;/h1-12H;1-8H;4-8H,3H2,1-2H3;/q-1;;;+1
InChIKey WQRLAXONRFOCLQ-UHFFFAOYSA-N
Literature Reference Author F.C.RIX,M.BROOKHART,P.S.WHITE
Literature Reference Citation J.AM.CHEM.SOC.,118,2436(1996)
Literature Reference DOI 10.1021/ja9527434
Molecular Weight 1299.060 g/mol
Sample ID 56513
Solvent CD2Cl2