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(2,3,9,10,12,18-Hexamethyl-3,9,13,17,20,23-hexaaza-bicyclo(10.7.6)pentacosa-1,10,12,17,19,23-hexaene-K4-N)-nickel dicati
SpectraBase Compound ID ICdUceXkPM3
InChI InChI=1S/C25H42N6.Ni/c1-20-24-18-26-14-15-27-19-25(21(2)29-13-11-12-28-20)23(4)31(6)17-10-8-7-9-16-30(5)22(24)3;/h18-19H,7-17H2,1-6H3;/q;+2/b24-22-,25-23-,26-18?,27-19?,28-20?,29-21?;
InChIKey COKNEDJTOAJOPJ-WUDWCFCHSA-N
Mol Weight 485.3 g/mol
Molecular Formula C25H42N6Ni
Exact Mass 484.282437 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1lBTaYosGk4
Name (2,3,9,10,12,18-Hexamethyl-3,9,13,17,20,23-hexaaza-bicyclo(10.7.6)pentacosa-1,10,12,17,19,23-hexaene-K4-N)-nickel dicati
Comments ANION PF6-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H42N6Ni
InChI InChI=1S/C25H42N6.Ni/c1-20-24-18-26-14-15-27-19-25(21(2)29-13-11-12-28-20)23(4)31(6)17-10-8-7-9-16-30(5)22(24)3;/h18-19H,7-17H2,1-6H3;/q;+2/b24-22-,25-23-,26-18?,27-19?,28-20?,29-21?;
InChIKey COKNEDJTOAJOPJ-WUDWCFCHSA-N
Instrument Name Bruker HX-90
Literature Reference D.H. Bush, D.J. Olszanski, J.C. Stevens, J. Am. Chem. Soc. 103, 1472 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD3CN