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CIIDGBSBPLUKNR-UHFFFAOYSA-N
SpectraBase Compound ID MBGaFQbMFC
InChI InChI=1S/C43H53N3O4Si3.3C5H.3Fe/c1-51(2,32-44-40(48)35-16-7-8-17-35)29-13-26-43(38-22-24-39(47)25-23-38,27-14-30-52(3,4)33-45-41(49)36-18-9-10-19-36)28-15-31-53(5,6)34-46-42(50)37-20-11-12-21-37;3*1-2-4-5-3-1;;;/h16,18,20,22-25,47H,13-15,26-34H2,1-6H3,(H,44,48)(H,45,49)(H,46,50);3*1H;;;
InChIKey CIIDGBSBPLUKNR-UHFFFAOYSA-N
Mol Weight 1110.9 g/mol
Molecular Formula C58H56Fe3N3O4Si3
Exact Mass 1110.16267 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DXmDg0K4uuY
Name CIIDGBSBPLUKNR-UHFFFAOYSA-N
Compound Number 6
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C58H56Fe3N3O4Si3
InChI InChI=1S/C43H53N3O4Si3.3C5H.3Fe/c1-51(2,32-44-40(48)35-16-7-8-17-35)29-13-26-43(38-22-24-39(47)25-23-38,27-14-30-52(3,4)33-45-41(49)36-18-9-10-19-36)28-15-31-53(5,6)34-46-42(50)37-20-11-12-21-37;3*1-2-4-5-3-1;;;/h16,18,20,22-25,47H,13-15,26-34H2,1-6H3,(H,44,48)(H,45,49)(H,46,50);3*1H;;;
InChIKey CIIDGBSBPLUKNR-UHFFFAOYSA-N
Literature Reference Author M.C.DANIEL,J.RUIZ,S.NLATE,J.C.BLAIS,D.ASTRUC
Literature Reference Citation J.AM.CHEM.SOC.,125,2617(2003)
Literature Reference DOI 10.1021/ja021325d
Molecular Weight 1110.898 g/mol
Sample ID 40663
Solvent CDCl3