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Iron, .mu.-bicyclo[4.2.0]octa-1,3,5-triene-7,8-diyltetracarbonylbis(.eta.5-2,4-cyclopentadien-1-yl)di-, stereoisomer
SpectraBase Compound ID G1DEr4YadSH
InChI InChI=1S/C8H6.2C5H5.4CO.2Fe/c1-2-4-8-6-5-7(8)3-1;2*1-2-4-5-3-1;4*1-2;;/h1-6H;2*1-5H;;;;;;/q-2;;;;;;;2*+1
InChIKey MXUHAFMPOICVMU-UHFFFAOYSA-N
Mol Weight 445.98 g/mol
Molecular Formula C22H6Fe2O4
Exact Mass 445.896481 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A1exoU2yqch
Name Iron, .mu.-bicyclo[4.2.0]octa-1,3,5-triene-7,8-diyltetracarbonylbis(.eta.5-2,4-cyclopentadien-1-yl)di-, stereoisomer
Alternate Name(s) bicyclo[4.2.0]octa-1,3,5-triene-7,8-diide bis(cyclopentane-1,2,3,4,5-pentaide) tetrakis(methanidylidyneoxidanium) diiron Iron, mu-bicyclo[4.2.0]octa-1,3,5-triene-7,8-diyltetracarbonylbis(eta5-2,4-cyclopentadien-1-yl)di-, stereoisomer
CAS Registry Number 52520-36-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16Fe2O4
InChI InChI=1S/C8H6.2C5H5.4CO.2Fe/c1-2-4-8-6-5-7(8)3-1;2*1-2-4-5-3-1;4*1-2;;/h1-6H;2*1-5H;;;;;;/q-2;;;;;;;2*+1
InChIKey MXUHAFMPOICVMU-UHFFFAOYSA-N
Molecular Weight 445.976 g/mol
SMILES [C]1[C][C][C][C]1.[O+]#[C-].[O+]#[C-].[O+]#[C-].[O+]#[C-].[CH-]1[CH-]c2c1cccc2.[Fe+].[Fe+].[C]1[C][C][C][C]1
SPLASH splash10-0fki-5950000000-8a4b9a3ae22672a1675e
Source of Spectrum W5-0-0-0
Wiley ID 1389204