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HEXACARBONYL-MY-[(1,2,2-ALPHA-ETA(3):3,3-ALPHA,4-ETA-(3))-2,3-DI-(E)-BENZYLIDENE-1,3-ANTI-BUTADIEN]-DIIRON
SpectraBase Compound ID 3qTQc8Na25X
InChI InChI=1S/C18H16.6CO.2Fe/c1-15(13-17-9-5-3-6-10-17)16(2)14-18-11-7-4-8-12-18;6*1-2;;/h3-14H,1-2H2;;;;;;;;
InChIKey WWEZAZLNTDICBN-UHFFFAOYSA-N
Mol Weight 512.08 g/mol
Molecular Formula C24H16Fe2O6
Exact Mass 511.96456 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BGyzv4Vic9M
Name Hexacarbonyl-.mu.-[{1,2,2.alpha.-.eta.(3):3,3.alpha.,4-.eta.(3)}-2,3-di-(E)-benzylidene-1,3-anti-butadiene]-diiron
CAS Registry Number 122675-05-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H16Fe2O6
InChI InChI=1S/C18H16.6CO.2Fe/c1-15(13-17-9-5-3-6-10-17)16(2)14-18-11-7-4-8-12-18;6*1-2;;/h3-14H,1-2H2;;;;;;;;
InChIKey WWEZAZLNTDICBN-UHFFFAOYSA-N
Molecular Weight 512.076 g/mol
SMILES [C@]12([Fe]([C@]2(c2ccccc2)[H])(C1)(C#[O])(C#[O])C#[O])C12[Fe](C#[O])(C#[O])(C#[O])(C2c2ccccc2)C1
SPLASH splash10-054o-8559700000-cf877682170528d8840b
Source of Spectrum K-123-355-8
Synonyms Hexacarbonyl-.mu.-[{1,2,2.alpha.-.eta.(3):3,3.alpha.,4-.eta.(3)}-2,3-di(E)-benzylidene-1,3-syn-butadiene]-diiron 1,1,1-tris(hydroxymethyl)-2-phenyl-3-[1,1,1-tris(hydroxymethyl)-2-phenyl-1-ferrabicyclo[1.1.0]butan-3-yl]-1-ferrabicyclo[1.1.0]butane
Wiley ID 1400744