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Pentacarbonyl{5-[(eta-cyclopentadienyl)dicarbonylferrio]-1,3,4-thiadiazolin-2-ylidene}chromium
SpectraBase Compound ID JEwZROdFJ8U
InChI InChI=1S/C5H5.C2HN2S.7CO.Cr.Fe/c1-2-4-5-3-1;1-3-4-2-5-1;7*1-2;;/h1-5H;3H;;;;;;;;;/q2*-1;;;;;;;;;+2
InChIKey GJNLVGJELCKXFJ-UHFFFAOYSA-N
Mol Weight 455.12 g/mol
Molecular Formula C14H7CrFeN2O7S
Exact Mass 454.872838 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KAA5ehiV6Ph
Name Pentacarbonyl{5-[(eta-cyclopentadienyl)dicarbonylferrio]-1,3,4-thiadiazolin-2-ylidene}chromium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H6CrFeN2O7S
InChI InChI=1S/C5H5.C2HN2S.7CO.Cr.Fe/c1-2-4-5-3-1;1-3-4-2-5-1;7*1-2;;/h1-5H;3H;;;;;;;;;/q2*-1;;;;;;;;;+2
InChIKey GJNLVGJELCKXFJ-UHFFFAOYSA-N
Molecular Weight 455.118 g/mol
SMILES c1ccc[cH-]1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe+2].[C-]#[O+].[C-]#[O+].[Cr].N1[CH]S[C-]=N1
SPLASH splash10-00di-0090000000-ea3e1e347034152d9d2c
Source of Spectrum DZ-636-707-6
Wiley ID 1796739