SpectraBase Compound ID | BILn5PaIJB3 |
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InChI | InChI=1S/C28H20.6CO.2Fe/c1-5-13-23(14-6-1)21-27(25-17-9-3-10-18-25)28(26-19-11-4-12-20-26)22-24-15-7-2-8-16-24;6*1-2;;/h1-20H;;;;;;;; |
InChIKey | KCHOMAQQIMHMEL-UHFFFAOYSA-N |
Mol Weight | 636.218 g/mol |
Molecular Formula | C34H20Fe2O6 |
Exact Mass | 635.99586 g/mol |
SpectraBase Spectrum ID | JZJmDUFZGNh |
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Name | Iron, hexacarbonyl[.mu.-[(1,2,3,4-.eta.:1,4-.eta.)-1,2,3,4-tetraphenyl-1,3-butadiene-1,4-diyl]]di-, (Fe-Fe) |
Alternate Name(s) | (Tetraphenylbutadiene)hexacarbonyldiiron 1,1,1 tricarbonylferratetraphenylcyclopentadiene-.pi.-tricarbonyliron Iron, hexacarbonyl[.mu.-(1,2,3,4-tetraphenyl-1,3-butadienylene)]di-, (fe-fe) Iron, tricarbonyl-(1,2,3,4-tetraphenyl-6,6,6-tricarbonyl-6-ferra-1,3-cyclopentadiene) Iron, hexacarbonyl[.mu.-[(1,2,3,4-.eta.:1,4-.eta.)-1,2,3,4-tetraphenyl-1,3-butad Iron, hexacarbonyl[mu-(1,2,3,4-tetraphenyl-1,3-butadienylene)]di-, (fe-fe) Iron, hexacarbonyl[mu-[(1,2,3,4-eta:1,4-eta)-1,2,3,4-tetraphenyl-1,3-butadiene-1,4-diyl]]di-, (fe-fe) |
CAS Registry Number | 128659-48-3 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C34H20Fe2O6 |
InChI | InChI=1S/C28H20.6CO.2Fe/c1-5-13-23(14-6-1)21-27(25-17-9-3-10-18-25)28(26-19-11-4-12-20-26)22-24-15-7-2-8-16-24;6*1-2;;/h1-20H;;;;;;;; |
InChIKey | KCHOMAQQIMHMEL-UHFFFAOYSA-N |
Molecular Weight | 636.218 g/mol |
SMILES | C=1([Fe](C(=C(C1c1ccccc1)c1ccccc1)c1ccccc1)([Fe](C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])c1ccccc1 |
SPLASH | splash10-05ne-1260951000-44ce22a596970aca277b |
Source of Spectrum | HE-1982-0-0 |
Wiley ID | 1412387 |