Iron, (.eta.5-2,4-cyclopentadien-1-yl)[(1,2,3,4,5-.eta.)-6-phenyl-2,4-cyclohexadien-1-yl]-, stereoisomer

SpectraBase Compound ID	EFinu4utsQW
InChI	InChI=1S/C12H11.C5H5.Fe/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-4-5-3-1;/h1-11H;1-5H;
InChIKey	QOSYZZAQODZGFA-UHFFFAOYSA-N Google Search
Mol Weight	276.16 g/mol
Molecular Formula	C17H16Fe
Exact Mass	276.060137 g/mol

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SpectraBase Spectrum ID	2KOus2iXoYt
Name	Iron, (.eta.5-2,4-cyclopentadien-1-yl)[(1,2,3,4,5-.eta.)-6-phenyl-2,4-cyclohexadien-1-yl]-, stereoisomer
Alternate Name(s)	(exo-Phenylcyclohexadienyl)(cyclopentadienyl)iron 6'-phenyl-1-ferraspiro[pentacyclo[2.2.0.0(1,3).0(1,5).0(2,6)]hexane-1,1'-pentacyclo[3.2.0.0(1,3).0(1,4).0(2,7)]heptane] Benzene, 2,4-cyclohexadien-1-yl-, iron complex
CAS Registry Number	57412-84-7
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H16Fe
InChI	InChI=1S/C12H11.C5H5.Fe/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-4-5-3-1;/h1-11H;1-5H;
InChIKey	QOSYZZAQODZGFA-UHFFFAOYSA-N
Molecular Weight	276.160 g/mol
SMILES	[C@]12([Fe]3456789([C@]1([C@@]5([C@](c1ccccc1)([C@@]3([C@]24[H])[H])[H])[H])[H])[C@]1([C@@]9([C@@]7([C@@]8([C@@]61[H])[H])[H])[H])[H])[H]
SPLASH	splash10-004i-0390000000-17799f7fc1d98f845646
Source of Spectrum	AG-96-266-1
Wiley ID	1280282