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Bis[(4-[2.2]paracyclophanyl)methylcyclopentadienyl]iron(II)
SpectraBase Compound ID 4SKB729qEmr
InChI InChI=1S/2C22H21.Fe/c2*1-2-4-19(3-1)15-22-16-20-10-9-17-5-7-18(8-6-17)11-13-21(22)14-12-20;/h2*1-8,12,14,16H,9-11,13,15H2;/q2*-1;+2
InChIKey QRMRNZLLXVIANJ-UHFFFAOYSA-N
Mol Weight 626.67 g/mol
Molecular Formula C44H42Fe
Exact Mass 626.263587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5wIFKQSYMgX
Name Bis[(4-[2.2]paracyclophanyl)methylcyclopentadienyl]iron(II)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H42Fe
InChI InChI=1S/2C22H21.Fe/c2*1-2-4-19(3-1)15-22-16-20-10-9-17-5-7-18(8-6-17)11-13-21(22)14-12-20;/h2*1-8,12,14,16H,9-11,13,15H2;/q2*-1;+2
InChIKey QRMRNZLLXVIANJ-UHFFFAOYSA-N
Literature Reference DOI 10.1002_1099-0682(20021)2002_1_123
Molecular Weight 626.665 g/mol
SMILES c1c2ccc(c1)CCc1ccc(CC2)cc1Cc1[cH-]ccc1.[Fe+2].c1c2ccc(c1)CCc1ccc(CC2)cc1Cc1[cH-]ccc1
SPLASH splash10-004i-0804019000-6e93fc719e108c9fb7b3
Source of Spectrum U2-2002-128-7
Synonyms iron(II) 2-(1,4(1,4)-dibenzenacyclohexaphane-1(2)-ylmethyl)cyclopenta-2,4-dien-1-ide
Wiley ID 1793179