1,5-Diamino-2,4-bis{tricarbonyl[(2-5.eta.)cyclohexa-2,4-dienyl]iron}benzene

SpectraBase Compound ID	DjbwYw9iPm5
InChI	InChI=1S/C18H20N2.6CO.2Fe/c19-17-12-18(20)16(14-9-5-2-6-10-14)11-15(17)13-7-3-1-4-8-13;6*1-2;;/h1-7,9,11-14H,8,10,19-20H2;;;;;;;;
InChIKey	GZAGQGPTDFNUMM-UHFFFAOYSA-N Google Search
Mol Weight	544.12 g/mol
Molecular Formula	C24H20Fe2N2O6
Exact Mass	544.002008 g/mol

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SpectraBase Spectrum ID	WicNkMJ3Zr
Name	1,5-Diamino-2,4-bis{tricarbonyl[(2-5.eta.)cyclohexa-2,4-dienyl]iron}benzene
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C24H20Fe2N2O6
InChI	InChI=1S/C18H20N2.6CO.2Fe/c19-17-12-18(20)16(14-9-5-2-6-10-14)11-15(17)13-7-3-1-4-8-13;6*1-2;;/h1-7,9,11-14H,8,10,19-20H2;;;;;;;;
InChIKey	GZAGQGPTDFNUMM-UHFFFAOYSA-N
Molecular Weight	544.122 g/mol
SMILES	Nc1c(cc(c(c1)N)C1C2[Fe]34(C2C4C3C1)(C#[O])(C#[O])C#[O])C1C2[Fe]34(C#[O])(C#[O])(C#[O])C(C4C23)C1
SPLASH	splash10-0296-0496510000-0868742565ce75790491
Source of Spectrum	F-56-4736-9
Wiley ID	856704