((5-ETA-C5H5)2ZRC4)-(C6H4ME)2-(C6H4CF3)2

SpectraBase Compound ID	J3DtWOdWVv1
InChI	InChI=1S/C32H22F6.2C5H.Zr/c1-21-3-11-25(12-4-21)29(19-23-7-15-27(16-8-23)31(33,34)35)30(26-13-5-22(2)6-14-26)20-24-9-17-28(18-10-24)32(36,37)38;21-2-4-5-3-1;/h3-18H,1-2H3;21H;
InChIKey	HBDQCWJIGMLHJQ-UHFFFAOYSA-N Google Search
Mol Weight	733.9 g/mol
Molecular Formula	C42H24F6Zr
Exact Mass	732.082919 g/mol

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SpectraBase Spectrum ID	4sBwMWo6PmZ
Name	((5-ETA-C5H5)2ZRC4)-(C6H4ME)2-(C6H4CF3)2
Compound Number	2D -(ALPHA-ALPHA)
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C42H24F6Zr
InChI	InChI=1S/C32H22F6.2C5H.Zr/c1-21-3-11-25(12-4-21)29(19-23-7-15-27(16-8-23)31(33,34)35)30(26-13-5-22(2)6-14-26)20-24-9-17-28(18-10-24)32(36,37)38;21-2-4-5-3-1;/h3-18H,1-2H3;21H;
InChIKey	HBDQCWJIGMLHJQ-UHFFFAOYSA-N
Literature Reference Author	S.A.JONSON,F.Q.LIU,M.C.SUH,S.ZUERCHER,M.HAUFE,S.S.H.MAO,T.D. TILLEY
Literature Reference Citation	J.AM.CHEM.SOC.,125,4199(2003)
Literature Reference DOI	10.1021/ja0209161
Solvent	C6D6
Source File Reference	UWLU40859