[MO2-(ETA(5)-C5H5)(2)-(H)-(MIU-KAPPA(1):KAPPA(1),ETA(6)-P-(2,4,6-C6H2-T-BU3))-(CO)(2)]-[B-(3,5-C6H3-(CF3)2)(4)]

SpectraBase Compound ID	9kHSSqP57nI
InChI	InChI=1S/C32H12BF24.C18H27P.2C5H.2CO.2Mo.H/c34-25(35,36)13-1-14(26(37,38)39)6-21(5-13)33(22-7-15(27(40,41)42)2-16(8-22)28(43,44)45,23-9-17(29(46,47)48)3-18(10-23)30(49,50)51)24-11-19(31(52,53)54)4-20(12-24)32(55,56)57;1-16(2,3)12-10-13(17(4,5)6)15(19)14(11-12)18(7,8)9;21-2-4-5-3-1;21-2;;;/h1-12H;1-9H3;2*1H;;;;;/q-1;+1;;;;;;;
InChIKey	ABPFFTXBYNJHLX-UHFFFAOYSA-N Google Search
Mol Weight	1509.67 g/mol
Molecular Formula	C62H43BF24Mo2O2P
Exact Mass	1513.081857 g/mol

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SpectraBase Spectrum ID	118lrT1jEv6
Name	[MO2-(ETA(5)-C5H5)(2)-(H)-(MIU-KAPPA(1):KAPPA(1),ETA(6)-P-(2,4,6-C6H2-T-BU3))-(CO)(2)]-[B-(3,5-C6H3-(CF3)2)(4)]
Compound Number	5-TRANS
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C62H42BF24Mo2O2P
InChI	InChI=1S/C32H12BF24.C18H27P.2C5H.2CO.2Mo.H/c34-25(35,36)13-1-14(26(37,38)39)6-21(5-13)33(22-7-15(27(40,41)42)2-16(8-22)28(43,44)45,23-9-17(29(46,47)48)3-18(10-23)30(49,50)51)24-11-19(31(52,53)54)4-20(12-24)32(55,56)57;1-16(2,3)12-10-13(17(4,5)6)15(19)14(11-12)18(7,8)9;21-2-4-5-3-1;21-2;;;/h1-12H;1-9H3;2*1H;;;;;/q-1;+1;;;;;;;
InChIKey	ABPFFTXBYNJHLX-UHFFFAOYSA-N
Literature Reference Author	M.E.GARCIA,V.RIERA,M.A.RUIZ,D.SAEZ,H.HAMIDOV,J.C.JEFFERY,T.R IIS-JOHANNESSEN
Literature Reference Citation	J.AM.CHEM.SOC.,125,13044(2003)
Literature Reference DOI	10.1021/ja037293r
Solvent	CD2Cl2
Source File Reference	UWSI35227