SpectraBase Spectrum ID |
3PVrjCHPd1H |
Name |
Iron, tricarbonyl[(2,3,5,6-.eta.)-2,3,5,6-tetramethyl-7,8-bis(trifluoromethyl)bicyclo[2.2.2]octa-2,5,7-triene]- |
CAS Registry Number |
55493-71-5 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H14F6FeO3 |
InChI |
InChI=1S/C14H14F6.3CO.Fe/c1-5-6(2)10-8(4)7(3)9(5)11(13(15,16)17)12(10)14(18,19)20;3*1-2;/h9-10H,1-4H3;;;;/q-4;;;;/t9-,10+;;;; |
InChIKey |
IBDMSRWVDCHAFP-GUQANJBTSA-N |
Molecular Weight |
436.132 g/mol |
SMILES |
[Fe].C=1([C@]2([C-](C)[C-]([C@]([C-](C)[C-]2C)(C1C(F)(F)F)[H])C)[H])C(F)(F)F.[O+]#[C-].[O+]#[C-].[O+]#[C-] |
SPLASH |
splash10-0udi-4492000000-d8b3ab71a0de849d01dc |
Source of Spectrum |
AD-0-2803-0 |
Synonyms |
.pi.-(2,3-bis(trifluoromethyl)-5,6,7,8-tetramethylbicyclo(2.2.2)-octa-2,5,7-trienyl)-tricarbonyliron
2,3,5,6-tetramethyl-7,8-bis(trifluoromethyl)bicyclo[2.2.2]oct-7-ene-2,3,5,6-tetraide tris(methanidylidyneoxidanium) iron
Iron, tricarbonyl[(2,3,5,6-eta)-2,3,5,6-tetramethyl-7,8-bis(trifluoromethyl)bicyclo[2.2.2]octa-2,5,7-triene]- |
Wiley ID |
59809 |