SpectraBase Spectrum ID |
D0pNHb5FrDF |
Name |
Tricarbonyl[(1-4-.eta.4)-5-exo-methoxy-1-(phenylsulfonyl)-1,3-cyclohexadiene]iron |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H14FeO6S |
InChI |
InChI=1S/C13H14O3S.3CO.Fe/c1-16-11-6-5-9-13(10-11)17(14,15)12-7-3-2-4-8-12;3*1-2;/h2-9,11H,10H2,1H3;;;;/q;3*+1;/t11-;;;;/m1..../s1 |
InChIKey |
CGLOQDNWMWFADR-LOSFGHDGSA-N |
Molecular Weight |
390.187 g/mol |
SMILES |
C12([Fe]34(C([C@](C2)(OC)[H])C4C13)(C#[O+])(C#[O+])C#[O+])S(=O)(=O)c1ccccc1 |
SPLASH |
splash10-004i-1391000000-66d33a863e88d4734e2c |
Source of Spectrum |
QA-44-365-4 |
Wiley ID |
862589 |