| SpectraBase Spectrum ID |
2p498zC1dbB |
| Name |
Tricarbonyl[(2,5.eta.(4))-1-exo-(3-cyanopropyl)-1-endo-(phenylthio)-2,4-cyclohexadiene]iron |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H17FeNO3S |
| InChI |
InChI=1S/C16H17NS.3CO.Fe/c17-14-8-7-13-16(11-5-2-6-12-16)18-15-9-3-1-4-10-15;3*1-2;/h1-6,9-11H,7-8,12-13H2;;;;/q;3*+1;/t16-;;;;/m0..../s1 |
| InChIKey |
NCWCBAKUTPZPNG-FXAGWRDUSA-N |
| Molecular Weight |
395.254 g/mol |
| SMILES |
C12[Fe]34(C2[C@@](Sc2ccccc2)(CCCC#N)CC4C13)(C#[O+])(C#[O+])C#[O+] |
| SPLASH |
splash10-0ik9-0369000000-198f5361d3b298886939 |
| Source of Spectrum |
QA-43-361-5 |
| Synonyms |
Tricarbonyl[(2,5.eta.(4))-(3-cyanopropyl)-1-endo-(phenylthio)-2,4-cyclohexadiene]iron |
| Wiley ID |
862261 |
![Tricarbonyl[(2,5.eta.(4))-1-exo-(3-cyanopropyl)-1-endo-(phenylthio)-2,4-cyclohexadiene]iron](/api/spectrum/2p498zC1dbB/structure.png?h=300&w=458 "Tricarbonyl[(2,5.eta.(4))-1-exo-(3-cyanopropyl)-1-endo-(phenylthio)-2,4-cyclohexadiene]iron")
