| SpectraBase Spectrum ID |
9yGUWEzL1U3 |
| Name |
(1RS,2RS,5SR,2E,4E)-Tricarbonyl-{[.eta(4).-(2->5)-1-cyanohexa-2,4-dienyl]-(3',5'-dinitrobenzoate}-iron |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H11FeN3O9 |
| InChI |
InChI=1S/C14H11N3O6.3CO.Fe/c1-2-3-4-5-13(9-15)23-14(18)10-6-11(16(19)20)8-12(7-10)17(21)22;3*1-2;/h2-8,13H,1H3;;;;/t13-;;;;/m1..../s1 |
| InChIKey |
JEIAEBIVJHHXEX-SVZPRBGCSA-N |
| Molecular Weight |
457.132 g/mol |
| SMILES |
C12[Fe]3(C2[C@@](OC(c2cc(N(=O)=O)cc(N(=O)=O)c2)=O)(C#N)[H])(C1C3C)(C#[O])(C#[O])C#[O] |
| SPLASH |
splash10-004i-9000000000-71f8c37709c9b79f7905 |
| Source of Spectrum |
C-121-9149-3b |
| Wiley ID |
1700334 |
![(1RS,2RS,5SR,2E,4E)-Tricarbonyl-{[.eta(4).-(2->5)-1-cyanohexa-2,4-dienyl]-(3',5'-dinitrobenzoate}-iron](/api/spectrum/9yGUWEzL1U3/structure.png?h=300&w=458 "(1RS,2RS,5SR,2E,4E)-Tricarbonyl-{[.eta(4).-(2->5)-1-cyanohexa-2,4-dienyl]-(3',5'-dinitrobenzoate}-iron")
