SpectraBase Spectrum ID |
7K5hPDeCx10 |
Name |
Tricarbonyl{7,7,8,8-tetracyano-(2,3,4,5-.eta.)-bicyclo[4.2.1]nona-2,4-diene}iron |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H8FeN4O3 |
InChI |
InChI=1S/C13H8N4.3CO.Fe/c14-6-12(7-15)10-3-1-2-4-11(5-10)13(12,8-16)9-17;3*1-2;/h1-4,10-11H,5H2;;;;/t10-,11+;;;; |
InChIKey |
CTGYHWRXBSHUAY-GLECXXGLSA-N |
Molecular Weight |
360.110 g/mol |
SMILES |
[C@]12([Fe]34([C@]2([C@]2(C(C#N)(C#N)C([C@@]([C@@]4([C@]13[H])[H])(C2)[H])(C#N)C#N)[H])[H])(C#[O])(C#[O])C#[O])[H] |
SPLASH |
splash10-000x-9200000000-4bcdcf5401ad5a7ee581 |
Source of Spectrum |
SO-0-950-7 |
Wiley ID |
1538673 |