| SpectraBase Spectrum ID |
1Q0kHasTMfI |
| Name |
Iron,cyanodicarbonyl-.pi.-cyclopentadienyl |
| CAS Registry Number |
12152-37-3 |
| Comments |
Note: The molecular formula of the structure shown is C8HFeNO2 - which differs from the formula reported for the mass spectrum (C8H5FeNO2) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H5FeNO2 |
| InChI |
InChI=1S/C5H.CN.2CO.Fe/c1-2-4-5-3-1;3*1-2;/h1H;;;;/q;;2*+1; |
| InChIKey |
QZZLTAIODAQNHS-UHFFFAOYSA-N |
| Molecular Weight |
198.946 g/mol |
| SMILES |
C(#N)[Fe]1234(C#[O+])(C#[O+])C5C4=C1C2=C35 |
| SPLASH |
splash10-05mk-8910000000-a33ccc89f830b15323cf |
| Source of Spectrum |
W5-1989-36871-28665 |
| Synonyms |
Iron,cyanodicarbonyl-pi-cyclopentadienyl
{[1-cyano-1-(oxidaniumylidynemethyl)-1-ferrapentacyclo[2.2.0.0(1,3).0(1,5).0(2,6)]hexa-2,4-dien-1-yl]methylidyne}oxidanium |
| Wiley ID |
1200542 |
