EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C38H34IrN6.Cl |
| Net Charge | -1 |
| Average Mass | 802.402 |
| Monoisotopic Mass | 802.21682 |
| SMILES | CC1=CC=[N]2C(=C1)C1=CC(/C=N/C(C)=C(/C)N)=CC=[N]1[Ir]213([c]2ccccc2C2=CC=CC=[N]21)[c]1ccccc1C1=CC=CC=[N]13.[Cl-] |
| InChI | InChI=1S/C16H18N4.2C11H8N.ClH.Ir/c1-11-4-6-18-15(8-11)16-9-14(5-7-19-16)10-20-13(3)12(2)17;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;/h4-10H,17H2,1-3H3;2*1-6,8-9H;1H;/p-1/b13-12-,20-10+;;;; |
| InChIKey | ZJZISHFMRUEFME-XTFPHMQFSA-M |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| [(ppy)2Ir(dmn)]Cl (CHEBI:133489) is a organic molecular entity (CHEBI:50860) |
| Synonym | Source |
|---|---|
| Ir-dmn | SUBMITTER |
| Citations |
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