C104H100F8N8O8Pt4-4 — CID 158674008
2-(4-fluorobenzene-6-id-1-yl)-3-(4-fluorophenyl)quinoxaline;bis(2-(4-methylphenyl)-3-[4-(trifluoromethyl)benzene-6-id-1-yl]quinoxaline);tetrakis(pentane-2,4-diol);2-phenyl-3-phenylquinoxaline;platinum (PubChem CID 158674008) has the molecular formula C104H100F8N8O8Pt4-4 and a molecular weight of 2522.29 g/mol. Its IUPAC name is 2-(4-fluorobenzene-6-id-1-yl)-3-(4-fluorophenyl)quinoxaline;bis(2-(4-methylphenyl)-3-[4-(trifluoromethyl)benzene-6-id-1-yl]quinoxaline);tetrakis(pentane-2,4-diol);2-phenyl-3-phenylquinoxaline;platinum.
| Compound Name | 2-(4-fluorobenzene-6-id-1-yl)-3-(4-fluorophenyl)quinoxaline;bis(2-(4-methylphenyl)-3-[4-(trifluoromethyl)benzene-6-id-1-yl]quinoxaline);tetrakis(pentane-2,4-diol);2-phenyl-3-phenylquinoxaline;platinum |
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| PubChem CID | 158674008 |
| Molecular Formula | C104H100F8N8O8Pt4-4 |
| Molecular Weight | 2522.29 g/mol |
| Exact Mass | 2520.61 |
| IUPAC Name | 2-(4-fluorobenzene-6-id-1-yl)-3-(4-fluorophenyl)quinoxaline;bis(2-(4-methylphenyl)-3-[4-(trifluoromethyl)benzene-6-id-1-yl]quinoxaline);tetrakis(pentane-2,4-diol);2-phenyl-3-phenylquinoxaline;platinum |
| SMILES | CC(O)CC(C)O.CC(O)CC(C)O.CC(O)CC(C)O.CC(O)CC(C)O.Cc1ccc(-c2nc3ccccc3nc2-c2[c-]cc(C(F)(F)F)cc2)cc1.Cc1ccc(-c2nc3ccccc3nc2-c2[c-]cc(C(F)(F)F)cc2)cc1.Fc1c[c-]c(-c2nc3ccccc3nc2-c2ccc(F)cc2)cc1.[Pt].[Pt].[Pt].[Pt].[c-]1ccccc1-c1nc2ccccc2nc1-c1ccccc1 |
| InChI | InChI=1S/2C22H14F3N2.C20H11F2N2.C20H13N2.4C5H12O2.4Pt/c2*1-14-6-8-15(9-7-14)20-21(27-19-5-3-2-4-18(19)26-20)16-10-12-17(13-11-16)22(23,24)25;21-15-9-5-13(6-10-15)19-20(14-7-11-16(22)12-8-14)24-18-4-2-1-3-17(18)23-19;1-3-9-15(10-4-1)19-20(16-11-5-2-6-12-16)22-18-14-8-7-13-17(18)21-19;4*1-4(6)3-5(2)7;;;;/h2*2-10,12-13H,1H3;1-7,9-12H;1-11,13-14H;4*4-7H,3H2,1-2H3;;;;/q4*-1;;;;;;;; |
| InChIKey | QJIWFJPCVSXUBP-UHFFFAOYSA-N |
| XLogP | 22.53 |
| TPSA | 264.96 Ų |
| H-Bond Donors | 8 |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 16 |
| Heavy Atoms | 132 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2522.29 |
| LogP ≤ 5 | 22.53 |
| H-Bond Donors ≤ 5 | 8 |
| H-Bond Acceptors ≤ 10 | 16 |
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'} |
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