C94H78N6O2Rh4S-4 — CID 160507540
5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(rhodium) (PubChem CID 160507540) has the molecular formula C94H78N6O2Rh4S-4 and a molecular weight of 1767.39 g/mol. Its IUPAC name is 5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(rhodium).
| Compound Name | 5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(rhodium) |
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| PubChem CID | 160507540 |
| Molecular Formula | C94H78N6O2Rh4S-4 |
| Molecular Weight | 1767.39 g/mol |
| Exact Mass | 1766.21 |
| IUPAC Name | 5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(rhodium) |
| SMILES | Cc1cc(-c2ccccc2)cc(C)c1-c1cc(-c2[c-]cccc2)no1.Cc1cc(-c2ccccc2)cc(C)c1-c1nnc(-c2[c-]cccc2)n1C.Cc1cc(-c2ccccc2)cc(C)c1-c1oc(-c2[c-]cccc2)nc1C.Cc1cc(-c2ccccc2)cc(C)c1-c1sc(-c2[c-]cccc2)nc1C.[Rh].[Rh].[Rh].[Rh] |
| InChI | InChI=1S/C24H20NO.C24H20NS.C23H20N3.C23H18NO.4Rh/c2*1-16-14-21(19-10-6-4-7-11-19)15-17(2)22(16)23-18(3)25-24(26-23)20-12-8-5-9-13-20;1-16-14-20(18-10-6-4-7-11-18)15-17(2)21(16)23-25-24-22(26(23)3)19-12-8-5-9-13-19;1-16-13-20(18-9-5-3-6-10-18)14-17(2)23(16)22-15-21(24-25-22)19-11-7-4-8-12-19;;;;/h3*4-12,14-15H,1-3H3;3-11,13-15H,1-2H3;;;;/q4*-1;;;; |
| InChIKey | ZQLYGNNQRRLODZ-UHFFFAOYSA-N |
| XLogP | 24.59 |
| TPSA | 95.66 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 107 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1767.39 |
| LogP ≤ 5 | 24.59 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 9 |
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'} |
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