C350H330Ir10N20O10Si10-20 — CID 158071448
[4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(4-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(4-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(4-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(4-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;decakis(iridium);pentakis(5-methyl-2-phenylpyridine);pentakis(2-phenylpyridine);trimethyl-[4-(5-methyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane;trimethyl-[6-(5-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]silane;trimethyl-[6-(5-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]silane;trimethyl-[6-(5-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]silane;trimethyl-[6-(5-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane (PubChem CID 158071448) has the molecular formula C350H330Ir10N20O10Si10-20 and a molecular weight of 7179.65 g/mol. Its IUPAC name is [4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(4-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(4-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(4-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(4-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;decakis(iridium);pentakis(5-methyl-2-phenylpyridine);pentakis(2-phenylpyridine);trimethyl-[4-(5-methyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane;trimethyl-[6-(5-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]silane;trimethyl-[6-(5-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]silane;trimethyl-[6-(5-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]silane;trimethyl-[6-(5-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane.
| Compound Name | [4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(4-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(4-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(4-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(4-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;decakis(iridium);pentakis(5-methyl-2-phenylpyridine);pentakis(2-phenylpyridine);trimethyl-[4-(5-methyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane;trimethyl-[6-(5-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]silane;trimethyl-[6-(5-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]silane;trimethyl-[6-(5-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]silane;trimethyl-[6-(5-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane |
|---|---|
| PubChem CID | 158071448 |
| Molecular Formula | C350H330Ir10N20O10Si10-20 |
| Molecular Weight | 7179.65 g/mol |
| Exact Mass | 7182.00 |
| IUPAC Name | [4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(4-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(4-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(4-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(4-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;decakis(iridium);pentakis(5-methyl-2-phenylpyridine);pentakis(2-phenylpyridine);trimethyl-[4-(5-methyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane;trimethyl-[6-(5-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]silane;trimethyl-[6-(5-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]silane;trimethyl-[6-(5-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]silane;trimethyl-[6-(5-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane |
| SMILES | C[Si](C)(C)c1c[c-]c(-c2cc(C3CCCCC3)ccn2)c2oc3ccccc3c12.C[Si](C)(C)c1ccc2c(c1)oc1c(-c3cc(C4CCCCC4)ccn3)[c-]ccc12.C[Si](C)(C)c1ccc2oc3c(-c4cc(C5CCCCC5)ccn4)[c-]ccc3c2c1.C[Si](C)(C)c1cccc2c1oc1c(-c3cc(C4CCCCC4)ccn3)[c-]ccc12.C[Si](C)(C)c1cccc2oc3c(-c4cc(C5CCCCC5)ccn4)[c-]ccc3c12.Cc1ccc(-c2[c-]cc([Si](C)(C)C)c3c2oc2ccccc23)nc1.Cc1ccc(-c2[c-]ccc3c2oc2c([Si](C)(C)C)cccc23)nc1.Cc1ccc(-c2[c-]ccc3c2oc2cc([Si](C)(C)C)ccc23)nc1.Cc1ccc(-c2[c-]ccc3c2oc2ccc([Si](C)(C)C)cc23)nc1.Cc1ccc(-c2[c-]ccc3c2oc2cccc([Si](C)(C)C)c23)nc1.Cc1ccc(-c2[c-]cccc2)nc1.Cc1ccc(-c2[c-]cccc2)nc1.Cc1ccc(-c2[c-]cccc2)nc1.Cc1ccc(-c2[c-]cccc2)nc1.Cc1ccc(-c2[c-]cccc2)nc1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1 |
| InChI | InChI=1S/5C26H28NOSi.5C21H20NOSi.5C12H10N.5C11H8N.10Ir/c1-29(2,3)24-14-8-12-21-20-11-7-13-22(25(20)28-26(21)24)23-17-19(15-16-27-23)18-9-5-4-6-10-18;1-29(2,3)24-14-8-13-23-25(24)21-12-7-11-20(26(21)28-23)22-17-19(15-16-27-22)18-9-5-4-6-10-18;1-29(2,3)24-14-13-20(26-25(24)21-11-7-8-12-23(21)28-26)22-17-19(15-16-27-22)18-9-5-4-6-10-18;1-29(2,3)20-12-13-21-22-10-7-11-23(26(22)28-25(21)17-20)24-16-19(14-15-27-24)18-8-5-4-6-9-18;1-29(2,3)20-12-13-25-23(17-20)21-10-7-11-22(26(21)28-25)24-16-19(14-15-27-24)18-8-5-4-6-9-18;1-14-11-12-18(22-13-14)17-9-5-7-15-16-8-6-10-19(24(2,3)4)21(16)23-20(15)17;1-14-11-12-17(22-13-14)15-7-5-8-16-20-18(23-21(15)16)9-6-10-19(20)24(2,3)4;1-14-8-11-19(22-13-14)18-7-5-6-17-16-10-9-15(24(2,3)4)12-20(16)23-21(17)18;1-14-8-10-19(22-13-14)17-7-5-6-16-18-12-15(24(2,3)4)9-11-20(18)23-21(16)17;1-14-9-11-17(22-13-14)15-10-12-19(24(2,3)4)20-16-7-5-6-8-18(16)23-21(15)20;5*1-10-7-8-12(13-9-10)11-5-3-2-4-6-11;5*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;;;;;;;/h7-8,11-12,14-18H,4-6,9-10H2,1-3H3;7-8,12-18H,4-6,9-10H2,1-3H3;7-8,11-12,14-18H,4-6,9-10H2,1-3H3;2*7,10,12-18H,4-6,8-9H2,1-3H3;5-8,10-13H,1-4H3;3*5-6,8-13H,1-4H3;5-9,11-13H,1-4H3;5*2-5,7-9H,1H3;5*1-6,8-9H;;;;;;;;;;/q20*-1;;;;;;;;;; |
| InChIKey | DUJBNURNEPKSNN-UHFFFAOYSA-N |
| XLogP | 88.72 |
| TPSA | 389.20 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 30 |
| Rotatable Bonds | 35 |
| Heavy Atoms | 400 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 7179.65 |
| LogP ≤ 5 | 88.72 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 30 |