C181H172Ge5Ir5N10-10 — CID 161009253
[4-cyclopentyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-dimethyl-phenylgermane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-dimethyl-phenylgermane;dimethyl-(4-methyl-6-phenyl-3-pyridinyl)-phenylgermane;dimethyl-[4-(2-methylpropyl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-phenylgermane;dimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]-phenylgermane;pentakis(iridium);pentakis(2-phenylpyridine) (PubChem CID 161009253) has the molecular formula C181H172Ge5Ir5N10-10 and a molecular weight of 3811.57 g/mol. Its IUPAC name is [4-cyclopentyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-dimethyl-phenylgermane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-dimethyl-phenylgermane;dimethyl-(4-methyl-6-phenyl-3-pyridinyl)-phenylgermane;dimethyl-[4-(2-methylpropyl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-phenylgermane;dimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]-phenylgermane;pentakis(iridium);pentakis(2-phenylpyridine).
| Compound Name | [4-cyclopentyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-dimethyl-phenylgermane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-dimethyl-phenylgermane;dimethyl-(4-methyl-6-phenyl-3-pyridinyl)-phenylgermane;dimethyl-[4-(2-methylpropyl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-phenylgermane;dimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]-phenylgermane;pentakis(iridium);pentakis(2-phenylpyridine) |
|---|---|
| PubChem CID | 161009253 |
| Molecular Formula | C181H172Ge5Ir5N10-10 |
| Molecular Weight | 3811.57 g/mol |
| Exact Mass | 3819.80 |
| IUPAC Name | [4-cyclopentyl-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-dimethyl-phenylgermane;(4-cyclopentyl-6-phenyl-3-pyridinyl)-dimethyl-phenylgermane;dimethyl-(4-methyl-6-phenyl-3-pyridinyl)-phenylgermane;dimethyl-[4-(2-methylpropyl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-phenylgermane;dimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]-phenylgermane;pentakis(iridium);pentakis(2-phenylpyridine) |
| SMILES | CC(C)Cc1cc(-c2[c-]ccc(-c3ccccc3)c2)ncc1[Ge](C)(C)c1ccccc1.CC(C)Cc1cc(-c2[c-]cccc2)ncc1[Ge](C)(C)c1ccccc1.C[Ge](C)(c1ccccc1)c1cnc(-c2[c-]ccc(-c3ccccc3)c2)cc1C1CCCC1.C[Ge](C)(c1ccccc1)c1cnc(-c2[c-]cccc2)cc1C1CCCC1.Cc1cc(-c2[c-]cccc2)ncc1[Ge](C)(C)c1ccccc1.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1 |
| InChI | InChI=1S/C30H30GeN.C29H30GeN.C24H26GeN.C23H26GeN.C20H20GeN.5C11H8N.5Ir/c1-31(2,27-18-7-4-8-19-27)29-22-32-30(21-28(29)24-14-9-10-15-24)26-17-11-16-25(20-26)23-12-5-3-6-13-23;1-22(2)18-26-20-29(25-15-11-14-24(19-25)23-12-7-5-8-13-23)31-21-28(26)30(3,4)27-16-9-6-10-17-27;1-25(2,21-15-7-4-8-16-21)23-18-26-24(20-13-5-3-6-14-20)17-22(23)19-11-9-10-12-19;1-18(2)15-20-16-23(19-11-7-5-8-12-19)25-17-22(20)24(3,4)21-13-9-6-10-14-21;1-16-14-20(17-10-6-4-7-11-17)22-15-19(16)21(2,3)18-12-8-5-9-13-18;5*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;;/h3-8,11-13,16,18-22,24H,9-10,14-15H2,1-2H3;5-14,16-17,19-22H,18H2,1-4H3;3-8,13,15-19H,9-12H2,1-2H3;5-11,13-14,16-18H,15H2,1-4H3;4-10,12-15H,1-3H3;5*1-6,8-9H;;;;;/q10*-1;;;;; |
| InChIKey | LMENEJHTOHQZRQ-UHFFFAOYSA-N |
| XLogP | 38.94 |
| TPSA | 128.90 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 10 |
| Rotatable Bonds | 28 |
| Heavy Atoms | 201 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3811.57 |
| LogP ≤ 5 | 38.94 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 10 |
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'} |
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