C86H72N8Pt4S4Si2 — CID 161121775
phenylbenzene;bis(2-phenylpyridine);tetrakis(platinum(2+));2-pyridin-2-ylpyridine;bis(2-(3H-thiophen-3-id-2-yl)pyridine);bis(trimethyl-(2-pyridin-2-yl-3H-thiophen-3-id-5-yl)silane) (PubChem CID 161121775) has the molecular formula C86H72N8Pt4S4Si2 and a molecular weight of 2182.33 g/mol. Its IUPAC name is phenylbenzene;bis(2-phenylpyridine);tetrakis(platinum(2+));2-pyridin-2-ylpyridine;bis(2-(3H-thiophen-3-id-2-yl)pyridine);bis(trimethyl-(2-pyridin-2-yl-3H-thiophen-3-id-5-yl)silane).
| Compound Name | phenylbenzene;bis(2-phenylpyridine);tetrakis(platinum(2+));2-pyridin-2-ylpyridine;bis(2-(3H-thiophen-3-id-2-yl)pyridine);bis(trimethyl-(2-pyridin-2-yl-3H-thiophen-3-id-5-yl)silane) |
|---|---|
| PubChem CID | 161121775 |
| Molecular Formula | C86H72N8Pt4S4Si2 |
| Molecular Weight | 2182.33 g/mol |
| Exact Mass | 2180.29 |
| IUPAC Name | phenylbenzene;bis(2-phenylpyridine);tetrakis(platinum(2+));2-pyridin-2-ylpyridine;bis(2-(3H-thiophen-3-id-2-yl)pyridine);bis(trimethyl-(2-pyridin-2-yl-3H-thiophen-3-id-5-yl)silane) |
| SMILES | C[Si](C)(C)c1c[c-]c(-c2ccccn2)s1.C[Si](C)(C)c1c[c-]c(-c2ccccn2)s1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1ccccc1-c1[c-]cccc1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccsc1-c1ccccn1.[c-]1ccsc1-c1ccccn1.c1ccc(-c2ccccn2)nc1 |
| InChI | InChI=1S/2C12H14NSSi.C12H8.2C11H8N.C10H8N2.2C9H6NS.4Pt/c2*1-15(2,3)12-8-7-11(14-12)10-6-4-5-9-13-10;1-3-7-11(8-4-1)12-9-5-2-6-10-12;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;1-3-7-11-9(5-1)10-6-2-4-8-12-10;2*1-2-6-10-8(4-1)9-5-3-7-11-9;;;;/h2*4-6,8-9H,1-3H3;1-7,9H;2*1-6,8-9H;1-8H;2*1-4,6-7H;;;;/q2*-1;-2;2*-1;;2*-1;4*+2 |
| InChIKey | VAQAQCDOKFNUCG-UHFFFAOYSA-N |
| XLogP | 21.72 |
| TPSA | 103.12 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 10 |
| Heavy Atoms | 104 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2182.33 |
| LogP ≤ 5 | 21.72 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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