9H-anthracen-9-ide;benzene;chloroplatinum(1+);4-(4-methoxyphenyl)-2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine;tris(platinum(2+));2-pyridin-2-yl-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine

C107H78ClF3N8OPt4 — CID 161414984

About 9H-anthracen-9-ide;benzene;chloroplatinum(1+);4-(4-methoxyphenyl)-2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine;tris(platinum(2+));2-pyridin-2-yl-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine

9H-anthracen-9-ide;benzene;chloroplatinum(1+);4-(4-methoxyphenyl)-2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine;tris(platinum(2+));2-pyridin-2-yl-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine (PubChem CID 161414984) has the molecular formula C107H78ClF3N8OPt4 and a molecular weight of 2364.61 g/mol. Its IUPAC name is 9H-anthracen-9-ide;benzene;chloroplatinum(1+);4-(4-methoxyphenyl)-2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine;tris(platinum(2+));2-pyridin-2-yl-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine.

Molecular Properties

• Compound Name: 9H-anthracen-9-ide;benzene;chloroplatinum(1+);4-(4-methoxyphenyl)-2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine;tris(platinum(2+));2-pyridin-2-yl-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine
• PubChem CID: 161414984
• Molecular Formula: C107H78ClF3N8OPt4
• Molecular Weight: 2364.61 g/mol
• Exact Mass: 2362.45
• IUPAC Name: 9H-anthracen-9-ide;benzene;chloroplatinum(1+);4-(4-methoxyphenyl)-2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine;tris(platinum(2+));2-pyridin-2-yl-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine
• SMILES: COc1ccc(-c2cc(-c3[c-]cccc3)nc(-c3ccccn3)c2)cc1.Cc1cc(C)c(-c2cc(-c3[c-]cccc3)nc(-c3ccccn3)c2)c(C)c1.Cl[Pt+].FC(F)(F)c1c[c-]c(-c2cccc(-c3ccccn3)n2)cc1.[Pt+2].[Pt+2].[Pt+2].[c-]1c2ccccc2cc2ccccc12.[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1-c1cccc(-c2ccccn2)n1
• InChI: InChI=1S/C25H21N2.C23H17N2O.C17H10F3N2.C16H11N2.C14H9.2C6H5.ClH.4Pt/c1-17-13-18(2)25(19(3)14-17)21-15-23(20-9-5-4-6-10-20)27-24(16-21)22-11-7-8-12-26-22;1-26-20-12-10-17(11-13-20)19-15-22(18-7-3-2-4-8-18)25-23(16-19)21-9-5-6-14-24-21;18-17(19,20)13-9-7-12(8-10-13)14-5-3-6-16(22-14)15-4-1-2-11-21-15;1-2-7-13(8-3-1)14-10-6-11-16(18-14)15-9-4-5-12-17-15;1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1;2*1-2-4-6-5-3-1;;;;;/h4-9,11-16H,1-3H3;2-7,9-16H,1H3;1-7,9-11H;1-7,9-12H;1-9H;2*1-5H;1H;;;;/q7*-1;;4*+2/p-1
• InChIKey: XSRUPLGIMDARRC-UHFFFAOYSA-M
• XLogP: 27.18
• TPSA: 112.35 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 11
• Heavy Atoms: 124
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2364.61
LogP ≤ 5	27.18
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 9H-anthracen-9-ide;benzene;chloroplatinum(1+);4-(4-methoxyphenyl)-2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine;tris(platinum(2+));2-pyridin-2-yl-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine?

The IUPAC name of 9H-anthracen-9-ide;benzene;chloroplatinum(1+);4-(4-methoxyphenyl)-2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine;tris(platinum(2+));2-pyridin-2-yl-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine (CID 161414984) is 9H-anthracen-9-ide;benzene;chloroplatinum(1+);4-(4-methoxyphenyl)-2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine;tris(platinum(2+));2-pyridin-2-yl-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine.

What is the SMILES notation for 9H-anthracen-9-ide;benzene;chloroplatinum(1+);4-(4-methoxyphenyl)-2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine;tris(platinum(2+));2-pyridin-2-yl-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine?

The canonical SMILES for 9H-anthracen-9-ide;benzene;chloroplatinum(1+);4-(4-methoxyphenyl)-2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine;tris(platinum(2+));2-pyridin-2-yl-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine is COc1ccc(-c2cc(-c3[c-]cccc3)nc(-c3ccccn3)c2)cc1.Cc1cc(C)c(-c2cc(-c3[c-]cccc3)nc(-c3ccccn3)c2)c(C)c1.Cl[Pt+].FC(F)(F)c1c[c-]c(-c2cccc(-c3ccccn3)n2)cc1.[Pt+2].[Pt+2].[Pt+2].[c-]1c2ccccc2cc2ccccc12.[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1-c1cccc(-c2ccccn2)n1.

What is the InChIKey of 9H-anthracen-9-ide;benzene;chloroplatinum(1+);4-(4-methoxyphenyl)-2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine;tris(platinum(2+));2-pyridin-2-yl-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine?

The InChIKey is XSRUPLGIMDARRC-UHFFFAOYSA-M. The full InChI is InChI=1S/C25H21N2.C23H17N2O.C17H10F3N2.C16H11N2.C14H9.2C6H5.ClH.4Pt/c1-17-13-18(2)25(19(3)14-17)21-15-23(20-9-5-4-6-10-20)27-24(16-21)22-11-7-8-12-26-22;1-26-20-12-10-17(11-13-20)19-15-22(18-7-3-2-4-8-18)25-23(16-19)21-9-5-6-14-24-21;18-17(19,20)13-9-7-12(8-10-13)14-5-3-6-16(22-14)15-4-1-2-11-21-15;1-2-7-13(8-3-1)14-10-6-11-16(18-14)15-9-4-5-12-17-15;1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1;2*1-2-4-6-5-3-1;;;;;/h4-9,11-16H,1-3H3;2-7,9-16H,1H3;1-7,9-11H;1-7,9-12H;1-9H;2*1-5H;1H;;;;/q7*-1;;4*+2/p-1.

What are the key properties of 9H-anthracen-9-ide;benzene;chloroplatinum(1+);4-(4-methoxyphenyl)-2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine;tris(platinum(2+));2-pyridin-2-yl-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine?

9H-anthracen-9-ide;benzene;chloroplatinum(1+);4-(4-methoxyphenyl)-2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine;tris(platinum(2+));2-pyridin-2-yl-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine has a molecular weight of 2364.61 g/mol, XLogP of 27.18, 11 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 9H-anthracen-9-ide;benzene;chloroplatinum(1+);4-(4-methoxyphenyl)-2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-ylpyridine;2-phenyl-6-pyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine;tris(platinum(2+));2-pyridin-2-yl-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine is sourced from PubChem (CID 161414984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).