2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;1-methyl-2-phenylimidazole;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;2-phenylpyridine;platinum;platinum(2+)

C124H107F16IrN10O4OsP2Pt3-3 — CID 158604789

IUPAC2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;1-methyl-2-phenylimidazole;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;2-phenylpyridine;platinum;platinum(2+)
SMILESC(=C[PH+](c1ccccc1)c1ccccc1)[PH+](c1ccccc1)c1ccccc1.CCC1=C(CC)c2cc3[n-]c(cc4nc(cc5[n-]c(cc1n2)c(CC)c5CC)C(CC)=C4CC)c(CC)c3CC.Cn1ccnc1-c1[c-]cccc1.Fc1c[c-]c(-c2ccccn2)c(F)c1.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.[Ir].[Os].[Pt+2].[Pt].[Pt].[c-]1ccccc1-c1ccccn1.c1ccc(-c2ccnc(-c3cc(-c4ccccc4)ccn3)c2)cc1
InChIInChI=1S/C36H44N4.C26H22P2.C22H16N2.C11H6F2N.C11H8N.C10H9N2.2C4HF7O2.Ir.Os.3Pt/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-7-17(8-4-1)19-11-13-23-21(15-19)22-16-20(12-14-24-22)18-9-5-2-6-10-18;12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;1-2-6-10(7-3-1)11-8-4-5-9-12-11;1-12-8-7-11-10(12)9-5-3-2-4-6-9;2*5-2(6,1(12)13)3(7,8)4(9,10)11;;;;;/h17-20H,9-16H2,1-8H3;1-22H;1-16H;1-4,6-7H;1-6,8-9H;2-5,7-8H,1H3;2*(H,12,13);;;;;/q-2;;;3*-1;;;;;;;+2/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20-;;;;;;;;;;;;
InChIKeyVCLNJTSHIXCDMX-WSZPVVFGSA-N
MW3134.88 g/mol
LogP28.34
Rot. Bonds24

About 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;1-methyl-2-phenylimidazole;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;2-phenylpyridine;platinum;platinum(2+)

2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;1-methyl-2-phenylimidazole;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;2-phenylpyridine;platinum;platinum(2+) (PubChem CID 158604789) has the molecular formula C124H107F16IrN10O4OsP2Pt3-3 and a molecular weight of 3134.88 g/mol. Its IUPAC name is 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;1-methyl-2-phenylimidazole;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;2-phenylpyridine;platinum;platinum(2+).

Molecular Properties

Compound Name2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;1-methyl-2-phenylimidazole;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;2-phenylpyridine;platinum;platinum(2+)
PubChem CID158604789
Molecular FormulaC124H107F16IrN10O4OsP2Pt3-3
Molecular Weight3134.88 g/mol
Exact Mass3135.59
IUPAC Name2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;1-methyl-2-phenylimidazole;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;2-phenylpyridine;platinum;platinum(2+)
SMILESC(=C[PH+](c1ccccc1)c1ccccc1)[PH+](c1ccccc1)c1ccccc1.CCC1=C(CC)c2cc3[n-]c(cc4nc(cc5[n-]c(cc1n2)c(CC)c5CC)C(CC)=C4CC)c(CC)c3CC.Cn1ccnc1-c1[c-]cccc1.Fc1c[c-]c(-c2ccccn2)c(F)c1.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.[Ir].[Os].[Pt+2].[Pt].[Pt].[c-]1ccccc1-c1ccccn1.c1ccc(-c2ccnc(-c3cc(-c4ccccc4)ccn3)c2)cc1
InChIInChI=1S/C36H44N4.C26H22P2.C22H16N2.C11H6F2N.C11H8N.C10H9N2.2C4HF7O2.Ir.Os.3Pt/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-7-17(8-4-1)19-11-13-23-21(15-19)22-16-20(12-14-24-22)18-9-5-2-6-10-18;12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;1-2-6-10(7-3-1)11-8-4-5-9-12-11;1-12-8-7-11-10(12)9-5-3-2-4-6-9;2*5-2(6,1(12)13)3(7,8)4(9,10)11;;;;;/h17-20H,9-16H2,1-8H3;1-22H;1-16H;1-4,6-7H;1-6,8-9H;2-5,7-8H,1H3;2*(H,12,13);;;;;/q-2;;;3*-1;;;;;;;+2/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20-;;;;;;;;;;;;
InChIKeyVCLNJTSHIXCDMX-WSZPVVFGSA-N
XLogP28.34
TPSA203.62 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds24
Heavy Atoms161
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003134.88
LogP ≤ 528.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;1-methyl-2-phenylimidazole;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;2-phenylpyridine;platinum;platinum(2+)?
The IUPAC name of 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;1-methyl-2-phenylimidazole;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;2-phenylpyridine;platinum;platinum(2+) (CID 158604789) is 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;1-methyl-2-phenylimidazole;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;2-phenylpyridine;platinum;platinum(2+).
What is the SMILES notation for 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;1-methyl-2-phenylimidazole;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;2-phenylpyridine;platinum;platinum(2+)?
The canonical SMILES for 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;1-methyl-2-phenylimidazole;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;2-phenylpyridine;platinum;platinum(2+) is C(=C[PH+](c1ccccc1)c1ccccc1)[PH+](c1ccccc1)c1ccccc1.CCC1=C(CC)c2cc3[n-]c(cc4nc(cc5[n-]c(cc1n2)c(CC)c5CC)C(CC)=C4CC)c(CC)c3CC.Cn1ccnc1-c1[c-]cccc1.Fc1c[c-]c(-c2ccccn2)c(F)c1.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.[Ir].[Os].[Pt+2].[Pt].[Pt].[c-]1ccccc1-c1ccccn1.c1ccc(-c2ccnc(-c3cc(-c4ccccc4)ccn3)c2)cc1.
What is the InChIKey of 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;1-methyl-2-phenylimidazole;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;2-phenylpyridine;platinum;platinum(2+)?
The InChIKey is VCLNJTSHIXCDMX-WSZPVVFGSA-N. The full InChI is InChI=1S/C36H44N4.C26H22P2.C22H16N2.C11H6F2N.C11H8N.C10H9N2.2C4HF7O2.Ir.Os.3Pt/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-7-17(8-4-1)19-11-13-23-21(15-19)22-16-20(12-14-24-22)18-9-5-2-6-10-18;12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;1-2-6-10(7-3-1)11-8-4-5-9-12-11;1-12-8-7-11-10(12)9-5-3-2-4-6-9;2*5-2(6,1(12)13)3(7,8)4(9,10)11;;;;;/h17-20H,9-16H2,1-8H3;1-22H;1-16H;1-4,6-7H;1-6,8-9H;2-5,7-8H,1H3;2*(H,12,13);;;;;/q-2;;;3*-1;;;;;;;+2/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20-;;;;;;;;;;;;.
What are the key properties of 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;1-methyl-2-phenylimidazole;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;2-phenylpyridine;platinum;platinum(2+)?
2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;1-methyl-2-phenylimidazole;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;2-phenylpyridine;platinum;platinum(2+) has a molecular weight of 3134.88 g/mol, XLogP of 28.34, 24 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;1-methyl-2-phenylimidazole;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;2-phenylpyridine;platinum;platinum(2+) is sourced from PubChem (CID 158604789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).