About [1-[3-[[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-(2,6-diphenylphenyl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-(N-[3-[difluoro(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2,6-diphenylanilino)benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-(3-pyridin-2-yloxybenzene-2-id-1-yl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum
[1-[3-[[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-(2,6-diphenylphenyl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-(N-[3-[difluoro(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2,6-diphenylanilino)benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-(3-pyridin-2-yloxybenzene-2-id-1-yl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum (PubChem CID 163553580) has the molecular formula C178H130B3F2N13O3Pt4-8
and a molecular weight of 3349.83 g/mol. Its IUPAC name is [1-[3-[[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-(2,6-diphenylphenyl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-(N-[3-[difluoro(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2,6-diphenylanilino)benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-(3-pyridin-2-yloxybenzene-2-id-1-yl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum.
Analyze [1-[3-[[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-(2,6-diphenylphenyl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-(N-[3-[difluoro(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2,6-diphenylanilino)benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-(3-pyridin-2-yloxybenzene-2-id-1-yl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum with MolForge
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Frequently Asked Questions
What is the IUPAC name of [1-[3-[[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-(2,6-diphenylphenyl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-(N-[3-[difluoro(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2,6-diphenylanilino)benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-(3-pyridin-2-yloxybenzene-2-id-1-yl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum?
The IUPAC name of [1-[3-[[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-(2,6-diphenylphenyl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-(N-[3-[difluoro(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2,6-diphenylanilino)benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-(3-pyridin-2-yloxybenzene-2-id-1-yl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum (CID 163553580) is [1-[3-[[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-(2,6-diphenylphenyl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-(N-[3-[difluoro(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2,6-diphenylanilino)benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-(3-pyridin-2-yloxybenzene-2-id-1-yl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum.
What is the SMILES notation for [1-[3-[[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-(2,6-diphenylphenyl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-(N-[3-[difluoro(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2,6-diphenylanilino)benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-(3-pyridin-2-yloxybenzene-2-id-1-yl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum?
The canonical SMILES for [1-[3-[[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-(2,6-diphenylphenyl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-(N-[3-[difluoro(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2,6-diphenylanilino)benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-(3-pyridin-2-yloxybenzene-2-id-1-yl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum is Cc1ccnc(Oc2[c-]c(B(c3[c-]c(-n4c(=[Pt])n(C)c5ccccc54)ccc3)c3c(-c4ccccc4)cccc3-c3ccccc3)ccc2)c1.Cn1c(=[Pt])n(-c2[c-]c(B(c3[c-]c(Oc4cc(C(C)(C)C)ccn4)ccc3)c3c(-c4ccccc4)cccc3-c3ccccc3)ccc2)c2ccccc21.Cn1c(=[Pt])n(-c2[c-]c(B(c3[c-]c(Oc4ccccn4)ccc3)c3c(-c4ccccc4)cccc3-c3ccccc3)ccc2)c2ccccc21.Cn1c(=[Pt])n(-c2[c-]c(N(c3[c-]c(C(F)(F)c4ccccn4)ccc3)c3c(-c4ccccc4)cccc3-c3ccccc3)ccc2)c2ccccc21.
What is the InChIKey of [1-[3-[[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-(2,6-diphenylphenyl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-(N-[3-[difluoro(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2,6-diphenylanilino)benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-(3-pyridin-2-yloxybenzene-2-id-1-yl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum?
The InChIKey is SCLFRXDYIOLBJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C47H38BN3O.C44H32BN3O.C44H30F2N4.C43H30BN3O.4Pt/c1-47(2,3)36-28-29-49-45(30-36)52-40-23-14-21-38(32-40)48(37-20-13-22-39(31-37)51-33-50(4)43-26-11-12-27-44(43)51)46-41(34-16-7-5-8-17-34)24-15-25-42(46)35-18-9-6-10-19-35;1-32-26-27-46-43(28-32)49-38-21-12-19-36(30-38)45(35-18-11-20-37(29-35)48-31-47(2)41-24-9-10-25-42(41)48)44-39(33-14-5-3-6-15-33)22-13-23-40(44)34-16-7-4-8-17-34;1-48-31-49(41-26-9-8-25-40(41)48)35-20-13-22-37(30-35)50(36-21-12-19-34(29-36)44(45,46)42-27-10-11-28-47-42)43-38(32-15-4-2-5-16-32)23-14-24-39(43)33-17-6-3-7-18-33;1-46-31-47(41-26-9-8-25-40(41)46)36-21-12-19-34(29-36)44(35-20-13-22-37(30-35)48-42-27-10-11-28-45-42)43-38(32-15-4-2-5-16-32)23-14-24-39(43)33-17-6-3-7-18-33;;;;/h5-30H,1-4H3;3-28H,1-2H3;2-28H,1H3;2-28H,1H3;;;;/q4*-2;;;;.
What are the key properties of [1-[3-[[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-(2,6-diphenylphenyl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-(N-[3-[difluoro(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2,6-diphenylanilino)benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-(3-pyridin-2-yloxybenzene-2-id-1-yl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum?
[1-[3-[[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-(2,6-diphenylphenyl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-(N-[3-[difluoro(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2,6-diphenylanilino)benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-(3-pyridin-2-yloxybenzene-2-id-1-yl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum has a molecular weight of 3349.83 g/mol, XLogP of 35.65, 32 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[3-[[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-(2,6-diphenylphenyl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-(N-[3-[difluoro(pyridin-2-yl)methyl]benzene-2-id-1-yl]-2,6-diphenylanilino)benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum;[1-[3-[(2,6-diphenylphenyl)-(3-pyridin-2-yloxybenzene-2-id-1-yl)boranyl]benzene-2-id-1-yl]-3-methylbenzimidazol-2-ylidene]platinum is sourced from PubChem (CID 163553580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).