About pentakis(iridium);bis(1-methyl-2-(2-methylbenzene-6-id-1-yl)imidazole);bis(1-methyl-2-(3-methylbenzene-6-id-1-yl)imidazole);1-methyl-2-[2-methyl-4-(trifluoromethoxy)benzene-6-id-1-yl]imidazole;tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine)
pentakis(iridium);bis(1-methyl-2-(2-methylbenzene-6-id-1-yl)imidazole);bis(1-methyl-2-(3-methylbenzene-6-id-1-yl)imidazole);1-methyl-2-[2-methyl-4-(trifluoromethoxy)benzene-6-id-1-yl]imidazole;tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine) (PubChem CID 157310685) has the molecular formula C98H76F18Ir5N28O-10
and a molecular weight of 2964.93 g/mol. Its IUPAC name is pentakis(iridium);bis(1-methyl-2-(2-methylbenzene-6-id-1-yl)imidazole);bis(1-methyl-2-(3-methylbenzene-6-id-1-yl)imidazole);1-methyl-2-[2-methyl-4-(trifluoromethoxy)benzene-6-id-1-yl]imidazole;tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine).
Analyze pentakis(iridium);bis(1-methyl-2-(2-methylbenzene-6-id-1-yl)imidazole);bis(1-methyl-2-(3-methylbenzene-6-id-1-yl)imidazole);1-methyl-2-[2-methyl-4-(trifluoromethoxy)benzene-6-id-1-yl]imidazole;tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine) with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of pentakis(iridium);bis(1-methyl-2-(2-methylbenzene-6-id-1-yl)imidazole);bis(1-methyl-2-(3-methylbenzene-6-id-1-yl)imidazole);1-methyl-2-[2-methyl-4-(trifluoromethoxy)benzene-6-id-1-yl]imidazole;tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine)?
The IUPAC name of pentakis(iridium);bis(1-methyl-2-(2-methylbenzene-6-id-1-yl)imidazole);bis(1-methyl-2-(3-methylbenzene-6-id-1-yl)imidazole);1-methyl-2-[2-methyl-4-(trifluoromethoxy)benzene-6-id-1-yl]imidazole;tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine) (CID 157310685) is pentakis(iridium);bis(1-methyl-2-(2-methylbenzene-6-id-1-yl)imidazole);bis(1-methyl-2-(3-methylbenzene-6-id-1-yl)imidazole);1-methyl-2-[2-methyl-4-(trifluoromethoxy)benzene-6-id-1-yl]imidazole;tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine).
What is the SMILES notation for pentakis(iridium);bis(1-methyl-2-(2-methylbenzene-6-id-1-yl)imidazole);bis(1-methyl-2-(3-methylbenzene-6-id-1-yl)imidazole);1-methyl-2-[2-methyl-4-(trifluoromethoxy)benzene-6-id-1-yl]imidazole;tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine)?
The canonical SMILES for pentakis(iridium);bis(1-methyl-2-(2-methylbenzene-6-id-1-yl)imidazole);bis(1-methyl-2-(3-methylbenzene-6-id-1-yl)imidazole);1-methyl-2-[2-methyl-4-(trifluoromethoxy)benzene-6-id-1-yl]imidazole;tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine) is Cc1cc(OC(F)(F)F)c[c-]c1-c1nccn1C.Cc1cc[c-]c(-c2nccn2C)c1.Cc1cc[c-]c(-c2nccn2C)c1.Cc1ccc[c-]c1-c1nccn1C.Cc1ccc[c-]c1-c1nccn1C.FC(F)(F)c1cc(-c2ccccn2)[n-]n1.FC(F)(F)c1cc(-c2ccccn2)[n-]n1.FC(F)(F)c1n[n-]c(-c2ccccn2)n1.FC(F)(F)c1n[n-]c(-c2ccccn2)n1.FC(F)(F)c1n[n-]c(-c2ccccn2)n1.[Ir].[Ir].[Ir].[Ir].[Ir].
What is the InChIKey of pentakis(iridium);bis(1-methyl-2-(2-methylbenzene-6-id-1-yl)imidazole);bis(1-methyl-2-(3-methylbenzene-6-id-1-yl)imidazole);1-methyl-2-[2-methyl-4-(trifluoromethoxy)benzene-6-id-1-yl]imidazole;tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine)?
The InChIKey is GFEYCGJTBGIANA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F3N2O.4C11H11N2.2C9H5F3N3.3C8H4F3N4.5Ir/c1-8-7-9(18-12(13,14)15)3-4-10(8)11-16-5-6-17(11)2;2*1-9-4-3-5-10(8-9)11-12-6-7-13(11)2;2*1-9-5-3-4-6-10(9)11-12-7-8-13(11)2;2*10-9(11,12)8-5-7(14-15-8)6-3-1-2-4-13-6;3*9-8(10,11)7-13-6(14-15-7)5-3-1-2-4-12-5;;;;;/h3,5-7H,1-2H3;2*3-4,6-8H,1-2H3;2*3-5,7-8H,1-2H3;2*1-5H;3*1-4H;;;;;/q10*-1;;;;;.
What are the key properties of pentakis(iridium);bis(1-methyl-2-(2-methylbenzene-6-id-1-yl)imidazole);bis(1-methyl-2-(3-methylbenzene-6-id-1-yl)imidazole);1-methyl-2-[2-methyl-4-(trifluoromethoxy)benzene-6-id-1-yl]imidazole;tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine)?
pentakis(iridium);bis(1-methyl-2-(2-methylbenzene-6-id-1-yl)imidazole);bis(1-methyl-2-(3-methylbenzene-6-id-1-yl)imidazole);1-methyl-2-[2-methyl-4-(trifluoromethoxy)benzene-6-id-1-yl]imidazole;tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine) has a molecular weight of 2964.93 g/mol, XLogP of 20.65, 11 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for pentakis(iridium);bis(1-methyl-2-(2-methylbenzene-6-id-1-yl)imidazole);bis(1-methyl-2-(3-methylbenzene-6-id-1-yl)imidazole);1-methyl-2-[2-methyl-4-(trifluoromethoxy)benzene-6-id-1-yl]imidazole;tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine) is sourced from PubChem (CID 157310685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).