1-benzyl-4H-phenanthro[9,10-d]imidazol-4-ide;7,9-bis(2,6-dimethylphenyl)-2,5-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;2-(2,6-dimethylphenyl)-1-methyl-4H-phenanthro[9,10-d]imidazol-4-ide;11-(2,6-dimethylphenyl)-2-methyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide;2,11-dimethyl-6-phenyl-4H-phenanthro[9,10-d][1,3]thiazol-4-ide;2-(2,6-dimethylphenyl)-3,4,7-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide;octakis(iridium);3,5,6-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide-2-carbonitrile;2,9,11-trimethyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide

C189H148Ir8N14O2S-8 — CID 157446841

About 1-benzyl-4H-phenanthro[9,10-d]imidazol-4-ide;7,9-bis(2,6-dimethylphenyl)-2,5-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;2-(2,6-dimethylphenyl)-1-methyl-4H-phenanthro[9,10-d]imidazol-4-ide;11-(2,6-dimethylphenyl)-2-methyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide;2,11-dimethyl-6-phenyl-4H-phenanthro[9,10-d][1,3]thiazol-4-ide;2-(2,6-dimethylphenyl)-3,4,7-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide;octakis(iridium);3,5,6-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide-2-carbonitrile;2,9,11-trimethyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide

1-benzyl-4H-phenanthro[9,10-d]imidazol-4-ide;7,9-bis(2,6-dimethylphenyl)-2,5-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;2-(2,6-dimethylphenyl)-1-methyl-4H-phenanthro[9,10-d]imidazol-4-ide;11-(2,6-dimethylphenyl)-2-methyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide;2,11-dimethyl-6-phenyl-4H-phenanthro[9,10-d][1,3]thiazol-4-ide;2-(2,6-dimethylphenyl)-3,4,7-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide;octakis(iridium);3,5,6-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide-2-carbonitrile;2,9,11-trimethyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide (PubChem CID 157446841) has the molecular formula C189H148Ir8N14O2S-8 and a molecular weight of 4217.16 g/mol. Its IUPAC name is 1-benzyl-4H-phenanthro[9,10-d]imidazol-4-ide;7,9-bis(2,6-dimethylphenyl)-2,5-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;2-(2,6-dimethylphenyl)-1-methyl-4H-phenanthro[9,10-d]imidazol-4-ide;11-(2,6-dimethylphenyl)-2-methyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide;2,11-dimethyl-6-phenyl-4H-phenanthro[9,10-d][1,3]thiazol-4-ide;2-(2,6-dimethylphenyl)-3,4,7-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide;octakis(iridium);3,5,6-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide-2-carbonitrile;2,9,11-trimethyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide.

Molecular Properties

• Compound Name: 1-benzyl-4H-phenanthro[9,10-d]imidazol-4-ide;7,9-bis(2,6-dimethylphenyl)-2,5-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;2-(2,6-dimethylphenyl)-1-methyl-4H-phenanthro[9,10-d]imidazol-4-ide;11-(2,6-dimethylphenyl)-2-methyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide;2,11-dimethyl-6-phenyl-4H-phenanthro[9,10-d][1,3]thiazol-4-ide;2-(2,6-dimethylphenyl)-3,4,7-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide;octakis(iridium);3,5,6-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide-2-carbonitrile;2,9,11-trimethyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide
• PubChem CID: 157446841
• Molecular Formula: C189H148Ir8N14O2S-8
• Molecular Weight: 4217.16 g/mol
• Exact Mass: 4220.87
• IUPAC Name: 1-benzyl-4H-phenanthro[9,10-d]imidazol-4-ide;7,9-bis(2,6-dimethylphenyl)-2,5-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;2-(2,6-dimethylphenyl)-1-methyl-4H-phenanthro[9,10-d]imidazol-4-ide;11-(2,6-dimethylphenyl)-2-methyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide;2,11-dimethyl-6-phenyl-4H-phenanthro[9,10-d][1,3]thiazol-4-ide;2-(2,6-dimethylphenyl)-3,4,7-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide;octakis(iridium);3,5,6-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide-2-carbonitrile;2,9,11-trimethyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide
• SMILES: Cc1cc(C)c2c(c1)c1ccc[c-]c1c1nc(C)oc12.Cc1cc2c3ccc[c-]c3c3nc(C#N)n(C)c3c2cc1C.Cc1cccc(C)c1-c1nc2c3[c-]cccc3c3c(C)ccc(C)c3c2n1C.Cc1cccc(C)c1-c1nc2c3[c-]cccc3c3ccccc3c2n1C.Cc1cn2c(n1)c1[c-]ccc(-c3c(C)cccc3C)c1c1cc(-c3c(C)cccc3C)cc(C)c12.Cc1nc2c3[c-]cc(-c4ccccc4)cc3c3cccc(C)c3c2s1.Cc1nc2c3[c-]cccc3c3cccc(-c4c(C)cccc4C)c3c2o1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1cccc2c1c1ncn(Cc3ccccc3)c1c1ccccc21
• InChI: InChI=1S/C33H29N2.C26H23N2.C24H19N2.C24H18NO.C23H16NS.C22H15N2.C19H14N3.C18H14NO.8Ir/c1-19-10-7-11-20(2)29(19)25-16-23(5)32-28(17-25)31-26(30-21(3)12-8-13-22(30)4)14-9-15-27(31)33-34-24(6)18-35(32)33;1-15-9-8-10-16(2)21(15)26-27-24-20-12-7-6-11-19(20)22-17(3)13-14-18(4)23(22)25(24)28(26)5;1-15-9-8-10-16(2)21(15)24-25-22-19-13-6-4-11-17(19)18-12-5-7-14-20(18)23(22)26(24)3;1-14-8-6-9-15(2)21(14)20-13-7-12-18-17-10-4-5-11-19(17)23-24(22(18)20)26-16(3)25-23;1-14-7-6-10-18-20-13-17(16-8-4-3-5-9-16)11-12-19(20)22-23(21(14)18)25-15(2)24-22;1-2-8-16(9-3-1)14-24-15-23-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)22(21)24;1-11-8-15-13-6-4-5-7-14(13)18-19(16(15)9-12(11)2)22(3)17(10-20)21-18;1-10-8-11(2)16-15(9-10)13-6-4-5-7-14(13)17-18(16)20-12(3)19-17;;;;;;;;/h7-14,16-18H,1-6H3;6-11,13-14H,1-5H3;4-12,14H,1-3H3;4-10,12-13H,1-3H3;3-11,13H,1-2H3;1-11,13,15H,14H2;4-6,8-9H,1-3H3;4-6,8-9H,1-3H3;;;;;;;;/q8*-1
• InChIKey: ASDKZAWRMSZGCD-UHFFFAOYSA-N
• XLogP: 48.58
• TPSA: 177.32 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 8
• Heavy Atoms: 214
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4217.16
LogP ≤ 5	48.58
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-4H-phenanthro[9,10-d]imidazol-4-ide;7,9-bis(2,6-dimethylphenyl)-2,5-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;2-(2,6-dimethylphenyl)-1-methyl-4H-phenanthro[9,10-d]imidazol-4-ide;11-(2,6-dimethylphenyl)-2-methyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide;2,11-dimethyl-6-phenyl-4H-phenanthro[9,10-d][1,3]thiazol-4-ide;2-(2,6-dimethylphenyl)-3,4,7-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide;octakis(iridium);3,5,6-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide-2-carbonitrile;2,9,11-trimethyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide?

The IUPAC name of 1-benzyl-4H-phenanthro[9,10-d]imidazol-4-ide;7,9-bis(2,6-dimethylphenyl)-2,5-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;2-(2,6-dimethylphenyl)-1-methyl-4H-phenanthro[9,10-d]imidazol-4-ide;11-(2,6-dimethylphenyl)-2-methyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide;2,11-dimethyl-6-phenyl-4H-phenanthro[9,10-d][1,3]thiazol-4-ide;2-(2,6-dimethylphenyl)-3,4,7-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide;octakis(iridium);3,5,6-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide-2-carbonitrile;2,9,11-trimethyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide (CID 157446841) is 1-benzyl-4H-phenanthro[9,10-d]imidazol-4-ide;7,9-bis(2,6-dimethylphenyl)-2,5-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;2-(2,6-dimethylphenyl)-1-methyl-4H-phenanthro[9,10-d]imidazol-4-ide;11-(2,6-dimethylphenyl)-2-methyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide;2,11-dimethyl-6-phenyl-4H-phenanthro[9,10-d][1,3]thiazol-4-ide;2-(2,6-dimethylphenyl)-3,4,7-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide;octakis(iridium);3,5,6-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide-2-carbonitrile;2,9,11-trimethyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide.

What is the SMILES notation for 1-benzyl-4H-phenanthro[9,10-d]imidazol-4-ide;7,9-bis(2,6-dimethylphenyl)-2,5-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;2-(2,6-dimethylphenyl)-1-methyl-4H-phenanthro[9,10-d]imidazol-4-ide;11-(2,6-dimethylphenyl)-2-methyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide;2,11-dimethyl-6-phenyl-4H-phenanthro[9,10-d][1,3]thiazol-4-ide;2-(2,6-dimethylphenyl)-3,4,7-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide;octakis(iridium);3,5,6-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide-2-carbonitrile;2,9,11-trimethyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide?

The canonical SMILES for 1-benzyl-4H-phenanthro[9,10-d]imidazol-4-ide;7,9-bis(2,6-dimethylphenyl)-2,5-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;2-(2,6-dimethylphenyl)-1-methyl-4H-phenanthro[9,10-d]imidazol-4-ide;11-(2,6-dimethylphenyl)-2-methyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide;2,11-dimethyl-6-phenyl-4H-phenanthro[9,10-d][1,3]thiazol-4-ide;2-(2,6-dimethylphenyl)-3,4,7-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide;octakis(iridium);3,5,6-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide-2-carbonitrile;2,9,11-trimethyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide is Cc1cc(C)c2c(c1)c1ccc[c-]c1c1nc(C)oc12.Cc1cc2c3ccc[c-]c3c3nc(C#N)n(C)c3c2cc1C.Cc1cccc(C)c1-c1nc2c3[c-]cccc3c3c(C)ccc(C)c3c2n1C.Cc1cccc(C)c1-c1nc2c3[c-]cccc3c3ccccc3c2n1C.Cc1cn2c(n1)c1[c-]ccc(-c3c(C)cccc3C)c1c1cc(-c3c(C)cccc3C)cc(C)c12.Cc1nc2c3[c-]cc(-c4ccccc4)cc3c3cccc(C)c3c2s1.Cc1nc2c3[c-]cccc3c3cccc(-c4c(C)cccc4C)c3c2o1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1cccc2c1c1ncn(Cc3ccccc3)c1c1ccccc21.

What is the InChIKey of 1-benzyl-4H-phenanthro[9,10-d]imidazol-4-ide;7,9-bis(2,6-dimethylphenyl)-2,5-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;2-(2,6-dimethylphenyl)-1-methyl-4H-phenanthro[9,10-d]imidazol-4-ide;11-(2,6-dimethylphenyl)-2-methyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide;2,11-dimethyl-6-phenyl-4H-phenanthro[9,10-d][1,3]thiazol-4-ide;2-(2,6-dimethylphenyl)-3,4,7-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide;octakis(iridium);3,5,6-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide-2-carbonitrile;2,9,11-trimethyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide?

The InChIKey is ASDKZAWRMSZGCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H29N2.C26H23N2.C24H19N2.C24H18NO.C23H16NS.C22H15N2.C19H14N3.C18H14NO.8Ir/c1-19-10-7-11-20(2)29(19)25-16-23(5)32-28(17-25)31-26(30-21(3)12-8-13-22(30)4)14-9-15-27(31)33-34-24(6)18-35(32)33;1-15-9-8-10-16(2)21(15)26-27-24-20-12-7-6-11-19(20)22-17(3)13-14-18(4)23(22)25(24)28(26)5;1-15-9-8-10-16(2)21(15)24-25-22-19-13-6-4-11-17(19)18-12-5-7-14-20(18)23(22)26(24)3;1-14-8-6-9-15(2)21(14)20-13-7-12-18-17-10-4-5-11-19(17)23-24(22(18)20)26-16(3)25-23;1-14-7-6-10-18-20-13-17(16-8-4-3-5-9-16)11-12-19(20)22-23(21(14)18)25-15(2)24-22;1-2-8-16(9-3-1)14-24-15-23-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)22(21)24;1-11-8-15-13-6-4-5-7-14(13)18-19(16(15)9-12(11)2)22(3)17(10-20)21-18;1-10-8-11(2)16-15(9-10)13-6-4-5-7-14(13)17-18(16)20-12(3)19-17;;;;;;;;/h7-14,16-18H,1-6H3;6-11,13-14H,1-5H3;4-12,14H,1-3H3;4-10,12-13H,1-3H3;3-11,13H,1-2H3;1-11,13,15H,14H2;4-6,8-9H,1-3H3;4-6,8-9H,1-3H3;;;;;;;;/q8*-1;;;;;;;;.

What are the key properties of 1-benzyl-4H-phenanthro[9,10-d]imidazol-4-ide;7,9-bis(2,6-dimethylphenyl)-2,5-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;2-(2,6-dimethylphenyl)-1-methyl-4H-phenanthro[9,10-d]imidazol-4-ide;11-(2,6-dimethylphenyl)-2-methyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide;2,11-dimethyl-6-phenyl-4H-phenanthro[9,10-d][1,3]thiazol-4-ide;2-(2,6-dimethylphenyl)-3,4,7-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide;octakis(iridium);3,5,6-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide-2-carbonitrile;2,9,11-trimethyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide?

1-benzyl-4H-phenanthro[9,10-d]imidazol-4-ide;7,9-bis(2,6-dimethylphenyl)-2,5-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;2-(2,6-dimethylphenyl)-1-methyl-4H-phenanthro[9,10-d]imidazol-4-ide;11-(2,6-dimethylphenyl)-2-methyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide;2,11-dimethyl-6-phenyl-4H-phenanthro[9,10-d][1,3]thiazol-4-ide;2-(2,6-dimethylphenyl)-3,4,7-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide;octakis(iridium);3,5,6-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide-2-carbonitrile;2,9,11-trimethyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide has a molecular weight of 4217.16 g/mol, XLogP of 48.58, 8 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 1-benzyl-4H-phenanthro[9,10-d]imidazol-4-ide;7,9-bis(2,6-dimethylphenyl)-2,5-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;2-(2,6-dimethylphenyl)-1-methyl-4H-phenanthro[9,10-d]imidazol-4-ide;11-(2,6-dimethylphenyl)-2-methyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide;2,11-dimethyl-6-phenyl-4H-phenanthro[9,10-d][1,3]thiazol-4-ide;2-(2,6-dimethylphenyl)-3,4,7-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide;octakis(iridium);3,5,6-trimethyl-11H-phenanthro[9,10-d]imidazol-11-ide-2-carbonitrile;2,9,11-trimethyl-4H-phenanthro[9,10-d][1,3]oxazol-4-ide is sourced from PubChem (CID 157446841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).