7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium)

C140H111Ir5N10-5 — CID 160958358

IUPAC7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium)
SMILESCC(C)(C)c1c[c-]c2c(c1)c1cc(C(C)(C)C)ccc1n1ccnc21.Cc1cc2c3ccc[c-]c3c3ncc(-c4c(-c5ccccc5)cccc4-c4ccccc4)n3c2cc1C.Cc1cc2c3ccc[c-]c3c3ncc(-c4c(C)cccc4C)n3c2cc1C.Cc1ccc2c(c1)c1ccc[c-]c1c1ncc(-c3c(C)cccc3C)n21.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1cccc2c1c1ncc(-c3c(-c4ccccc4)cccc3-c3ccccc3)n1c1ccccc21
InChIInChI=1S/C35H25N2.C33H21N2.C25H21N2.C24H19N2.C23H25N2.5Ir/c1-23-20-31-29-16-9-10-17-30(29)35-36-22-33(37(35)32(31)21-24(23)2)34-27(25-12-5-3-6-13-25)18-11-19-28(34)26-14-7-4-8-15-26;1-3-12-23(13-4-1)25-19-11-20-26(24-14-5-2-6-15-24)32(25)31-22-34-33-29-18-8-7-16-27(29)28-17-9-10-21-30(28)35(31)33;1-15-8-7-9-16(2)24(15)23-14-26-25-20-11-6-5-10-19(20)21-12-17(3)18(4)13-22(21)27(23)25;1-15-11-12-21-20(13-15)18-9-4-5-10-19(18)24-25-14-22(26(21)24)23-16(2)7-6-8-17(23)3;1-22(2,3)15-7-9-17-18(13-15)19-14-16(23(4,5)6)8-10-20(19)25-12-11-24-21(17)25;;;;;/h3-16,18-22H,1-2H3;1-17,19-22H;5-10,12-14H,1-4H3;4-9,11-14H,1-3H3;7-8,10-14H,1-6H3;;;;;/q5*-1;;;;;
InChIKeyBSISVZMPOWVRBR-UHFFFAOYSA-N
MW2894.58 g/mol
LogP35.90
Rot. Bonds8

About 7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium)

7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium) (PubChem CID 160958358) has the molecular formula C140H111Ir5N10-5 and a molecular weight of 2894.58 g/mol. Its IUPAC name is 7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium).

Molecular Properties

Compound Name7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium)
PubChem CID160958358
Molecular FormulaC140H111Ir5N10-5
Molecular Weight2894.58 g/mol
Exact Mass2896.72
IUPAC Name7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium)
SMILESCC(C)(C)c1c[c-]c2c(c1)c1cc(C(C)(C)C)ccc1n1ccnc21.Cc1cc2c3ccc[c-]c3c3ncc(-c4c(-c5ccccc5)cccc4-c4ccccc4)n3c2cc1C.Cc1cc2c3ccc[c-]c3c3ncc(-c4c(C)cccc4C)n3c2cc1C.Cc1ccc2c(c1)c1ccc[c-]c1c1ncc(-c3c(C)cccc3C)n21.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1cccc2c1c1ncc(-c3c(-c4ccccc4)cccc3-c3ccccc3)n1c1ccccc21
InChIInChI=1S/C35H25N2.C33H21N2.C25H21N2.C24H19N2.C23H25N2.5Ir/c1-23-20-31-29-16-9-10-17-30(29)35-36-22-33(37(35)32(31)21-24(23)2)34-27(25-12-5-3-6-13-25)18-11-19-28(34)26-14-7-4-8-15-26;1-3-12-23(13-4-1)25-19-11-20-26(24-14-5-2-6-15-24)32(25)31-22-34-33-29-18-8-7-16-27(29)28-17-9-10-21-30(28)35(31)33;1-15-8-7-9-16(2)24(15)23-14-26-25-20-11-6-5-10-19(20)21-12-17(3)18(4)13-22(21)27(23)25;1-15-11-12-21-20(13-15)18-9-4-5-10-19(18)24-25-14-22(26(21)24)23-16(2)7-6-8-17(23)3;1-22(2,3)15-7-9-17-18(13-15)19-14-16(23(4,5)6)8-10-20(19)25-12-11-24-21(17)25;;;;;/h3-16,18-22H,1-2H3;1-17,19-22H;5-10,12-14H,1-4H3;4-9,11-14H,1-3H3;7-8,10-14H,1-6H3;;;;;/q5*-1;;;;;
InChIKeyBSISVZMPOWVRBR-UHFFFAOYSA-N
XLogP35.90
TPSA86.50 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms155
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002894.58
LogP ≤ 535.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

Analyze 7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium) with MolForge

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Related Compounds

7-tert-butyl-5-(4-tert-butylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium);7-[2,4,6-tri(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-ide
CID 157438193
7,10-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium);7-methyl-5-(4-methylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;7-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide
CID 158846855
carbanide;3-(2,6-diphenyl-4-propan-2-ylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;iridium;yttrium
CID 58162748
CID 158903542
CID 158903542
iridium;7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide
CID 58943914
2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;iridium
CID 58162931
3-(2,6-dimethylphenyl)-7-(2,2-dimethylpropyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;tris(iridium);2-(3-phenylbenzene-6-id-1-yl)pyridine
CID 160881462
bromozinc(1+);7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide
CID 58163088
7-tert-butyl-5-(4-tert-butylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;carbanide;7-cyclohexyl-12H-imidazo[1,2-f]phenanthridin-12-ide;7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;5,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;hexakis(iridium(3+));7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;7-[2,4,6-tri(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-ide
CID 158123757
6,7-bis(2,2-dimethylpropyl)-3-[2,4,6-tri(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-ide;carbanide;3-(2,6-dimethylphenyl)-6,7-bis(2,2-dimethylpropyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-(2,2-dimethylpropyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6,7-dimethyl-3-[4-phenyl-2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-ide;tetrakis(iridium);tetrakis(yttrium)
CID 157352487
bis(2-(4H-1-benzofuran-4-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole);2-(6H-1-benzofuran-6-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole;10-benzyl-6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethyl-4-phenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;10-(2,6-dimethylphenyl)-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;octakis(iridium);7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide
CID 159331384
CID 158332744
CID 158332744

Frequently Asked Questions

What is the IUPAC name of 7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium)?
The IUPAC name of 7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium) (CID 160958358) is 7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium).
What is the SMILES notation for 7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium)?
The canonical SMILES for 7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium) is CC(C)(C)c1c[c-]c2c(c1)c1cc(C(C)(C)C)ccc1n1ccnc21.Cc1cc2c3ccc[c-]c3c3ncc(-c4c(-c5ccccc5)cccc4-c4ccccc4)n3c2cc1C.Cc1cc2c3ccc[c-]c3c3ncc(-c4c(C)cccc4C)n3c2cc1C.Cc1ccc2c(c1)c1ccc[c-]c1c1ncc(-c3c(C)cccc3C)n21.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1cccc2c1c1ncc(-c3c(-c4ccccc4)cccc3-c3ccccc3)n1c1ccccc21.
What is the InChIKey of 7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium)?
The InChIKey is BSISVZMPOWVRBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H25N2.C33H21N2.C25H21N2.C24H19N2.C23H25N2.5Ir/c1-23-20-31-29-16-9-10-17-30(29)35-36-22-33(37(35)32(31)21-24(23)2)34-27(25-12-5-3-6-13-25)18-11-19-28(34)26-14-7-4-8-15-26;1-3-12-23(13-4-1)25-19-11-20-26(24-14-5-2-6-15-24)32(25)31-22-34-33-29-18-8-7-16-27(29)28-17-9-10-21-30(28)35(31)33;1-15-8-7-9-16(2)24(15)23-14-26-25-20-11-6-5-10-19(20)21-12-17(3)18(4)13-22(21)27(23)25;1-15-11-12-21-20(13-15)18-9-4-5-10-19(18)24-25-14-22(26(21)24)23-16(2)7-6-8-17(23)3;1-22(2,3)15-7-9-17-18(13-15)19-14-16(23(4,5)6)8-10-20(19)25-12-11-24-21(17)25;;;;;/h3-16,18-22H,1-2H3;1-17,19-22H;5-10,12-14H,1-4H3;4-9,11-14H,1-3H3;7-8,10-14H,1-6H3;;;;;/q5*-1;;;;;.
What are the key properties of 7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium)?
7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium) has a molecular weight of 2894.58 g/mol, XLogP of 35.90, 8 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 7,10-ditert-butyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-7-methyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-diphenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;pentakis(iridium) is sourced from PubChem (CID 160958358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).