pentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane

C221H165Ge5Ir5N15O7S-10 — CID 163519675

IUPACpentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane
SMILESC[Ge](C)(C)c1ccc(-c2[c-]cc3ccccc3c2)nc1.C[Ge](C)(C)c1ccc(-c2[c-]cc3oc4ccccc4c3c2)nc1.C[Ge](C)(C)c1ccc(-c2[c-]ccc3c2oc2ccccc23)nc1.C[Ge](C)(C)c1ccc(-c2[c-]ccc3c2sc2ccccc23)nc1.C[Ge](C)(C)c1ccc(-c2[c-]ccc3ccccc23)nc1.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1.[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1.[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1.[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1.[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1
InChIInChI=1S/5C25H15N2O.2C20H18GeNO.C20H18GeNS.2C18H18GeN.5Ir/c5*1-2-9-17(10-3-1)27-22-15-6-5-14-21(22)26-25(27)20-13-8-12-19-18-11-4-7-16-23(18)28-24(19)20;1-21(2,3)14-11-12-18(22-13-14)17-9-6-8-16-15-7-4-5-10-19(15)23-20(16)17;1-21(2,3)15-9-10-18(22-13-15)14-8-11-20-17(12-14)16-6-4-5-7-19(16)23-20;1-21(2,3)14-11-12-18(22-13-14)17-9-6-8-16-15-7-4-5-10-19(15)23-20(16)17;1-19(2,3)15-11-12-18(20-13-15)17-10-6-8-14-7-4-5-9-16(14)17;1-19(2,3)17-10-11-18(20-13-17)16-9-8-14-6-4-5-7-15(14)12-16;;;;;/h5*1-12,14-16H;4-8,10-13H,1-3H3;4-7,9-13H,1-3H3;4-8,10-13H,1-3H3;4-9,11-13H,1-3H3;4-8,10-13H,1-3H3;;;;;/q10*-1;;;;;
InChIKeyJRTGOLATQYQUAX-UHFFFAOYSA-N
MW4499.05 g/mol
LogP55.89
Rot. Bonds20

About pentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane

pentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane (PubChem CID 163519675) has the molecular formula C221H165Ge5Ir5N15O7S-10 and a molecular weight of 4499.05 g/mol. Its IUPAC name is pentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane.

Molecular Properties

Compound Namepentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane
PubChem CID163519675
Molecular FormulaC221H165Ge5Ir5N15O7S-10
Molecular Weight4499.05 g/mol
Exact Mass4506.70
IUPAC Namepentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane
SMILESC[Ge](C)(C)c1ccc(-c2[c-]cc3ccccc3c2)nc1.C[Ge](C)(C)c1ccc(-c2[c-]cc3oc4ccccc4c3c2)nc1.C[Ge](C)(C)c1ccc(-c2[c-]ccc3c2oc2ccccc23)nc1.C[Ge](C)(C)c1ccc(-c2[c-]ccc3c2sc2ccccc23)nc1.C[Ge](C)(C)c1ccc(-c2[c-]ccc3ccccc23)nc1.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1.[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1.[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1.[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1.[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1
InChIInChI=1S/5C25H15N2O.2C20H18GeNO.C20H18GeNS.2C18H18GeN.5Ir/c5*1-2-9-17(10-3-1)27-22-15-6-5-14-21(22)26-25(27)20-13-8-12-19-18-11-4-7-16-23(18)28-24(19)20;1-21(2,3)14-11-12-18(22-13-14)17-9-6-8-16-15-7-4-5-10-19(15)23-20(16)17;1-21(2,3)15-9-10-18(22-13-15)14-8-11-20-17(12-14)16-6-4-5-7-19(16)23-20;1-21(2,3)14-11-12-18(22-13-14)17-9-6-8-16-15-7-4-5-10-19(15)23-20(16)17;1-19(2,3)15-11-12-18(20-13-15)17-10-6-8-14-7-4-5-9-16(14)17;1-19(2,3)17-10-11-18(20-13-17)16-9-8-14-6-4-5-7-15(14)12-16;;;;;/h5*1-12,14-16H;4-8,10-13H,1-3H3;4-7,9-13H,1-3H3;4-8,10-13H,1-3H3;4-9,11-13H,1-3H3;4-8,10-13H,1-3H3;;;;;/q10*-1;;;;;
InChIKeyJRTGOLATQYQUAX-UHFFFAOYSA-N
XLogP55.89
TPSA245.53 Ų
H-Bond Donors
H-Bond Acceptors23
Rotatable Bonds20
Heavy Atoms254
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004499.05
LogP ≤ 555.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

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

Analyze pentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane with MolForge

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Frequently Asked Questions

What is the IUPAC name of pentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane?
The IUPAC name of pentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane (CID 163519675) is pentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane.
What is the SMILES notation for pentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane?
The canonical SMILES for pentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane is C[Ge](C)(C)c1ccc(-c2[c-]cc3ccccc3c2)nc1.C[Ge](C)(C)c1ccc(-c2[c-]cc3oc4ccccc4c3c2)nc1.C[Ge](C)(C)c1ccc(-c2[c-]ccc3c2oc2ccccc23)nc1.C[Ge](C)(C)c1ccc(-c2[c-]ccc3c2sc2ccccc23)nc1.C[Ge](C)(C)c1ccc(-c2[c-]ccc3ccccc23)nc1.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1.[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1.[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1.[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1.[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1.
What is the InChIKey of pentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane?
The InChIKey is JRTGOLATQYQUAX-UHFFFAOYSA-N. The full InChI is InChI=1S/5C25H15N2O.2C20H18GeNO.C20H18GeNS.2C18H18GeN.5Ir/c5*1-2-9-17(10-3-1)27-22-15-6-5-14-21(22)26-25(27)20-13-8-12-19-18-11-4-7-16-23(18)28-24(19)20;1-21(2,3)14-11-12-18(22-13-14)17-9-6-8-16-15-7-4-5-10-19(15)23-20(16)17;1-21(2,3)15-9-10-18(22-13-15)14-8-11-20-17(12-14)16-6-4-5-7-19(16)23-20;1-21(2,3)14-11-12-18(22-13-14)17-9-6-8-16-15-7-4-5-10-19(15)23-20(16)17;1-19(2,3)15-11-12-18(20-13-15)17-10-6-8-14-7-4-5-9-16(14)17;1-19(2,3)17-10-11-18(20-13-17)16-9-8-14-6-4-5-7-15(14)12-16;;;;;/h5*1-12,14-16H;4-8,10-13H,1-3H3;4-7,9-13H,1-3H3;4-8,10-13H,1-3H3;4-9,11-13H,1-3H3;4-8,10-13H,1-3H3;;;;;/q10*-1;;;;;.
What are the key properties of pentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane?
pentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane has a molecular weight of 4499.05 g/mol, XLogP of 55.89, 20 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for pentakis(2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole);[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzofuran-3-id-4-yl)-3-pyridinyl]-trimethylgermane;[6-(3H-dibenzothiophen-3-id-4-yl)-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane;trimethyl-[6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]germane is sourced from PubChem (CID 163519675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).