bis(10H-benzo[h]quinolin-10-ide);2-(3H-1-benzothiophen-3-id-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;tetrakis(4-hydroxypent-3-en-2-one);pentakis(iridium);10-methylbenzo[h]quinoline;2-(2-methylphenyl)pyridine;2-phenyl-1,3-benzothiazole;pentakis(2-phenylpyridine);platinum(2+);rhodium(2+)

C164H132F2Ir5N12O8PtRhS2-6 — CID 162130664

About bis(10H-benzo[h]quinolin-10-ide);2-(3H-1-benzothiophen-3-id-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;tetrakis(4-hydroxypent-3-en-2-one);pentakis(iridium);10-methylbenzo[h]quinoline;2-(2-methylphenyl)pyridine;2-phenyl-1,3-benzothiazole;pentakis(2-phenylpyridine);platinum(2+);rhodium(2+)

bis(10H-benzo[h]quinolin-10-ide);2-(3H-1-benzothiophen-3-id-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;tetrakis(4-hydroxypent-3-en-2-one);pentakis(iridium);10-methylbenzo[h]quinoline;2-(2-methylphenyl)pyridine;2-phenyl-1,3-benzothiazole;pentakis(2-phenylpyridine);platinum(2+);rhodium(2+) (PubChem CID 162130664) has the molecular formula C164H132F2Ir5N12O8PtRhS2-6 and a molecular weight of 3760.13 g/mol. Its IUPAC name is bis(10H-benzo[h]quinolin-10-ide);2-(3H-1-benzothiophen-3-id-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;tetrakis(4-hydroxypent-3-en-2-one);pentakis(iridium);10-methylbenzo[h]quinoline;2-(2-methylphenyl)pyridine;2-phenyl-1,3-benzothiazole;pentakis(2-phenylpyridine);platinum(2+);rhodium(2+).

Molecular Properties

• Compound Name: bis(10H-benzo[h]quinolin-10-ide);2-(3H-1-benzothiophen-3-id-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;tetrakis(4-hydroxypent-3-en-2-one);pentakis(iridium);10-methylbenzo[h]quinoline;2-(2-methylphenyl)pyridine;2-phenyl-1,3-benzothiazole;pentakis(2-phenylpyridine);platinum(2+);rhodium(2+)
• PubChem CID: 162130664
• Molecular Formula: C164H132F2Ir5N12O8PtRhS2-6
• Molecular Weight: 3760.13 g/mol
• Exact Mass: 3761.66
• IUPAC Name: bis(10H-benzo[h]quinolin-10-ide);2-(3H-1-benzothiophen-3-id-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;tetrakis(4-hydroxypent-3-en-2-one);pentakis(iridium);10-methylbenzo[h]quinoline;2-(2-methylphenyl)pyridine;2-phenyl-1,3-benzothiazole;pentakis(2-phenylpyridine);platinum(2+);rhodium(2+)
• SMILES: CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.Cc1cccc2ccc3cccnc3c12.Cc1ccccc1-c1ccccn1.Fc1c[c-]c(-c2ccccn2)c(F)c1.[Ir].[Ir].[Ir].[Ir].[Ir].[Pt+2].[Rh+2].[c-]1c(-c2ccccn2)sc2ccccc12.[c-]1cccc2ccc3cccnc3c12.[c-]1cccc2ccc3cccnc3c12.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1nc2ccccc2s1
• InChI: InChI=1S/C14H11N.2C13H8NS.2C13H8N.C12H11N.C11H6F2N.5C11H8N.4C5H8O2.5Ir.Pt.Rh/c1-10-4-2-5-11-7-8-12-6-3-9-15-14(12)13(10)11;1-2-7-12-10(5-1)9-13(15-12)11-6-3-4-8-14-11;1-2-6-10(7-3-1)13-14-11-8-4-5-9-12(11)15-13;2*1-2-6-12-10(4-1)7-8-11-5-3-9-14-13(11)12;1-10-6-2-3-7-11(10)12-8-4-5-9-13-12;12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;5*1-2-6-10(7-3-1)11-8-4-5-9-12-11;4*1-4(6)3-5(2)7;;;;;;;/h2-9H,1H3;1-8H;1-6,8-9H;2*1-5,7-9H;2-9H,1H3;1-4,6-7H;5*1-6,8-9H;4*3,6H,1-2H3;;;;;;;/q;4*-1;;6*-1;;;;;;;;;;2*+2
• InChIKey: QQOCRZAYNSLBQU-UHFFFAOYSA-N
• XLogP: 40.36
• TPSA: 303.88 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 22
• Rotatable Bonds: 13
• Heavy Atoms: 195
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3760.13
LogP ≤ 5	40.36
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(10H-benzo[h]quinolin-10-ide);2-(3H-1-benzothiophen-3-id-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;tetrakis(4-hydroxypent-3-en-2-one);pentakis(iridium);10-methylbenzo[h]quinoline;2-(2-methylphenyl)pyridine;2-phenyl-1,3-benzothiazole;pentakis(2-phenylpyridine);platinum(2+);rhodium(2+)?

The IUPAC name of bis(10H-benzo[h]quinolin-10-ide);2-(3H-1-benzothiophen-3-id-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;tetrakis(4-hydroxypent-3-en-2-one);pentakis(iridium);10-methylbenzo[h]quinoline;2-(2-methylphenyl)pyridine;2-phenyl-1,3-benzothiazole;pentakis(2-phenylpyridine);platinum(2+);rhodium(2+) (CID 162130664) is bis(10H-benzo[h]quinolin-10-ide);2-(3H-1-benzothiophen-3-id-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;tetrakis(4-hydroxypent-3-en-2-one);pentakis(iridium);10-methylbenzo[h]quinoline;2-(2-methylphenyl)pyridine;2-phenyl-1,3-benzothiazole;pentakis(2-phenylpyridine);platinum(2+);rhodium(2+).

What is the SMILES notation for bis(10H-benzo[h]quinolin-10-ide);2-(3H-1-benzothiophen-3-id-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;tetrakis(4-hydroxypent-3-en-2-one);pentakis(iridium);10-methylbenzo[h]quinoline;2-(2-methylphenyl)pyridine;2-phenyl-1,3-benzothiazole;pentakis(2-phenylpyridine);platinum(2+);rhodium(2+)?

The canonical SMILES for bis(10H-benzo[h]quinolin-10-ide);2-(3H-1-benzothiophen-3-id-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;tetrakis(4-hydroxypent-3-en-2-one);pentakis(iridium);10-methylbenzo[h]quinoline;2-(2-methylphenyl)pyridine;2-phenyl-1,3-benzothiazole;pentakis(2-phenylpyridine);platinum(2+);rhodium(2+) is CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.Cc1cccc2ccc3cccnc3c12.Cc1ccccc1-c1ccccn1.Fc1c[c-]c(-c2ccccn2)c(F)c1.[Ir].[Ir].[Ir].[Ir].[Ir].[Pt+2].[Rh+2].[c-]1c(-c2ccccn2)sc2ccccc12.[c-]1cccc2ccc3cccnc3c12.[c-]1cccc2ccc3cccnc3c12.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1nc2ccccc2s1.

What is the InChIKey of bis(10H-benzo[h]quinolin-10-ide);2-(3H-1-benzothiophen-3-id-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;tetrakis(4-hydroxypent-3-en-2-one);pentakis(iridium);10-methylbenzo[h]quinoline;2-(2-methylphenyl)pyridine;2-phenyl-1,3-benzothiazole;pentakis(2-phenylpyridine);platinum(2+);rhodium(2+)?

The InChIKey is QQOCRZAYNSLBQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N.2C13H8NS.2C13H8N.C12H11N.C11H6F2N.5C11H8N.4C5H8O2.5Ir.Pt.Rh/c1-10-4-2-5-11-7-8-12-6-3-9-15-14(12)13(10)11;1-2-7-12-10(5-1)9-13(15-12)11-6-3-4-8-14-11;1-2-6-10(7-3-1)13-14-11-8-4-5-9-12(11)15-13;2*1-2-6-12-10(4-1)7-8-11-5-3-9-14-13(11)12;1-10-6-2-3-7-11(10)12-8-4-5-9-13-12;12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;5*1-2-6-10(7-3-1)11-8-4-5-9-12-11;4*1-4(6)3-5(2)7;;;;;;;/h2-9H,1H3;1-8H;1-6,8-9H;2*1-5,7-9H;2-9H,1H3;1-4,6-7H;5*1-6,8-9H;4*3,6H,1-2H3;;;;;;;/q;4*-1;;6*-1;;;;;;;;;;2*+2.

What are the key properties of bis(10H-benzo[h]quinolin-10-ide);2-(3H-1-benzothiophen-3-id-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;tetrakis(4-hydroxypent-3-en-2-one);pentakis(iridium);10-methylbenzo[h]quinoline;2-(2-methylphenyl)pyridine;2-phenyl-1,3-benzothiazole;pentakis(2-phenylpyridine);platinum(2+);rhodium(2+)?

bis(10H-benzo[h]quinolin-10-ide);2-(3H-1-benzothiophen-3-id-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;tetrakis(4-hydroxypent-3-en-2-one);pentakis(iridium);10-methylbenzo[h]quinoline;2-(2-methylphenyl)pyridine;2-phenyl-1,3-benzothiazole;pentakis(2-phenylpyridine);platinum(2+);rhodium(2+) has a molecular weight of 3760.13 g/mol, XLogP of 40.36, 13 rotatable bonds, 4 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for bis(10H-benzo[h]quinolin-10-ide);2-(3H-1-benzothiophen-3-id-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;tetrakis(4-hydroxypent-3-en-2-one);pentakis(iridium);10-methylbenzo[h]quinoline;2-(2-methylphenyl)pyridine;2-phenyl-1,3-benzothiazole;pentakis(2-phenylpyridine);platinum(2+);rhodium(2+) is sourced from PubChem (CID 162130664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).