bis(2-bromo-6-(3-phenylbenzene-2-id-1-yl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(3-phenylbenzene-2-id-1-yl)pyridine);2-fluoro-6-(3-phenylbenzene-2-id-1-yl)pyridine;2-[3-(4-methylbenzene-6-id-1-yl)benzene-2-id-1-yl]-5-(trifluoromethyl)pyridine;tris(nickel(3+))

C140H86Br2Cl5F4N9Ni6-6 — CID 158160270

About bis(2-bromo-6-(3-phenylbenzene-2-id-1-yl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(3-phenylbenzene-2-id-1-yl)pyridine);2-fluoro-6-(3-phenylbenzene-2-id-1-yl)pyridine;2-[3-(4-methylbenzene-6-id-1-yl)benzene-2-id-1-yl]-5-(trifluoromethyl)pyridine;tris(nickel(3+))

bis(2-bromo-6-(3-phenylbenzene-2-id-1-yl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(3-phenylbenzene-2-id-1-yl)pyridine);2-fluoro-6-(3-phenylbenzene-2-id-1-yl)pyridine;2-[3-(4-methylbenzene-6-id-1-yl)benzene-2-id-1-yl]-5-(trifluoromethyl)pyridine;tris(nickel(3+)) (PubChem CID 158160270) has the molecular formula C140H86Br2Cl5F4N9Ni6-6 and a molecular weight of 2659.51 g/mol. Its IUPAC name is bis(2-bromo-6-(3-phenylbenzene-2-id-1-yl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(3-phenylbenzene-2-id-1-yl)pyridine);2-fluoro-6-(3-phenylbenzene-2-id-1-yl)pyridine;2-[3-(4-methylbenzene-6-id-1-yl)benzene-2-id-1-yl]-5-(trifluoromethyl)pyridine;tris(nickel(3+)).

Molecular Properties

• Compound Name: bis(2-bromo-6-(3-phenylbenzene-2-id-1-yl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(3-phenylbenzene-2-id-1-yl)pyridine);2-fluoro-6-(3-phenylbenzene-2-id-1-yl)pyridine;2-[3-(4-methylbenzene-6-id-1-yl)benzene-2-id-1-yl]-5-(trifluoromethyl)pyridine;tris(nickel(3+))
• PubChem CID: 158160270
• Molecular Formula: C140H86Br2Cl5F4N9Ni6-6
• Molecular Weight: 2659.51 g/mol
• Exact Mass: 2648.99
• IUPAC Name: bis(2-bromo-6-(3-phenylbenzene-2-id-1-yl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(3-phenylbenzene-2-id-1-yl)pyridine);2-fluoro-6-(3-phenylbenzene-2-id-1-yl)pyridine;2-[3-(4-methylbenzene-6-id-1-yl)benzene-2-id-1-yl]-5-(trifluoromethyl)pyridine;tris(nickel(3+))
• SMILES: Brc1cccc(-c2[c-]c(-c3[c-]cccc3)ccc2)n1.Brc1cccc(-c2[c-]c(-c3[c-]cccc3)ccc2)n1.Cc1c[c-]c(-c2[c-]c(-c3ccc(C(F)(F)F)cn3)ccc2)cc1.Cl[Ni].Cl[Ni].Cl[Ni].Clc1cccc(-c2[c-]c(-c3[c-]cccc3)ccc2)n1.Clc1cccc(-c2[c-]c(-c3[c-]cccc3)ccc2)n1.Fc1cccc(-c2[c-]c(-c3[c-]cccc3)ccc2)n1.[Ni+3].[Ni+3].[Ni+3].c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12
• InChI: InChI=1S/C19H12F3N.2C17H10BrN.2C17H10ClN.C17H10FN.3C12H8N.3ClH.6Ni/c1-13-5-7-14(8-6-13)15-3-2-4-16(11-15)18-10-9-17(12-23-18)19(20,21)22;5*18-17-11-5-10-16(19-17)15-9-4-8-14(12-15)13-6-2-1-3-7-13;3*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;;;;;;;;;/h2-7,9-10,12H,1H3;5*1-6,8-11H;3*1-8H;3*1H;;;;;;/q6*-2;3*-1;;;;3*+1;3*+3/p-3
• InChIKey: QTMIIQGXMSQSAN-UHFFFAOYSA-K
• XLogP: 39.30
• TPSA: 119.64 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 12
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2659.51
LogP ≤ 5	39.30
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(2-bromo-6-(3-phenylbenzene-2-id-1-yl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(3-phenylbenzene-2-id-1-yl)pyridine);2-fluoro-6-(3-phenylbenzene-2-id-1-yl)pyridine;2-[3-(4-methylbenzene-6-id-1-yl)benzene-2-id-1-yl]-5-(trifluoromethyl)pyridine;tris(nickel(3+))?

The IUPAC name of bis(2-bromo-6-(3-phenylbenzene-2-id-1-yl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(3-phenylbenzene-2-id-1-yl)pyridine);2-fluoro-6-(3-phenylbenzene-2-id-1-yl)pyridine;2-[3-(4-methylbenzene-6-id-1-yl)benzene-2-id-1-yl]-5-(trifluoromethyl)pyridine;tris(nickel(3+)) (CID 158160270) is bis(2-bromo-6-(3-phenylbenzene-2-id-1-yl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(3-phenylbenzene-2-id-1-yl)pyridine);2-fluoro-6-(3-phenylbenzene-2-id-1-yl)pyridine;2-[3-(4-methylbenzene-6-id-1-yl)benzene-2-id-1-yl]-5-(trifluoromethyl)pyridine;tris(nickel(3+)).

What is the SMILES notation for bis(2-bromo-6-(3-phenylbenzene-2-id-1-yl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(3-phenylbenzene-2-id-1-yl)pyridine);2-fluoro-6-(3-phenylbenzene-2-id-1-yl)pyridine;2-[3-(4-methylbenzene-6-id-1-yl)benzene-2-id-1-yl]-5-(trifluoromethyl)pyridine;tris(nickel(3+))?

The canonical SMILES for bis(2-bromo-6-(3-phenylbenzene-2-id-1-yl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(3-phenylbenzene-2-id-1-yl)pyridine);2-fluoro-6-(3-phenylbenzene-2-id-1-yl)pyridine;2-[3-(4-methylbenzene-6-id-1-yl)benzene-2-id-1-yl]-5-(trifluoromethyl)pyridine;tris(nickel(3+)) is Brc1cccc(-c2[c-]c(-c3[c-]cccc3)ccc2)n1.Brc1cccc(-c2[c-]c(-c3[c-]cccc3)ccc2)n1.Cc1c[c-]c(-c2[c-]c(-c3ccc(C(F)(F)F)cn3)ccc2)cc1.Cl[Ni].Cl[Ni].Cl[Ni].Clc1cccc(-c2[c-]c(-c3[c-]cccc3)ccc2)n1.Clc1cccc(-c2[c-]c(-c3[c-]cccc3)ccc2)n1.Fc1cccc(-c2[c-]c(-c3[c-]cccc3)ccc2)n1.[Ni+3].[Ni+3].[Ni+3].c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.

What is the InChIKey of bis(2-bromo-6-(3-phenylbenzene-2-id-1-yl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(3-phenylbenzene-2-id-1-yl)pyridine);2-fluoro-6-(3-phenylbenzene-2-id-1-yl)pyridine;2-[3-(4-methylbenzene-6-id-1-yl)benzene-2-id-1-yl]-5-(trifluoromethyl)pyridine;tris(nickel(3+))?

The InChIKey is QTMIIQGXMSQSAN-UHFFFAOYSA-K. The full InChI is InChI=1S/C19H12F3N.2C17H10BrN.2C17H10ClN.C17H10FN.3C12H8N.3ClH.6Ni/c1-13-5-7-14(8-6-13)15-3-2-4-16(11-15)18-10-9-17(12-23-18)19(20,21)22;5*18-17-11-5-10-16(19-17)15-9-4-8-14(12-15)13-6-2-1-3-7-13;3*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;;;;;;;;;/h2-7,9-10,12H,1H3;5*1-6,8-11H;3*1-8H;3*1H;;;;;;/q6*-2;3*-1;;;;3*+1;3*+3/p-3.

What are the key properties of bis(2-bromo-6-(3-phenylbenzene-2-id-1-yl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(3-phenylbenzene-2-id-1-yl)pyridine);2-fluoro-6-(3-phenylbenzene-2-id-1-yl)pyridine;2-[3-(4-methylbenzene-6-id-1-yl)benzene-2-id-1-yl]-5-(trifluoromethyl)pyridine;tris(nickel(3+))?

bis(2-bromo-6-(3-phenylbenzene-2-id-1-yl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(3-phenylbenzene-2-id-1-yl)pyridine);2-fluoro-6-(3-phenylbenzene-2-id-1-yl)pyridine;2-[3-(4-methylbenzene-6-id-1-yl)benzene-2-id-1-yl]-5-(trifluoromethyl)pyridine;tris(nickel(3+)) has a molecular weight of 2659.51 g/mol, XLogP of 39.30, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2-bromo-6-(3-phenylbenzene-2-id-1-yl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(3-phenylbenzene-2-id-1-yl)pyridine);2-fluoro-6-(3-phenylbenzene-2-id-1-yl)pyridine;2-[3-(4-methylbenzene-6-id-1-yl)benzene-2-id-1-yl]-5-(trifluoromethyl)pyridine;tris(nickel(3+)) is sourced from PubChem (CID 158160270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).