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

C134H86Br2Cl5F4N15Ni6-3 — CID 158137784

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

bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(6-phenyl-2-pyridinyl)pyridine);2-fluoro-6-(6-phenyl-2-pyridinyl)pyridine;2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine;tris(nickel(2+)) (PubChem CID 158137784) has the molecular formula C134H86Br2Cl5F4N15Ni6-3 and a molecular weight of 2671.49 g/mol. Its IUPAC name is bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(6-phenyl-2-pyridinyl)pyridine);2-fluoro-6-(6-phenyl-2-pyridinyl)pyridine;2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine;tris(nickel(2+)).

Molecular Properties

• Compound Name: bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(6-phenyl-2-pyridinyl)pyridine);2-fluoro-6-(6-phenyl-2-pyridinyl)pyridine;2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine;tris(nickel(2+))
• PubChem CID: 158137784
• Molecular Formula: C134H86Br2Cl5F4N15Ni6-3
• Molecular Weight: 2671.49 g/mol
• Exact Mass: 2661.01
• IUPAC Name: bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(6-phenyl-2-pyridinyl)pyridine);2-fluoro-6-(6-phenyl-2-pyridinyl)pyridine;2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine;tris(nickel(2+))
• SMILES: Brc1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.Brc1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.Cc1c[c-]c(-c2cccc(-c3ccc(C(F)(F)F)cn3)n2)cc1.Cl[Ni].Cl[Ni].Cl[Ni].Clc1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.Clc1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.Fc1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.[Ni+2].[Ni+2].[Ni+2].c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12
• InChI: InChI=1S/C18H12F3N2.2C16H10BrN2.2C16H10ClN2.C16H10FN2.3C12H8N.3ClH.6Ni/c1-12-5-7-13(8-6-12)15-3-2-4-17(23-15)16-10-9-14(11-22-16)18(19,20)21;5*17-16-11-5-10-15(19-16)14-9-4-8-13(18-14)12-6-2-1-3-7-12;3*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;;;;;;;;;/h2-7,9-11H,1H3;5*1-6,8-11H;3*1-8H;3*1H;;;;;;/q9*-1;;;;3*+1;3*+2/p-3
• InChIKey: VWIZPKWZPVSLBS-UHFFFAOYSA-K
• XLogP: 36.87
• TPSA: 196.98 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 12
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2671.49
LogP ≤ 5	36.87
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

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-(6-phenyl-2-pyridinyl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(6-phenyl-2-pyridinyl)pyridine);2-fluoro-6-(6-phenyl-2-pyridinyl)pyridine;2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine;tris(nickel(2+))?

The IUPAC name of bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(6-phenyl-2-pyridinyl)pyridine);2-fluoro-6-(6-phenyl-2-pyridinyl)pyridine;2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine;tris(nickel(2+)) (CID 158137784) is bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(6-phenyl-2-pyridinyl)pyridine);2-fluoro-6-(6-phenyl-2-pyridinyl)pyridine;2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine;tris(nickel(2+)).

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

The canonical SMILES for bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(6-phenyl-2-pyridinyl)pyridine);2-fluoro-6-(6-phenyl-2-pyridinyl)pyridine;2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine;tris(nickel(2+)) is Brc1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.Brc1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.Cc1c[c-]c(-c2cccc(-c3ccc(C(F)(F)F)cn3)n2)cc1.Cl[Ni].Cl[Ni].Cl[Ni].Clc1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.Clc1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.Fc1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.[Ni+2].[Ni+2].[Ni+2].c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.

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

The InChIKey is VWIZPKWZPVSLBS-UHFFFAOYSA-K. The full InChI is InChI=1S/C18H12F3N2.2C16H10BrN2.2C16H10ClN2.C16H10FN2.3C12H8N.3ClH.6Ni/c1-12-5-7-13(8-6-12)15-3-2-4-17(23-15)16-10-9-14(11-22-16)18(19,20)21;5*17-16-11-5-10-15(19-16)14-9-4-8-13(18-14)12-6-2-1-3-7-12;3*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;;;;;;;;;/h2-7,9-11H,1H3;5*1-6,8-11H;3*1-8H;3*1H;;;;;;/q9*-1;;;;3*+1;3*+2/p-3.

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

bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(6-phenyl-2-pyridinyl)pyridine);2-fluoro-6-(6-phenyl-2-pyridinyl)pyridine;2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine;tris(nickel(2+)) has a molecular weight of 2671.49 g/mol, XLogP of 36.87, 12 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2-bromo-6-(6-phenyl-2-pyridinyl)pyridine);tris(carbazol-9-ide);chloronickel;bis(2-chloro-6-(6-phenyl-2-pyridinyl)pyridine);2-fluoro-6-(6-phenyl-2-pyridinyl)pyridine;2-(4-methylbenzene-6-id-1-yl)-6-[5-(trifluoromethyl)-2-pyridinyl]pyridine;tris(nickel(2+)) is sourced from PubChem (CID 158137784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).