bis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide)

C44H30N6Pt2 — CID 176621886

IUPACbis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide)
SMILES[Pt+2].[Pt+2].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.c1ccc2c(c1)[n-]c1ncccc12.c1ccc2c(c1)[n-]c1ncccc12
InChIInChI=1S/2C11H7N2.2C11H8N.2Pt/c2*1-2-6-10-8(4-1)9-5-3-7-12-11(9)13-10;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;/h2*1-7H;2*1-6,8-9H;;/q4*-1;2*+2
InChIKeyYLWOTTZQKRHPQN-UHFFFAOYSA-N
MW1032.92 g/mol
LogP9.78
Rot. Bonds2

About bis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide)

bis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide) (PubChem CID 176621886) has the molecular formula C44H30N6Pt2 and a molecular weight of 1032.92 g/mol. Its IUPAC name is bis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide).

Molecular Properties

Compound Namebis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide)
PubChem CID176621886
Molecular FormulaC44H30N6Pt2
Molecular Weight1032.92 g/mol
Exact Mass1032.18
IUPAC Namebis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide)
SMILES[Pt+2].[Pt+2].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.c1ccc2c(c1)[n-]c1ncccc12.c1ccc2c(c1)[n-]c1ncccc12
InChIInChI=1S/2C11H7N2.2C11H8N.2Pt/c2*1-2-6-10-8(4-1)9-5-3-7-12-11(9)13-10;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;/h2*1-7H;2*1-6,8-9H;;/q4*-1;2*+2
InChIKeyYLWOTTZQKRHPQN-UHFFFAOYSA-N
XLogP9.78
TPSA79.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001032.92
LogP ≤ 59.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

bis(2-phenylpyridine);bis(2-phenylpyrido[2,3-b]indol-9-ide);bis(platinum(2+))
CID 176622002
bis(2-(4-fluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide)
CID 176621893
bis(2-(2H-naphthalen-2-id-1-yl)pyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide)
CID 176621902
iridium;tris(2-phenylpyridine)
CID 23386734
bis(chloroiridium(2+));tetrakis(2-phenylpyridine)
CID 54724512
2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide
CID 20807166
chlorozinc(1+);2-phenylpyridine
CID 59773311
dichloroiridium(1+);tetrakis(2-phenylpyridine)
CID 175874187
iridium(3+);bis(2-phenylpyridine);2-pyridin-2-ylbenzimidazol-1-ide
CID 59010560
iridium(3+);1-phenylisoquinoline;bis(2-phenylpyridine)
CID 140815692
bis(2-methylpyrido[2,3-b]indol-9-ide);bis(1-phenylisoquinoline);bis(platinum(2+))
CID 176622051
2-phenylpyridine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);hexafluorophosphate
CID 10963599

Frequently Asked Questions

What is the IUPAC name of bis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide)?
The IUPAC name of bis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide) (CID 176621886) is bis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide).
What is the SMILES notation for bis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide)?
The canonical SMILES for bis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide) is [Pt+2].[Pt+2].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.c1ccc2c(c1)[n-]c1ncccc12.c1ccc2c(c1)[n-]c1ncccc12.
What is the InChIKey of bis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide)?
The InChIKey is YLWOTTZQKRHPQN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H7N2.2C11H8N.2Pt/c2*1-2-6-10-8(4-1)9-5-3-7-12-11(9)13-10;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;/h2*1-7H;2*1-6,8-9H;;/q4*-1;2*+2.
What are the key properties of bis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide)?
bis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide) has a molecular weight of 1032.92 g/mol, XLogP of 9.78, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide) is sourced from PubChem (CID 176621886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).