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

C56H38N6Pt2 — CID 176622002

IUPACbis(2-phenylpyridine);bis(2-phenylpyrido[2,3-b]indol-9-ide);bis(platinum(2+))
SMILES[Pt+2].[Pt+2].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.c1ccc(-c2ccc3c(n2)[n-]c2ccccc23)cc1.c1ccc(-c2ccc3c(n2)[n-]c2ccccc23)cc1
InChIInChI=1S/2C17H11N2.2C11H8N.2Pt/c2*1-2-6-12(7-3-1)15-11-10-14-13-8-4-5-9-16(13)19-17(14)18-15;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;/h2*1-11H;2*1-6,8-9H;;/q4*-1;2*+2
InChIKeyCOZHJGDQLJIMGT-UHFFFAOYSA-N
MW1185.12 g/mol
LogP13.12
Rot. Bonds4

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

bis(2-phenylpyridine);bis(2-phenylpyrido[2,3-b]indol-9-ide);bis(platinum(2+)) (PubChem CID 176622002) has the molecular formula C56H38N6Pt2 and a molecular weight of 1185.12 g/mol. Its IUPAC name is bis(2-phenylpyridine);bis(2-phenylpyrido[2,3-b]indol-9-ide);bis(platinum(2+)).

Molecular Properties

Compound Namebis(2-phenylpyridine);bis(2-phenylpyrido[2,3-b]indol-9-ide);bis(platinum(2+))
PubChem CID176622002
Molecular FormulaC56H38N6Pt2
Molecular Weight1185.12 g/mol
Exact Mass1184.25
IUPAC Namebis(2-phenylpyridine);bis(2-phenylpyrido[2,3-b]indol-9-ide);bis(platinum(2+))
SMILES[Pt+2].[Pt+2].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.c1ccc(-c2ccc3c(n2)[n-]c2ccccc23)cc1.c1ccc(-c2ccc3c(n2)[n-]c2ccccc23)cc1
InChIInChI=1S/2C17H11N2.2C11H8N.2Pt/c2*1-2-6-12(7-3-1)15-11-10-14-13-8-4-5-9-16(13)19-17(14)18-15;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;/h2*1-11H;2*1-6,8-9H;;/q4*-1;2*+2
InChIKeyCOZHJGDQLJIMGT-UHFFFAOYSA-N
XLogP13.12
TPSA79.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001185.12
LogP ≤ 513.12
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(platinum(2+));bis(pyrido[2,3-b]indol-9-ide)
CID 176621886
chloroplatinum(1+);2-phenylpyridine;2-phenylpyridine
CID 54698144
bis(chloroiridium(2+));tetrakis(2-phenylpyridine)
CID 54724512
2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide
CID 20807166
iridium;tris(2-phenylpyridine)
CID 23386734
bis(2-(2H-naphthalen-2-id-1-yl)pyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide)
CID 176621902
bis(2-(4-fluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide)
CID 176621893
3,5-diphenyl-2-phenylimidazo[4,5-b]pyridine;iridium;2-phenylpyridine
CID 164826378
iridium;2-methyl-3-phenyl-6-phenylpyridine;phenylbenzene;2-phenylpyridine
CID 166495302
iridium;2-phenyl-6-phenylselenopheno[2,3-b]pyridine;2-phenylpyridine
CID 155629248
bis(2-methylpyrido[2,3-b]indol-9-ide);bis(1-phenylisoquinoline);bis(platinum(2+))
CID 176622051
iridium(3+);bis(2-phenylpyridine);2-pyridin-2-ylbenzimidazol-1-ide
CID 59010560

Frequently Asked Questions

What is the IUPAC name of bis(2-phenylpyridine);bis(2-phenylpyrido[2,3-b]indol-9-ide);bis(platinum(2+))?
The IUPAC name of bis(2-phenylpyridine);bis(2-phenylpyrido[2,3-b]indol-9-ide);bis(platinum(2+)) (CID 176622002) is bis(2-phenylpyridine);bis(2-phenylpyrido[2,3-b]indol-9-ide);bis(platinum(2+)).
What is the SMILES notation for bis(2-phenylpyridine);bis(2-phenylpyrido[2,3-b]indol-9-ide);bis(platinum(2+))?
The canonical SMILES for bis(2-phenylpyridine);bis(2-phenylpyrido[2,3-b]indol-9-ide);bis(platinum(2+)) is [Pt+2].[Pt+2].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.c1ccc(-c2ccc3c(n2)[n-]c2ccccc23)cc1.c1ccc(-c2ccc3c(n2)[n-]c2ccccc23)cc1.
What is the InChIKey of bis(2-phenylpyridine);bis(2-phenylpyrido[2,3-b]indol-9-ide);bis(platinum(2+))?
The InChIKey is COZHJGDQLJIMGT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C17H11N2.2C11H8N.2Pt/c2*1-2-6-12(7-3-1)15-11-10-14-13-8-4-5-9-16(13)19-17(14)18-15;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;/h2*1-11H;2*1-6,8-9H;;/q4*-1;2*+2.
What are the key properties of bis(2-phenylpyridine);bis(2-phenylpyrido[2,3-b]indol-9-ide);bis(platinum(2+))?
bis(2-phenylpyridine);bis(2-phenylpyrido[2,3-b]indol-9-ide);bis(platinum(2+)) has a molecular weight of 1185.12 g/mol, XLogP of 13.12, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-phenylpyridine);bis(2-phenylpyrido[2,3-b]indol-9-ide);bis(platinum(2+)) is sourced from PubChem (CID 176622002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).