2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-1-ium-2-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)pyridine;platinum

C29H24F2N7Pt- — CID 164946671

IUPAC2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-1-ium-2-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)pyridine;platinum
SMILESC[n+]1[c-]n(-c2ccccn2)cc1.Cn1[c-][n+](-c2ccccn2)cc1.Fc1c[c-]c(-c2ccccn2)c(F)c1.[Pt]
InChIInChI=1S/C11H6F2N.2C9H9N3.Pt/c12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;2*1-11-6-7-12(8-11)9-4-2-3-5-10-9;/h1-4,6-7H;2*2-7H,1H3;/q-1;;;
InChIKeySHTZAHBXXPFEGI-UHFFFAOYSA-N
MW703.63 g/mol
LogP3.82
Rot. Bonds3

About 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-1-ium-2-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)pyridine;platinum

2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-1-ium-2-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)pyridine;platinum (PubChem CID 164946671) has the molecular formula C29H24F2N7Pt- and a molecular weight of 703.63 g/mol. Its IUPAC name is 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-1-ium-2-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)pyridine;platinum.

Molecular Properties

Compound Name2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-1-ium-2-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)pyridine;platinum
PubChem CID164946671
Molecular FormulaC29H24F2N7Pt-
Molecular Weight703.63 g/mol
Exact Mass703.17
IUPAC Name2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-1-ium-2-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)pyridine;platinum
SMILESC[n+]1[c-]n(-c2ccccn2)cc1.Cn1[c-][n+](-c2ccccn2)cc1.Fc1c[c-]c(-c2ccccn2)c(F)c1.[Pt]
InChIInChI=1S/C11H6F2N.2C9H9N3.Pt/c12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;2*1-11-6-7-12(8-11)9-4-2-3-5-10-9;/h1-4,6-7H;2*2-7H,1H3;/q-1;;;
InChIKeySHTZAHBXXPFEGI-UHFFFAOYSA-N
XLogP3.82
TPSA56.29 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500703.63
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-1-ium-2-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)pyridine;platinum?
The IUPAC name of 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-1-ium-2-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)pyridine;platinum (CID 164946671) is 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-1-ium-2-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)pyridine;platinum.
What is the SMILES notation for 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-1-ium-2-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)pyridine;platinum?
The canonical SMILES for 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-1-ium-2-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)pyridine;platinum is C[n+]1[c-]n(-c2ccccn2)cc1.Cn1[c-][n+](-c2ccccn2)cc1.Fc1c[c-]c(-c2ccccn2)c(F)c1.[Pt].
What is the InChIKey of 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-1-ium-2-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)pyridine;platinum?
The InChIKey is SHTZAHBXXPFEGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6F2N.2C9H9N3.Pt/c12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;2*1-11-6-7-12(8-11)9-4-2-3-5-10-9;/h1-4,6-7H;2*2-7H,1H3;/q-1;;;.
What are the key properties of 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-1-ium-2-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)pyridine;platinum?
2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-1-ium-2-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)pyridine;platinum has a molecular weight of 703.63 g/mol, XLogP of 3.82, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-1-ium-2-id-1-yl)pyridine;2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)pyridine;platinum is sourced from PubChem (CID 164946671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).