bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyridin-2-ylazanide)

C32H22F4N6Pt2 — CID 140728814

IUPACbis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyridin-2-ylazanide)
SMILESFc1c[c-]c(-c2ccccn2)c(F)c1.Fc1c[c-]c(-c2ccccn2)c(F)c1.[NH-]c1ccccn1.[NH-]c1ccccn1.[Pt+2].[Pt+2]
InChIInChI=1S/2C11H6F2N.2C5H5N2.2Pt/c2*12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;2*6-5-3-1-2-4-7-5;;/h2*1-4,6-7H;2*1-4H,(H-,6,7);;/q4*-1;2*+2
InChIKeyDERGWZKWKLRDKQ-UHFFFAOYSA-N
MW956.72 g/mol
LogP9.18
Rot. Bonds2

About bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyridin-2-ylazanide)

bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyridin-2-ylazanide) (PubChem CID 140728814) has the molecular formula C32H22F4N6Pt2 and a molecular weight of 956.72 g/mol. Its IUPAC name is bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyridin-2-ylazanide).

Molecular Properties

Compound Namebis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyridin-2-ylazanide)
PubChem CID140728814
Molecular FormulaC32H22F4N6Pt2
Molecular Weight956.72 g/mol
Exact Mass956.11
IUPAC Namebis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyridin-2-ylazanide)
SMILESFc1c[c-]c(-c2ccccn2)c(F)c1.Fc1c[c-]c(-c2ccccn2)c(F)c1.[NH-]c1ccccn1.[NH-]c1ccccn1.[Pt+2].[Pt+2]
InChIInChI=1S/2C11H6F2N.2C5H5N2.2Pt/c2*12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;2*6-5-3-1-2-4-7-5;;/h2*1-4,6-7H;2*1-4H,(H-,6,7);;/q4*-1;2*+2
InChIKeyDERGWZKWKLRDKQ-UHFFFAOYSA-N
XLogP9.18
TPSA99.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms44
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500956.72
LogP ≤ 59.18
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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Frequently Asked Questions

What is the IUPAC name of bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyridin-2-ylazanide)?
The IUPAC name of bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyridin-2-ylazanide) (CID 140728814) is bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyridin-2-ylazanide).
What is the SMILES notation for bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyridin-2-ylazanide)?
The canonical SMILES for bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyridin-2-ylazanide) is Fc1c[c-]c(-c2ccccn2)c(F)c1.Fc1c[c-]c(-c2ccccn2)c(F)c1.[NH-]c1ccccn1.[NH-]c1ccccn1.[Pt+2].[Pt+2].
What is the InChIKey of bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyridin-2-ylazanide)?
The InChIKey is DERGWZKWKLRDKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H6F2N.2C5H5N2.2Pt/c2*12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;2*6-5-3-1-2-4-7-5;;/h2*1-4,6-7H;2*1-4H,(H-,6,7);;/q4*-1;2*+2.
What are the key properties of bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyridin-2-ylazanide)?
bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyridin-2-ylazanide) has a molecular weight of 956.72 g/mol, XLogP of 9.18, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));bis(pyridin-2-ylazanide) is sourced from PubChem (CID 140728814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).