tetrakis(dichloromethane);bis(2,6-dipyridin-2-ylpyridine);ruthenium(2+);dichloride

C34H30Cl10N6Ru — CID 139149679

IUPACtetrakis(dichloromethane);bis(2,6-dipyridin-2-ylpyridine);ruthenium(2+);dichloride
SMILESClCCl.ClCCl.ClCCl.ClCCl.[Cl-].[Cl-].[Ru+2].c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(-c2cccc(-c3ccccn3)n2)nc1
InChIInChI=1S/2C15H11N3.4CH2Cl2.2ClH.Ru/c2*1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;4*2-1-3;;;/h2*1-11H;4*1H2;2*1H;/q;;;;;;;;+2/p-2
InChIKeyMDTLTRZGJAYIQL-UHFFFAOYSA-L
MW978.26 g/mol
LogP6.10
Rot. Bonds4

About tetrakis(dichloromethane);bis(2,6-dipyridin-2-ylpyridine);ruthenium(2+);dichloride

tetrakis(dichloromethane);bis(2,6-dipyridin-2-ylpyridine);ruthenium(2+);dichloride (PubChem CID 139149679) has the molecular formula C34H30Cl10N6Ru and a molecular weight of 978.26 g/mol. Its IUPAC name is tetrakis(dichloromethane);bis(2,6-dipyridin-2-ylpyridine);ruthenium(2+);dichloride.

Molecular Properties

Compound Nametetrakis(dichloromethane);bis(2,6-dipyridin-2-ylpyridine);ruthenium(2+);dichloride
PubChem CID139149679
Molecular FormulaC34H30Cl10N6Ru
Molecular Weight978.26 g/mol
Exact Mass973.85
IUPAC Nametetrakis(dichloromethane);bis(2,6-dipyridin-2-ylpyridine);ruthenium(2+);dichloride
SMILESClCCl.ClCCl.ClCCl.ClCCl.[Cl-].[Cl-].[Ru+2].c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(-c2cccc(-c3ccccn3)n2)nc1
InChIInChI=1S/2C15H11N3.4CH2Cl2.2ClH.Ru/c2*1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;4*2-1-3;;;/h2*1-11H;4*1H2;2*1H;/q;;;;;;;;+2/p-2
InChIKeyMDTLTRZGJAYIQL-UHFFFAOYSA-L
XLogP6.10
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500978.26
LogP ≤ 56.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

Tris(2,2a(2)-bipyridyl)dichlororuthenium(II) hexahydrate
CID 165340051
Tris(2,2'-bipyridine)nickel dichloride
CID 72193962
tris(2,2'-bipyridyl)dichlororuthenium(II) hexahydrate
CID 172897992
tris(2,2'-bipyridine)iron(II)
CID 6857601
tris(2,2'-bipyridine)ruthenium(II)
CID 44176403
4-Methyl-2-(4-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium
CID 5494444
Tris(2,2'-bipyridyl)ruthenium(II) dichloride
CID 44140593
Cerium(3+);bis(2,6-dipyridin-2-ylpyridine);tris(trifluoromethanesulfonate)
CID 139153054
Iridium;bis(2-phenylpyridine);2-pyridin-2-ylpyridine
CID 59773775
cis-Dichlorobis(2,2'-dipyridyl)rhodium(III) chloride
CID 129896657
Tris(2,2'-bipyridyl-N,N')iron(II) diperchlorate
CID 139057872
Tetrakis(bis(pyridin-2-ylmethyl)azanide);bis(iron(2+))
CID 139115232

Frequently Asked Questions

What is the IUPAC name of tetrakis(dichloromethane);bis(2,6-dipyridin-2-ylpyridine);ruthenium(2+);dichloride?
The IUPAC name of tetrakis(dichloromethane);bis(2,6-dipyridin-2-ylpyridine);ruthenium(2+);dichloride (CID 139149679) is tetrakis(dichloromethane);bis(2,6-dipyridin-2-ylpyridine);ruthenium(2+);dichloride.
What is the SMILES notation for tetrakis(dichloromethane);bis(2,6-dipyridin-2-ylpyridine);ruthenium(2+);dichloride?
The canonical SMILES for tetrakis(dichloromethane);bis(2,6-dipyridin-2-ylpyridine);ruthenium(2+);dichloride is ClCCl.ClCCl.ClCCl.ClCCl.[Cl-].[Cl-].[Ru+2].c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(-c2cccc(-c3ccccn3)n2)nc1.
What is the InChIKey of tetrakis(dichloromethane);bis(2,6-dipyridin-2-ylpyridine);ruthenium(2+);dichloride?
The InChIKey is MDTLTRZGJAYIQL-UHFFFAOYSA-L. The full InChI is InChI=1S/2C15H11N3.4CH2Cl2.2ClH.Ru/c2*1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;4*2-1-3;;;/h2*1-11H;4*1H2;2*1H;/q;;;;;;;;+2/p-2.
What are the key properties of tetrakis(dichloromethane);bis(2,6-dipyridin-2-ylpyridine);ruthenium(2+);dichloride?
tetrakis(dichloromethane);bis(2,6-dipyridin-2-ylpyridine);ruthenium(2+);dichloride has a molecular weight of 978.26 g/mol, XLogP of 6.10, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(dichloromethane);bis(2,6-dipyridin-2-ylpyridine);ruthenium(2+);dichloride is sourced from PubChem (CID 139149679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).