bis(dimethylazanide);(2,6-dimethylphenyl)-[2-[(2,6-dimethylphenyl)azanidyl-dimethylsilyl]ethyl-dimethylsilyl]azanide;zirconium(4+)

C26H46N4Si2Zr — CID 10918753

IUPACbis(dimethylazanide);(2,6-dimethylphenyl)-[2-[(2,6-dimethylphenyl)azanidyl-dimethylsilyl]ethyl-dimethylsilyl]azanide;zirconium(4+)
SMILESC[N-]C.C[N-]C.Cc1cccc(C)c1[N-][Si](C)(C)CC[Si](C)(C)[N-]c1c(C)cccc1C.[Zr+4]
InChIInChI=1S/C22H34N2Si2.2C2H6N.Zr/c1-17-11-9-12-18(2)21(17)23-25(5,6)15-16-26(7,8)24-22-19(3)13-10-14-20(22)4;2*1-3-2;/h9-14H,15-16H2,1-8H3;2*1-2H3;/q-2;2*-1;+4
InChIKeyYHWSULDAXMXUBH-UHFFFAOYSA-N
MW562.08 g/mol
LogP9.28
Rot. Bonds7

About bis(dimethylazanide);(2,6-dimethylphenyl)-[2-[(2,6-dimethylphenyl)azanidyl-dimethylsilyl]ethyl-dimethylsilyl]azanide;zirconium(4+)

bis(dimethylazanide);(2,6-dimethylphenyl)-[2-[(2,6-dimethylphenyl)azanidyl-dimethylsilyl]ethyl-dimethylsilyl]azanide;zirconium(4+) (PubChem CID 10918753) has the molecular formula C26H46N4Si2Zr and a molecular weight of 562.08 g/mol. Its IUPAC name is bis(dimethylazanide);(2,6-dimethylphenyl)-[2-[(2,6-dimethylphenyl)azanidyl-dimethylsilyl]ethyl-dimethylsilyl]azanide;zirconium(4+).

Molecular Properties

Compound Namebis(dimethylazanide);(2,6-dimethylphenyl)-[2-[(2,6-dimethylphenyl)azanidyl-dimethylsilyl]ethyl-dimethylsilyl]azanide;zirconium(4+)
PubChem CID10918753
Molecular FormulaC26H46N4Si2Zr
Molecular Weight562.08 g/mol
Exact Mass560.23
IUPAC Namebis(dimethylazanide);(2,6-dimethylphenyl)-[2-[(2,6-dimethylphenyl)azanidyl-dimethylsilyl]ethyl-dimethylsilyl]azanide;zirconium(4+)
SMILESC[N-]C.C[N-]C.Cc1cccc(C)c1[N-][Si](C)(C)CC[Si](C)(C)[N-]c1c(C)cccc1C.[Zr+4]
InChIInChI=1S/C22H34N2Si2.2C2H6N.Zr/c1-17-11-9-12-18(2)21(17)23-25(5,6)15-16-26(7,8)24-22-19(3)13-10-14-20(22)4;2*1-3-2;/h9-14H,15-16H2,1-8H3;2*1-2H3;/q-2;2*-1;+4
InChIKeyYHWSULDAXMXUBH-UHFFFAOYSA-N
XLogP9.28
TPSA56.40 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500562.08
LogP ≤ 59.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

[2-(dimethylamino)-2-(2,6-dimethylphenyl)iminoethyl]-(2,6-dimethylphenyl)azanide;tris(dimethylazanide);zirconium(4+)
CID 139100173
tris(dimethylazanide);[(2R)-1-(2,6-dimethylphenoxy)propan-2-yl]-(2,6-dimethylphenyl)azanide;zirconium(4+)
CID 139156798
2,4,6-tris(2,6-dimethylphenyl)-1,3,5,2,4,6-trioxatriborinane
CID 13358595
(2,3-dimethylphenyl)methyl-trimethylsilane
CID 71387326
(2,3-dimethylphenyl)-[2-(2,3-dimethylphenyl)silylethyl]silane
CID 173345555
2-[(2,6-dimethylphenyl)sulfanylmethoxy]ethyl-trimethylsilane
CID 171362122
2,4,6-tris(2,6-dimethylphenyl)-1,3,5-trimethyl-1,3,5,2,4,6-triazatriborinane
CID 140908098
bis(chromium(4+));tris(dichloromethane);bis((2,6-dimethylphenyl)-[10-(2,6-dimethylphenyl)azanidylphenanthren-9-yl]azanide);oxolane;tetrachloride
CID 139157821
1,2-xylene
CID 173422016
4,5,6-trimethylbenzo[b][1]benzoborole
CID 169309234
(2,3-dimethylphenyl)-trimethylsilane
CID 45357324
2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol
CID 23082280

Frequently Asked Questions

What is the IUPAC name of bis(dimethylazanide);(2,6-dimethylphenyl)-[2-[(2,6-dimethylphenyl)azanidyl-dimethylsilyl]ethyl-dimethylsilyl]azanide;zirconium(4+)?
The IUPAC name of bis(dimethylazanide);(2,6-dimethylphenyl)-[2-[(2,6-dimethylphenyl)azanidyl-dimethylsilyl]ethyl-dimethylsilyl]azanide;zirconium(4+) (CID 10918753) is bis(dimethylazanide);(2,6-dimethylphenyl)-[2-[(2,6-dimethylphenyl)azanidyl-dimethylsilyl]ethyl-dimethylsilyl]azanide;zirconium(4+).
What is the SMILES notation for bis(dimethylazanide);(2,6-dimethylphenyl)-[2-[(2,6-dimethylphenyl)azanidyl-dimethylsilyl]ethyl-dimethylsilyl]azanide;zirconium(4+)?
The canonical SMILES for bis(dimethylazanide);(2,6-dimethylphenyl)-[2-[(2,6-dimethylphenyl)azanidyl-dimethylsilyl]ethyl-dimethylsilyl]azanide;zirconium(4+) is C[N-]C.C[N-]C.Cc1cccc(C)c1[N-][Si](C)(C)CC[Si](C)(C)[N-]c1c(C)cccc1C.[Zr+4].
What is the InChIKey of bis(dimethylazanide);(2,6-dimethylphenyl)-[2-[(2,6-dimethylphenyl)azanidyl-dimethylsilyl]ethyl-dimethylsilyl]azanide;zirconium(4+)?
The InChIKey is YHWSULDAXMXUBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34N2Si2.2C2H6N.Zr/c1-17-11-9-12-18(2)21(17)23-25(5,6)15-16-26(7,8)24-22-19(3)13-10-14-20(22)4;2*1-3-2;/h9-14H,15-16H2,1-8H3;2*1-2H3;/q-2;2*-1;+4.
What are the key properties of bis(dimethylazanide);(2,6-dimethylphenyl)-[2-[(2,6-dimethylphenyl)azanidyl-dimethylsilyl]ethyl-dimethylsilyl]azanide;zirconium(4+)?
bis(dimethylazanide);(2,6-dimethylphenyl)-[2-[(2,6-dimethylphenyl)azanidyl-dimethylsilyl]ethyl-dimethylsilyl]azanide;zirconium(4+) has a molecular weight of 562.08 g/mol, XLogP of 9.28, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(dimethylazanide);(2,6-dimethylphenyl)-[2-[(2,6-dimethylphenyl)azanidyl-dimethylsilyl]ethyl-dimethylsilyl]azanide;zirconium(4+) is sourced from PubChem (CID 10918753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).