bis(dimethylsilylidenehafnium(2+));tetrakis(1H-inden-1-ide);dichloride

C40H40Cl2Hf2Si2-2 — CID 22347931

IUPACbis(dimethylsilylidenehafnium(2+));tetrakis(1H-inden-1-ide);dichloride
SMILESC[Si](C)=[Hf+2].C[Si](C)=[Hf+2].[Cl-].[Cl-].c1ccc2[cH-]ccc2c1.c1ccc2[cH-]ccc2c1.c1ccc2[cH-]ccc2c1.c1ccc2[cH-]ccc2c1
InChIInChI=1S/4C9H7.2C2H6Si.2ClH.2Hf/c4*1-2-5-9-7-3-6-8(9)4-1;2*1-3-2;;;;/h4*1-7H;2*1-2H3;2*1H;;/q4*-1;;;;;2*+2/p-2
InChIKeyCIYNJMNZDAOFLH-UHFFFAOYSA-L
MW1004.82 g/mol
LogP5.81
Rot. Bonds

About bis(dimethylsilylidenehafnium(2+));tetrakis(1H-inden-1-ide);dichloride

bis(dimethylsilylidenehafnium(2+));tetrakis(1H-inden-1-ide);dichloride (PubChem CID 22347931) has the molecular formula C40H40Cl2Hf2Si2-2 and a molecular weight of 1004.82 g/mol. Its IUPAC name is bis(dimethylsilylidenehafnium(2+));tetrakis(1H-inden-1-ide);dichloride.

Molecular Properties

Compound Namebis(dimethylsilylidenehafnium(2+));tetrakis(1H-inden-1-ide);dichloride
PubChem CID22347931
Molecular FormulaC40H40Cl2Hf2Si2-2
Molecular Weight1004.82 g/mol
Exact Mass1006.10
IUPAC Namebis(dimethylsilylidenehafnium(2+));tetrakis(1H-inden-1-ide);dichloride
SMILESC[Si](C)=[Hf+2].C[Si](C)=[Hf+2].[Cl-].[Cl-].c1ccc2[cH-]ccc2c1.c1ccc2[cH-]ccc2c1.c1ccc2[cH-]ccc2c1.c1ccc2[cH-]ccc2c1
InChIInChI=1S/4C9H7.2C2H6Si.2ClH.2Hf/c4*1-2-5-9-7-3-6-8(9)4-1;2*1-3-2;;;;/h4*1-7H;2*1-2H3;2*1H;;/q4*-1;;;;;2*+2/p-2
InChIKeyCIYNJMNZDAOFLH-UHFFFAOYSA-L
XLogP5.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001004.82
LogP ≤ 55.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(dimethylsilylidenehafnium(2+));tetrakis(1H-inden-1-ide);dichloride?
The IUPAC name of bis(dimethylsilylidenehafnium(2+));tetrakis(1H-inden-1-ide);dichloride (CID 22347931) is bis(dimethylsilylidenehafnium(2+));tetrakis(1H-inden-1-ide);dichloride.
What is the SMILES notation for bis(dimethylsilylidenehafnium(2+));tetrakis(1H-inden-1-ide);dichloride?
The canonical SMILES for bis(dimethylsilylidenehafnium(2+));tetrakis(1H-inden-1-ide);dichloride is C[Si](C)=[Hf+2].C[Si](C)=[Hf+2].[Cl-].[Cl-].c1ccc2[cH-]ccc2c1.c1ccc2[cH-]ccc2c1.c1ccc2[cH-]ccc2c1.c1ccc2[cH-]ccc2c1.
What is the InChIKey of bis(dimethylsilylidenehafnium(2+));tetrakis(1H-inden-1-ide);dichloride?
The InChIKey is CIYNJMNZDAOFLH-UHFFFAOYSA-L. The full InChI is InChI=1S/4C9H7.2C2H6Si.2ClH.2Hf/c4*1-2-5-9-7-3-6-8(9)4-1;2*1-3-2;;;;/h4*1-7H;2*1-2H3;2*1H;;/q4*-1;;;;;2*+2/p-2.
What are the key properties of bis(dimethylsilylidenehafnium(2+));tetrakis(1H-inden-1-ide);dichloride?
bis(dimethylsilylidenehafnium(2+));tetrakis(1H-inden-1-ide);dichloride has a molecular weight of 1004.82 g/mol, XLogP of 5.81, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(dimethylsilylidenehafnium(2+));tetrakis(1H-inden-1-ide);dichloride is sourced from PubChem (CID 22347931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).