bis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride

C24H30Cl2Si2Zr-2 — CID 161478102

IUPACbis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride
SMILESC[Si](=[Zr+2])[Si](C)(C)C.Cc1cc2ccccc2[cH-]1.Cc1cc2ccccc2[cH-]1.[Cl-].[Cl-]
InChIInChI=1S/2C10H9.C4H12Si2.2ClH.Zr/c2*1-8-6-9-4-2-3-5-10(9)7-8;1-5-6(2,3)4;;;/h2*2-7H,1H3;1-4H3;2*1H;/q2*-1;;;;+2/p-2
InChIKeyDDERDLNZOYVXCS-UHFFFAOYSA-L
MW536.81 g/mol
LogP1.31
Rot. Bonds1

About bis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride

bis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride (PubChem CID 161478102) has the molecular formula C24H30Cl2Si2Zr-2 and a molecular weight of 536.81 g/mol. Its IUPAC name is bis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride.

Molecular Properties

Compound Namebis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride
PubChem CID161478102
Molecular FormulaC24H30Cl2Si2Zr-2
Molecular Weight536.81 g/mol
Exact Mass534.03
IUPAC Namebis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride
SMILESC[Si](=[Zr+2])[Si](C)(C)C.Cc1cc2ccccc2[cH-]1.Cc1cc2ccccc2[cH-]1.[Cl-].[Cl-]
InChIInChI=1S/2C10H9.C4H12Si2.2ClH.Zr/c2*1-8-6-9-4-2-3-5-10(9)7-8;1-5-6(2,3)4;;;/h2*2-7H,1H3;1-4H3;2*1H;/q2*-1;;;;+2/p-2
InChIKeyDDERDLNZOYVXCS-UHFFFAOYSA-L
XLogP1.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500536.81
LogP ≤ 51.31
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'}

Analyze bis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 157447863
CID 157447863
chromium(2+);bis(2-methyl-1H-inden-1-ide)
CID 139887885
2-methyl-1H-inden-1-ide;praseodymium
CID 150206996
dimethylsilylidenezirconium(2+);2-methyl-1H-inden-1-ide;2-phenyl-1H-inden-1-ide;dichloride
CID 18369835
carbanide;dimethylsilylidenetitanium;bis(2-methyl-1H-inden-1-ide)
CID 173290342
1,3-dimethylcyclopenta-1,3-diene;dimethylsilylidenezirconium(2+);2-methyl-1H-inden-1-ide;dichloride
CID 172816212
ethane;2-methyl-1H-inden-1-ide;zirconium(4+);dichloride
CID 157150414
bis(2-methyl-1H-inden-1-ide);trimethyl(methylsilyl)silane;zirconium(4+);dichloride
CID 159743008
dipropylsilylidenezirconium(2+);bis(2-methyl-1H-inden-1-ide);dichloride
CID 161077385
CID 87864757
CID 87864757
meso-Dimethylsilyl-bis-(2-methylindenyl)zirconium dichloride
CID 132989110
diphenylsilylidenehafnium(2+);bis(2-methyl-1H-inden-1-ide);dichloride
CID 87676842

Frequently Asked Questions

What is the IUPAC name of bis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride?
The IUPAC name of bis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride (CID 161478102) is bis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride.
What is the SMILES notation for bis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride?
The canonical SMILES for bis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride is C[Si](=[Zr+2])[Si](C)(C)C.Cc1cc2ccccc2[cH-]1.Cc1cc2ccccc2[cH-]1.[Cl-].[Cl-].
What is the InChIKey of bis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride?
The InChIKey is DDERDLNZOYVXCS-UHFFFAOYSA-L. The full InChI is InChI=1S/2C10H9.C4H12Si2.2ClH.Zr/c2*1-8-6-9-4-2-3-5-10(9)7-8;1-5-6(2,3)4;;;/h2*2-7H,1H3;1-4H3;2*1H;/q2*-1;;;;+2/p-2.
What are the key properties of bis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride?
bis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride has a molecular weight of 536.81 g/mol, XLogP of 1.31, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride is sourced from PubChem (CID 161478102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).