bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hafnium(4+);dichloride

C16H26Cl2HfSi2 — CID 22467772

IUPACbis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hafnium(4+);dichloride
SMILESC[Si](C)(C)C1=[C-]CC=C1.C[Si](C)(C)C1=[C-]CC=C1.[Cl-].[Cl-].[Hf+4]
InChIInChI=1S/2C8H13Si.2ClH.Hf/c2*1-9(2,3)8-6-4-5-7-8;;;/h2*4,6H,5H2,1-3H3;2*1H;/q2*-1;;;+4/p-2
InChIKeyWVIZFWANRVZSGE-UHFFFAOYSA-L
MW523.95 g/mol
LogP-0.89
Rot. Bonds2

About bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hafnium(4+);dichloride

bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hafnium(4+);dichloride (PubChem CID 22467772) has the molecular formula C16H26Cl2HfSi2 and a molecular weight of 523.95 g/mol. Its IUPAC name is bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hafnium(4+);dichloride.

Molecular Properties

Compound Namebis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hafnium(4+);dichloride
PubChem CID22467772
Molecular FormulaC16H26Cl2HfSi2
Molecular Weight523.95 g/mol
Exact Mass524.04
IUPAC Namebis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hafnium(4+);dichloride
SMILESC[Si](C)(C)C1=[C-]CC=C1.C[Si](C)(C)C1=[C-]CC=C1.[Cl-].[Cl-].[Hf+4]
InChIInChI=1S/2C8H13Si.2ClH.Hf/c2*1-9(2,3)8-6-4-5-7-8;;;/h2*4,6H,5H2,1-3H3;2*1H;/q2*-1;;;+4/p-2
InChIKeyWVIZFWANRVZSGE-UHFFFAOYSA-L
XLogP-0.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500523.95
LogP ≤ 5-0.89
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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Related Compounds

Silane, 2,4-cyclopentadien-1-ylidenebis(trimethyl-
CID 141813
2,5,5-Tris(trimethylsilyl)-1,3-cyclopentadiene
CID 4181619
Silane, dimethyldi(2,4-cyclopentadien-1-yl)-
CID 579493
DI(Cyclopentadienyl)dimethylsilane
CID 12133503
(1-Trimethylsilylcyclopenta-2,-4-dienyl)trichlorosilane
CID 15812308
(Cyclopenta-1,3-diene-1,2-diyl)bis(trimethylsilane)
CID 15819599
Di(cyclopenta-1,4-dien-1-yl)-dimethylsilane
CID 15325246
Chloro-dimethyl-(1-trimethylsilylcyclopenta-2,4-dien-1-yl)silane
CID 11053448
Dichloro-methyl-(1-trimethylsilylcyclopenta-2,4-dien-1-yl)silane
CID 11107800
Trimethyl-(3-trimethylsilylcyclopenta-1,4-dien-1-yl)silane
CID 11985856
Cyclopenta-1,3-dien-1-yl-[cyclopenta-1,3-dien-1-yl(dimethyl)silyl]-dimethylsilane
CID 14118826
Trimethyl-(2-trimethylsilylcyclopenta-2,4-dien-1-yl)silane
CID 11987086

Frequently Asked Questions

What is the IUPAC name of bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hafnium(4+);dichloride?
The IUPAC name of bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hafnium(4+);dichloride (CID 22467772) is bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hafnium(4+);dichloride.
What is the SMILES notation for bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hafnium(4+);dichloride?
The canonical SMILES for bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hafnium(4+);dichloride is C[Si](C)(C)C1=[C-]CC=C1.C[Si](C)(C)C1=[C-]CC=C1.[Cl-].[Cl-].[Hf+4].
What is the InChIKey of bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hafnium(4+);dichloride?
The InChIKey is WVIZFWANRVZSGE-UHFFFAOYSA-L. The full InChI is InChI=1S/2C8H13Si.2ClH.Hf/c2*1-9(2,3)8-6-4-5-7-8;;;/h2*4,6H,5H2,1-3H3;2*1H;/q2*-1;;;+4/p-2.
What are the key properties of bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hafnium(4+);dichloride?
bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hafnium(4+);dichloride has a molecular weight of 523.95 g/mol, XLogP of -0.89, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(cyclopenta-1,4-dien-1-yl(trimethyl)silane);hafnium(4+);dichloride is sourced from PubChem (CID 22467772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).