Formula of Dimesitylbis(indenyl)silane (C36H36Si)
Identification of Dimesitylbis(indenyl)silane Chemical Compound
| Chemical Formula | C36H36Si |
|---|---|
| Molecular Weight | 496.75654 g/mol |
| IUPAC Name | bis(1H-inden-1-yl)bis(2,4,6-trimethylphenyl)silane |
| SMILES String | Cc1cc(C)c(c(C)c1)[Si](C2C=Cc3ccccc23)(C4C=Cc5ccccc45)c6c(C)cc(C)cc6C |
| InChI | InChI=1S/C36H36Si/c1-23-19-25(3)35(26(4)20-23)37(36-27(5)21-24(2)22-28(36)6,33-17-15-29-11-7-9-13-31(29)33)34-18-16-30-12-8-10-14-32(30)34/h7-22,33-34H,1-6H3 |
| InChIKey | AFZHVSZKMTTWMI-UHFFFAOYSA-N |
Chemical Formula Description
The dimesitylbis(indenyl)silane molecule contains a total of 73 atom(s). There are 36 Hydrogen atom(s) and 36 Carbon atom(s). A chemical formula of dimesitylbis(indenyl)silane can therefore be written as:
C36H36Si
The chemical formula of dimesitylbis(indenyl)silane shown above is based on the molecular formula indicating the numbers of each type of atom in a molecule without structural information, which is different from the empirical formula which provides the numerical proportions of atoms of each type.
The above chemical formula is the basis of stoichiometry in chemical equations, i.e., the calculation of relative quantities of reactants and products in chemical reactions. The law of conservation of mass dictates that the quantity of each element given in the chemical formula does not change in a chemical reaction. Thus, each side of the chemical equation must represent the same quantity of any particular element based on the chemical formula.
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- InChI: InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
- InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N
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Additional Information for Identifying Dimesitylbis(indenyl)silane Molecule
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Structure Data File (SDF/MOL File) of dimesitylbis(indenyl)silane
The structure data file (SDF/MOL File) of dimesitylbis(indenyl)silane is available for download in the SDF page of dimesitylbis(indenyl)silane providing the information about the atoms, bonds, connectivity and coordinates of dimesitylbis(indenyl)silane, which is not completely available in the chemical formula representation. The dimesitylbis(indenyl)silane structure data file can be imported to most of the cheminformatics software for further analysis and visualization.
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Chemical structure of dimesitylbis(indenyl)silane
The chemical structure image of dimesitylbis(indenyl)silane is available in chemical structure page of dimesitylbis(indenyl)silane, which specifies the molecular geometry, i.e., the spatial arrangement of atoms in the chemical formula of dimesitylbis(indenyl)silane and the chemical bonds that hold the atoms together.
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Molecular weight of dimesitylbis(indenyl)silane
The molecular weight of dimesitylbis(indenyl)silane is available in molecular weight page of dimesitylbis(indenyl)silane, which is calculated as the sum of the atomic weights of each constituent element multiplied by the number of atoms of that element specified in the chemical formula of dimesitylbis(indenyl)silane.
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InChI (IUPAC International Chemical Identifier) information of dimesitylbis(indenyl)silane
The molecular chemical formulas lack structural information. An alternative textual expression including the structural information is InChI. The full standard InChI of dimesitylbis(indenyl)silane is:
InChI=1S/C36H36Si/c1-23-19-25(3)35(26(4)20-23)37(36-27(5)21-24(2)22-28(36)6,33-17-15-29-11-7-9-13-31(29)33)34-18-16-30-12-8-10-14-32(30)34/h7-22,33-34H,1-6H3
It can provide a standard way to encode the molecular information of dimesitylbis(indenyl)silane to facilitate the search for the compound information in databases and on the web.
The condensed, 27 character standard InChIKey (hashed version of the full standard InChI) of dimesitylbis(indenyl)silane is:
InChIKey=AFZHVSZKMTTWMI-UHFFFAOYSA-N
The InChIKey may allow easier web searches for dimesitylbis(indenyl)silane, but it needs to be linked to the full InChI to get back to the original structure of the dimesitylbis(indenyl)silane since the full standard InChI cannot be reconstructed from the InChIKey.
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Other names (synonyms) or registry numbers of dimesitylbis(indenyl)silane
The dimesitylbis(indenyl)silane compound may have different names depending on the various different situations of industrial applications. The list of the other names (synonyms) of dimesitylbis(indenyl)silane including the registry numbers is given below, if available:
- dimesitylbis(indenyl)silane
Dimesitylbis(indenyl)silane Identification Summary Frequently Asked Questions (FAQs)
| What’s the chemical formula of dimesitylbis(indenyl)silane? |
|---|
| C36H36Si |
| How many atoms and what are they in the dimesitylbis(indenyl)silane structure? |
| 73 atom(s) - 36 Hydrogen atom(s) and 36 Carbon atom(s) |
| How many chemical bonds and what are they in the dimesitylbis(indenyl)silane structure? |
| 78 bond(s) - 42 non-H bond(s), 26 multiple bond(s), 4 rotatable bond(s), 2 double bond(s), 24 aromatic bond(s), 2 five-membered ring(s), 4 six-membered ring(s), and 2 nine-membered ring(s) |
| What’s the molecular weight of dimesitylbis(indenyl)silane? |
| 496.75654 g/mol |
| What’s the SMILES string of dimesitylbis(indenyl)silane? |
| Cc1cc(C)c(c(C)c1)[Si](C2C=Cc3ccccc23)(C4C=Cc5ccccc45)c6c(C)cc(C)cc6C |
| What’s the InChI of dimesitylbis(indenyl)silane? |
| InChI=1S/C36H36Si/c1-23-19-25(3)35(26(4)20-23)37(36-27(5)21-24(2)22-28(36)6,33-17-15-29-11-7-9-13-31(29)33)34-18-16-30-12-8-10-14-32(30)34/h7-22,33-34H,1-6H3 |
| What’s the InChIKey of dimesitylbis(indenyl)silane? |
| AFZHVSZKMTTWMI-UHFFFAOYSA-N |
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technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).