Structure & Deep Data of Molybdenum trisulfide (MoS3)
Identification of Molybdenum trisulfide Chemical Compound
Chemical Formula | MoS3 |
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Molecular Weight | 192.155 g/mol |
IUPAC Name | trisulfanylidenemolybdenum |
SMILES String | S=[Mo](=S)=S |
InChI | InChI=1S/Mo.3S |
InChIKey | TVWWSIKTCILRBF-UHFFFAOYSA-N |
Chemical Structure Description
A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The Molybdenum trisulfide molecule contains a total of 3 bond(s). There are 3 non-H bond(s), 3 multiple bond(s), and 3 double bond(s). Images of the chemical structure of Molybdenum trisulfide are given below:
The 2D chemical structure image of Molybdenum trisulfide is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of Molybdenum trisulfide are implied to be located at the corner(s) and hydrogen atoms attached to carbon atoms are not indicated – each carbon atom is considered to be associated with enough hydrogen atoms to provide the carbon atom with four bonds.
The 3D chemical structure image of Molybdenum trisulfide is based on the ball-and-stick model which displays both the three-dimensional position of the atoms and the bonds between them. The radius of the spheres is therefore smaller than the rod lengths in order to provide a clearer view of the atoms and bonds throughout the chemical structure model of Molybdenum trisulfide. Download structure data file (SDF/MOL) file of this compound.
Interactive 3D Visualization
For a better understanding of the chemical structure, an interactive 3D visualization of Molybdenum trisulfide is provided here.
The Molybdenum trisulfide molecule shown in the visualization screen can be rotated interactively by keep clicking and moving the mouse button. Mouse wheel zoom is available as well – the size of the Molybdenum trisulfide molecule can be increased or decreased by scrolling the mouse wheel.
The information of the atoms, bonds, connectivity and coordinates included in the chemical structure of Molybdenum trisulfide can easily be identified by this visualization. By right-clicking the visualization screen, various other options are available including the visualization of van der Waals surface and exporting to an image file.
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- InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N
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Additional Information for Identifying Molybdenum trisulfide Molecule
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SMILES (Simplified Molecular-Input Line-Entry System) string of Molybdenum trisulfide
The SMILES string of Molybdenum trisulfide is S=[Mo](=S)=S, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the Molybdenum trisulfide.
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Structure Data File (SDF/MOL File) of Molybdenum trisulfide
The structure data file (SDF/MOL File) of Molybdenum trisulfide is available for download in the SDF page of Molybdenum trisulfide, which provides the information about the atoms, bonds, connectivity and coordinates of Molybdenum trisulfide. The Molybdenum trisulfide structure data file can be imported to most of the cheminformatics software systems and applications.
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Chemical formula of Molybdenum trisulfide
The molecular formula of Molybdenum trisulfide is available in chemical formula page of Molybdenum trisulfide, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.
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Molecular weight of Molybdenum trisulfide
The molecular weight of Molybdenum trisulfide is available in molecular weight page of Molybdenum trisulfide, which is calculated as the sum of the atomic weights of each constituent element multiplied by the number of atoms of that element in the molecular formula.
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Other names (synonyms) or registry numbers of Molybdenum trisulfide
The Molybdenum trisulfide compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of Molybdenum trisulfide including the various registry numbers, if available:
- AR-1L7880
- tris(sulfanylidene)molybdenum
- Molybdenum sulfide(MoS3)
- Molybdenum sulfide (MoS3)
- MOLYBDENUM(VI) SULFIDE 2-HYDRATE
- 12033-29-3
- trithioxomolybdenum
- Molybdenum trisulfide
Molybdenum trisulfide Identification Summary Frequently Asked Questions (FAQs)
What’s the chemical formula of Molybdenum trisulfide? |
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MoS3 |
How many atoms and what are the elements included the Molybdenum trisulfide molecule? |
4 atom(s) - 3 Sulfur atom(s) |
How many chemical bonds and what kind of bonds are included the Molybdenum trisulfide structure? |
3 bond(s) - 3 non-H bond(s), 3 multiple bond(s), and 3 double bond(s) |
What’s the Molybdenum trisulfide’s molecular weight? |
192.155 g/mol |
What’s the SMILES code of Molybdenum trisulfide? |
S=[Mo](=S)=S |
What’s the InChI string of Molybdenum trisulfide? |
InChI=1S/Mo.3S |
What’s the InChIKey code of Molybdenum trisulfide? |
TVWWSIKTCILRBF-UHFFFAOYSA-N |
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The contents of this page can freely be shared if cited as follows:
Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN
technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).