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Molecule FYI-1002067
Molecule Summary: ID: FYI-1002067 Names: InChIKey: CYVDGZYJHHYIIU-FBCYGCLPSA-N SMILES: C/C(=N\\Nc1c(Cl)cc(Cl)cc1Cl)c2 cc(Cl)ccc2OReceived at FYIcenter.com on: 2023-01-24
2023-01-25, 2047🔥, 0💬

What Is Radical Molecule
What is Radical Molecule? A Radical molecule, also called free radical, is molecule that has one or more radical centers. A Radical center is an atom in a molecule that has an unpaired valence electron, or odd number of valence electrons (including both bounded and unbound electrons). When writing t...
2020-08-03, 2045🔥, 1💬

Molecule FYI-1001342
Molecule Summary: ID: FYI-1001342 SMILES: Received at FYIcenter.com on: 2022-05-25
2022-07-01, 2004🔥, 0💬

biomodel.uah.es - Draw/View Molecules
What is biomodel.uah.es? biomodel.uah.es is a Website that offers an online tool to draw and view and search molecules. biomodel.uah.es uses the JSME Molecular Editor, which may be used for free under terms of the BSD Licence. JSME Editor courtesy of Peter Ertl and Bruno Bienfait. And for the 3D mod...
2020-04-16, 1982🔥, 0💬

Molecule FYI-1003680
Molecule Summary: ID: FYI-1003680 Names: InChIKey: OFBQJSOFQDEBGM-UHFFFAOYSA-N SMILES: CCCCC Received at FYIcenter.com on: 2023-07-18
2023-07-29, 1950🔥, 0💬

What Are CTfile and CTAB
What Are CTfile (Chemical Table File) and CTAB (Connection Table)? CTfile (Chemical Table File) refers to six file formats that are used to store chemical information in a table style. All CTfile formats shares a common structure called CTAB (Connection Table), which describes the structural relatio...
2020-04-16, 1950🔥, 0💬

Open Babel Options on SDF/Mol Files
What options are offered in Parity Code to support stereoinformation in SDF/Mol V2000 and V3000 files generated by Open Babel? Here is the documentation of Open Babel 2.4.1 with options listed to support stereoinformation in SDF/Mol V2000 and V3000 files: fyicenter$ obabel -V Open Babel 2.4.1 -- May...
2021-03-07, 1918🔥, 0💬

What IS JSME - Molecule Editor in JavaScript
What IS JSME, Molecule Editor in JavaScript? JSME, Molecule Editor in JavaScript is a free molecule editor created by Peter Ertl and Bruno Bienfait. It can be used as an integrated online Web tool. JSME features are described in its documentation as: "JSME supports drawing and editing of molecules a...
2020-05-18, 1909🔥, 0💬

3Dmol.js FAQ
Where to find 3Dmol.js FAQ (Frequently Asked Questions)? I want to learn more about 3Dmol.js JavaScript library. Here is a large collection of answers to frequently asked questions compiled by FYIcenter.com team about 3Dmol.js JavaScript library: Getting Started with 3Dmol.js What Is 3Dmol.js Librar...
2022-12-24, 1905🔥, 0💬

Molecule FYI-1002970
Molecule Summary: ID: FYI-1002970 Names: NICKEL, BIS(3,5-HEPTANEDIONATO-O,O''-2 ,2,6,6-TETRAMETHYL)-;InChIKey: PIIJAZNTPALBJL-ATMONBRVSA-L SMILES: CC(C)(C)C(=CC(=O)C(C)(C)C)[O-] .CC(C)(C)C(=CC(=O)C(C)(C)C)[O- ].[Ni+2]Received at FYIcenter.com on: 2023-05-03
2023-05-31, 1903🔥, 0💬

Molecule FYI-1003356
Molecule Summary: ID: FYI-1003356 Names: InChIKey: OPBCOLZGTXBFTN-ZJLYAJKPSA-N SMILES: C[C@H](CS)C(=O)N1CCC[C@@H]1C(= O)O.C1CCC1Received at FYIcenter.com on: 2023-06-05
2023-07-01, 1882🔥, 0💬

Save Molecule from JSME to Server
How to save molecules created in JSME editor to the Web server? If you want to save the molecule structure created in the JSME editor to the backend Web server, you need write JavaScript code to extract the molecule data and send it as HTML form parameters. 1. Create a new HTML document, save-molecu...
2020-05-18, 1871🔥, 0💬

Molecule FYI-1003679
Molecule Summary: ID: FYI-1003679 Names: InChIKey: GZUCKQPYAQFHIC-UHFFFAOYSA-N SMILES: CC(=O)OC(O)CCO Received at FYIcenter.com on: 2023-07-18
2023-07-29, 1863🔥, 0💬

Molecule FYI-1003701
Molecule Summary: ID: FYI-1003701 Names: InChIKey: YAGGBZZRJWIFPD-UHFFFAOYSA-N SMILES: CC(O)(CO)CCC(O)C(C)(O)C4CCC3C2 =CC(=O)C1CC(O)C(O)CC1(C)C2CCC3 4CReceived at FYIcenter.com on: 2023-07-19
2023-07-29, 1862🔥, 0💬

Search Molecule by Name
Can I search for a molecule by its name? Yes. You can search for a molecule by its name using the search tool prepared by FYIcenter.com. All you need to do is to enter a name, and click the "Submit" button below. If a molecule is found for the given name, it will be displayed below: Molecule found b...
2023-01-24, 1856🔥, 0💬

Introduction to SDF/Mol V3000 File Format
Where to find FAQ (Frequently Asked Questions) in understanding what is SDF/Mol V3000 file format? Here is a list of tutorials to answer many frequently asked questions compiled by FYIcenter.com team in understanding what is SDF/Mol V3000 file format. What Is SDF/Mol V3000 File Format Tools for SDF/...
2022-07-26, 1852🔥, 0💬

Running Open Babel on macOS
Where to find FAQ (Frequently Asked Questions) on running Open Babel on macOS? Here is a list of tutorials to answer many frequently asked questions compiled by FYIcenter.com team on running Open Babel on macOS. Open Babel Installation Options on macOS Install Open Babel Binary Package on macOS Open...
2020-09-15, 1829🔥, 0💬

chemwriter.com - Draw/View Molecules
What is chemwriter.com? chemwriter.com is a Website that offers ChemWriter as commercial software and an online tool to draw and view and search molecules. Molecule Online Tool - chemwriter.com For more information, visit chemwriter.com .     ⇒ peter-ertl.com/jsme - JSME (JavaScript Molecule ...
2020-04-16, 1805🔥, 0💬

JSME JavaScript API
Where to find FAQ (Frequently Asked Questions) on JSME JavaScript API? Here is a list of tutorials to answer many frequently asked questions compiled by FYIcenter.com team on JSME JavaScript API. What Is JSME JavaScript API JSApplet.Inchi.computeInchi() - Generate InChI Save Molecule from JSME to Se...
2020-05-18, 1787🔥, 0💬

Molecule FYI-1004898
Molecule Summary: ID: FYI-1004898 Names: InChIKey: ITHUWDONTHSZRK-UHFFFAOYSA-K SMILES: C[Ru](Cl)(Cl)(Cl)(Cl)[n+]1cc[n H]c1.CS([CH2-])=O.[H+].c1c[nH] cn1Received at FYIcenter.com on: 2023-09-27
2023-10-11, 1783🔥, 0💬

List of Open Babel Commands
How many command line tools are provided in the Open Babel package? By default, Open Babel package provides the following command line tools: babel (obabel) - Convert chemistry and molecular modeling data files. obchiral - Print molecular chirality information. obconformer - Generate conformer coord...
2020-11-22, 1780🔥, 0💬

Open Babel File Location on macOS
Where are Open Babel files located on my macOS computers? If you install Open Babel 2.3.1 with the pre-compiled binary package on a macOS computer, you can find its program file location with the "which" command: fyicenter$ which babel /usr/local/bin/babel fyicenter$ ls -l /usr/local/bin/babel -rwxr...
2020-05-24, 1778🔥, 0💬

Molecule FYI-1001420
Molecule Summary: ID: FYI-1001420 SMILES: Received at FYIcenter.com on: 2022-07-23
2022-10-01, 1769🔥, 0💬

Molecule FYI-1003941
Molecule Summary: ID: FYI-1003941 Names: InChIKey: XAVMZYKSKCKTOL-UHFFFAOYSA-N SMILES: CCOc3cccc(c2ccc1[nH]ccc1c2)c3 Received at FYIcenter.com on: 2023-08-07
2023-08-09, 1755🔥, 0💬

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