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Administrator GO button at the upper right connects to CambridgeSoft’s WWW server for this database. Click the button or one of the hyperlinks, and ChemInfo attempts to start your system’s default web browser and direct it to the appropriate URL. BuckyBase The subfolder BUCKYBSE within ChemINDEX contains two databases. BUCKBALL is a file of 132 buckminsterfullerenes, and BUILDING is a file of 99 building blocks which can be joined together to make new or existing buckminsterfullerenes. Directories: buckybse, balls, building Filenames: Buckball.cfw, Building.cfw Number of compounds: 132 buckyballs; 99 building blocks Key Fields: • Structure • Formula • Molecular Weight • Name To view any of the buckyballs or building blocks as a 3-dimensional model using Chem3D: • Right-click the structure and select View Model. Chem3D starts and displays the molecule. The webserver at www.chemfinder.com, is one of the most heavily used public-access chemical information site on the Internet. ChemINDEX is the ChemFinder database of small molecule information presented at this site. Many of the individual compound records also contain lists of hyperlinks (URLs) to other sites containing additional information about the compound. To go to a site, click its link. The default web browser on your system will be activated and directed to the target URL. Using ChemINDEX Online ChemINDEX, available online through a Subscription uses the same conventions as other webserver applications. For more information about general ChemOffice Webserver application concepts, please see “ChemOffice WebServer” on page 3. 236•ChemINDEX CambridgeSoft BuckyBase
Chapter 16: ChemRXN What Is It ChemRXN is a class of databases of chemical reactions which include literature citations, products, reactants, solvent and catalyst data, yields, and reaction conditions. ChemRXN consists of ChemPrep and ChemSelect. How Is It Useful ChemRXN provides ready access to information useful in planning a chemical synthesis. A reaction query can search for all reactions that: • Yield a particular product • Use a particular catalyst or solvent • Consume a particular reactant • Have been published by a certain author For example, you can search for reactions which produce benzofurans in greater than 90% yield. ChemPrep ChemPrep is a carefully prepared chemical reaction database from the Institute for Scientific Information (ISI). ISI is one of the largest and most reputable providers of scientific information, and has a number of scientific databases available including exhaustive reaction and molecular literature databases. Directory: ChemPrep Filenames: Chemprep.cfw, Catalyst.cfw, Reaction.cfw, Solvent.cfw Number of Reactions: 16,761 Key Fields: • Structure (reaction) • Reaction Formula • Abstract • Molecular Weight (components) • Atmosphere • Reaction text • Time • Key phrases • Pressure • Reflux ChemPrep has a principal form or main screen, Chemprep.cfw, and three associated forms: • Reaction.cfw • Solvent.cfw • Catalyst.cfw Reaction.cfw shows the reaction diagram in a larger window. It is useful in case the reaction is complicated or has large molecules or many components. Reaction.cfw is called from the main screen by clicking the zoom Reaction button. The “view Solvents” and “view Catalysts” buttons provide larger views of the solvent (form Solvent.cfw) and catalyst (form Catalyst.cfw) molecules which appear in the scrolling lists on the right of the main screen. Each of these associated forms has a button to return to the main screen. ChemOffice Enterprise Workgroup & Databases 2005 ChemRXN • 237 What Is It
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CAMBRIDGESOFT ChemOffice Desktop to
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