WebCocon 4J

 

 

 

Thomas Lindel, Matthias Köck, Jochen Junker

 

München, Frankfurt, Göttingen

 

2002

Contents

(get a PDF file of this manual)

 

1. Purpose

 

2. Short description

2.1. Molecular formula

2.2. HMBC correlations

2.3. 13C NMR chemical shifts

 

3. WebCocon 4J Input

3.1. Calculation Options

3.2. Connectivity Table

 

4. WebCocon 4J Output

4.1. Viewing the constitutions with Jmol

 

Appendix 1: Example of an inputfile

Appendix 2: List of available atomtypes

Appendix 3: One-sphere HOSE codes used by WebCocon 4J

 

© Team Cocon: Jochen Junker, Matthias Köck, Thomas Lindel