User:AngelHerraez/Sandbox/Caffeine

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Revision as of 18:43, 24 May 2009 by AngelHerraez (talk | contribs) (trying to add the new '3DStruct' parameter)
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Caffeine
Hybrid skeletal structure of the caffeine molecule
Space-filling model of the caffeine molecule
IUPAC name
Other names 1,3,7-trimethylxanthine, trimethylxanthine,
theine, methyltheobromine
Identifiers
CAS number [58-08-2]
RTECS number EV6475000
SMILES
ChemSpider ID 2424
Structure
3D structure

Caffeine.mol

Molecular shape mostly planar
Except where noted otherwise, data are given for
materials in their standard state
(at 25 Â°C, 100 kPa)

Infobox references

Contributors

AngelHerraez