MediaWiki/ChemBox1

Caffeine
Hybrid skeletal structure of the caffeine molecule	Space-filling model of the caffeine molecule
IUPAC name	1,3,7-trimethyl- 1H-purine- 2,6(3H,7H)-dione
Other names	1,3,7-trimethylxanthine, trimethylxanthine, theine, methyltheobromine
Identifiers
CAS number	[58-08-2]
RTECS number	EV6475000
SMILES	C[n]1cnc2N(C)C(=O)N(C)C(=O)c12
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

This a duplicate of (part of) the ChemBox template used at Wikipedia, with an added item, '3D structure' inside the 'Structure' section. The link is inserted using standard syntax of the ChemBox template, that includes a parameter with the filename (that's why the link text is the same as the filename, just simplifying things). The link opens a small, resizable browser window (a pop-up, but only by user's action, so it should not be blocked by pop-up-blocker software) with the JmolApplet that covers the full window and resizes with it.

(Images are not working temporarily, but under normal conditions should be there at the top row of the ChemBox).

Contributors

AngelHerraez