In the title compound C 7 H 9 NO 4 , the 1,3-dioxane-4,6-dione ring exhibits an envelope conformation. Intermolecular hydrogen bonds connect the molecules into chains. One intramolecular N-HÁ Á ÁO hydrogen bond to a carbonyl O atom is also observed, forming a six-membered ring.
2,2-Dimethyl-5-(pyrrolidin-2-ylidene)-1,3-dioxane-4,6-dione
✍ Scribed by Sabino, Jose R. ;Damasceno, Fabiano ;Cunha, Silvio
- Publisher
- International Union of Crystallography
- Year
- 2007
- Tongue
- English
- Weight
- 202 KB
- Volume
- 63
- Category
- Article
- ISSN
- 1600-5368
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✦ Synopsis
This work describes the first solid-state structural study of a cyclic enaminone derivative from Meldrum's acid, C 10 H 13 NO 4 . The packing shows an infinite linear chain along [111] mediated by dimeric N-HÁ Á ÁO and nonclassical C-HÁ Á ÁO hydrogen-bonding interactions.
📜 SIMILAR VOLUMES
Single-crystal X-ray study T = 297 K Mean (C-C) = 0.004 A Disorder in main residue R factor = 0.076 wR factor = 0.204 Data-to-parameter ratio = 12.9 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.
In the title compound, C 14 H 15 NO 5 , the 1,3-dioxane-4,6-dione ring exhibits a half-chair conformation. The amino H atom has one intra-and one intermolecular contact to carbonyl O atoms, with OÁ Á ÁH distances of 2.11 (2) and 2.31 (2) A ˚.