Crystal structure of (2-acetyl­ferrocen-1-yl)boronic acid

Description

(2-Acetyl­ferrocen-1-yl)boronic acid, [Fe(C5H5)(C7H8BO3)] or 2-C(O)CH3-1-B(OH)2–Fc [Fc = Fe(η5-C5H3)(η5-C5H5)], crystallizes in the centrosymmetric space group P21/n. The boronic acid functionality inter­acts via intra­molecular hydrogen bonds with the acetyl group and with the –B(OH)2 functionality of an adjacent mol­ecule. The resulting centrosymmetric dimer exhibits an anti-positioning of the ferrocenyl moieties towards the central B2O4 plane. Consequently, an (Rp,Sp)-, i.e. a meso configuration is present for this dimer. In the crystal, weak C—H⋯O hydrogen bonds consolidate the mol­ecular packing.

Links & Downloads

1. urn:nbn:de:bsz:ch1-qucosa2-333160
2. https://monarch.qucosa.de/id/qucosa%3A33316
3. https://monarch.qucosa.de/api/qucosa%3A33316/attachment/ATT-0/
4. https://monarch.qucosa.de/api/qucosa%3A33316/attachment/ATT-1/
5. https://monarch.qucosa.de/api/qucosa%3A33316/attachment/ATT-2/

Tags

info:eu-repo/classification/ddc/540

ddc:540

Ferrocen; Kristallographie

Additional Fields

Identifer	oai:union.ndltd.org:DRESDEN/oai:qucosa:de:qucosa:33316
Date	22 February 2019
Creators	Preuss, Andrea, Korb, Marcus, Lang, Heinrich
Publisher	International Union of Crystallography
Source Sets	Hochschulschriftenserver (HSSS) der SLUB Dresden
Language	English
Detected Language	English
Type	info:eu-repo/semantics/publishedVersion, doc-type:article, info:eu-repo/semantics/article, doc-type:Text
Rights	info:eu-repo/semantics/openAccess
Relation	10.1107/S2056989019001178, 2056-9890, 10.1107/S2056989019001178