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2-(3,5-Dioxo-4-aza­tri­cyclo­[5.2.1.02,6]dec-8-en-4-yl)acetic acid

Identifieur interne : 002077 ( Main/Exploration ); précédent : 002076; suivant : 002078

2-(3,5-Dioxo-4-aza­tri­cyclo­[5.2.1.02,6]dec-8-en-4-yl)acetic acid

Auteurs : Mehmet Akkurt [Turquie] ; Aliasghar Jarrahpour [Iran] ; Pouria Shirvani [Iran] ; Muhammad Nawaz Tahir [Pakistan]

Source :

RBID : PMC:3884503

Abstract

The asymmetric unit of the title compound, C11H11NO4, contains two mol­ecules, A and B, with different conformations: in mol­ecule A, the norborne and carb­oxy­lic acid groups lie to the same side of the heterocycle, whereas in a mol­ecule B, they lie on opposite sides. In the crystal, the A mol­ecules form R22(8) carb­oxy­lic acid inversion dimers, linked by pairs of O—H⋯O hydrogen bonds. The B mol­ecules link to one of the ketone O atoms of the A mol­ecule by an O—H⋯O inter­action, resulting in tetra­mers (two A and two B mol­ecules). The tetra­mers are linked by weak C—H⋯O inter­actions, generating a three-dimensional network.


Url:
DOI: 10.1107/S1600536813021764
PubMed: 24427042
PubMed Central: 3884503


Affiliations:


Links toward previous steps (curation, corpus...)


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<title xml:lang="en" level="a" type="main">2-(3,5-Dioxo-4-aza­tri­cyclo­[5.2.1.0
<sup>2,6</sup>
]dec-8-en-4-yl)acetic acid</title>
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<name sortKey="Akkurt, Mehmet" sort="Akkurt, Mehmet" uniqKey="Akkurt M" first="Mehmet" last="Akkurt">Mehmet Akkurt</name>
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<p>The asymmetric unit of the title compound, C
<sub>11</sub>
H
<sub>11</sub>
NO
<sub>4</sub>
, contains two mol­ecules,
<italic>A</italic>
and
<italic>B</italic>
, with different conformations: in mol­ecule
<italic>A</italic>
, the norborne and carb­oxy­lic acid groups lie to the same side of the heterocycle, whereas in a mol­ecule
<italic>B</italic>
, they lie on opposite sides. In the crystal, the
<italic>A</italic>
mol­ecules form
<italic>R</italic>
<sub>2</sub>
<sup>2</sup>
(8) carb­oxy­lic acid inversion dimers, linked by pairs of O—H⋯O hydrogen bonds. The
<italic>B</italic>
mol­ecules link to one of the ketone O atoms of the
<italic>A</italic>
mol­ecule by an O—H⋯O inter­action, resulting in tetra­mers (two
<italic>A</italic>
and two
<italic>B</italic>
mol­ecules). The tetra­mers are linked by weak C—H⋯O inter­actions, generating a three-dimensional network.</p>
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