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Tert-Butyl imidazole-1-carboxyl-ate.

ABSTRACT: In the title compound, C(8)H(12)N(2)O(2), mol-ecules are inter-connected by weak C-H?O contacts with H?O distances of 2.30?Å, resulting in the formation of chains along [100]. According to graph-set analysis, the unitary descriptor of these chains is C(5). In addition, there are ?-? stacking inter-actions between pyrazole rings (centroid distance = 3.878?Å and ring plane distance = 3.26?Å).

SUBMITTER: Kerscher T

PROVIDER: S-EPMC2968161 | biostudies-literature | 2009 Jan

REPOSITORIES: biostudies-literature

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tert-Butyl imidazole-1-carboxyl-ate.

Kerscher Tobias T Prommnitz Tanja T Klüfers Peter P Mayer Peter P

Acta crystallographica. Section E, Structure reports online 20090128 Pt 2

In the title compound, C(8)H(12)N(2)O(2), mol-ecules are inter-connected by weak C-H⋯O contacts with H⋯O distances of 2.30 Å, resulting in the formation of chains along [100]. According to graph-set analysis, the unitary descriptor of these chains is C(5). In addition, there are π-π stacking inter-actions between pyrazole rings (centroid distance = 3.878 Å and ring plane distance = 3.26 Å). ...[more]

PMID: 21581998

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