6533b7d5fe1ef96bd12648a6

RESEARCH PRODUCT

Ethyl 1-acetyl-3-amino-1H-pyrazole-4-carboxyl­ate, a tetra­gonal structure with Z′ = 4

Anna E. KoziolEdyta KołodziejczykBarbara RzeszotarskaAnna Kusakiewicz-dawidTadeusz Lis

subject

chemistry.chemical_compoundchemistrybiologyStereochemistryTetraAtom (order theory)General Materials ScienceAmine gas treatingGeneral ChemistryPyrazoleCondensed Matter Physicsbiology.organism_classification

description

The title compound, C8H11N3O3, crystallizes with Z' = 4. One pyrazole N atom is substituted and excluded from inter­molecular contacts. The amine N, acetyl O and an ester O atom are involved in the formation of nearly planar mol­ecular layers. The layers are perpendicular to the c axis, with an inter­layer distance of 3.333 Å. The hydrogen-bonding patterns are similar for each mol­ecule, i.e. intra­molecular N-H...O, as well as inter­molecular N-H...O and C-H...N(pyrazole), bonds are present.

yearjournalcountryeditionlanguage
2006-08-04Acta Crystallographica Section E-Structure Reports Online
10.1107/s1600536806029515https://onlinelibrary.wiley.com/iucr/doi/10.1107/S1600536806029515