38 research outputs found

    2,3-Diamino­pyridinium 3-amino­benzoate

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    In the title salt, C5H8N3 +·C7H6NO2 −, the pyridine N atom of the 2,3-diamino­pyridine mol­ecule is protonated. The proton­ated N atom and one of the two N atoms of the 2-amino groups are hydrogen bonded to the 3-amino­benzoate anion through a pair of N—H⋯O hydrogen bonds, forming an R 2 2(8) ring motif. The carboxyl­ate mean plane of the 3-amino­benzoate anion is twisted by 8.81 (7)° from the attached ring. The crystal structure is further stabilized by π–π inter­actions [centroid–centroid distance 3.6827 (7) Å]

    6-Amino-3,4-dimethyl-1,2,4-triazin-1-ium 2-anilinobenzoate–3-amino-5,6-dimethyl-1,2,4- triazine (1/1)

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    In the title molecular salt, C5H9N4 + C13H10NO2 C5H8N4, the asymmetric unit consists of a 6-amino-3,4-dimethyl-1,2,4-triazin-1-ium cation, a 2-anilinobenzoate anion and a neutral 3-amino-5,6-dimethyl-1,2,4-triazine molecule. The typical intramolecular NH—O hydrogen bond is observed in the 2-anilinobenzoate anion. In the crystal, the protonated N atom and the 3-amino group are hydrogen bonded to the carboxylate oxygen atoms via a pair of N—HO hydrogen bonds, forming an R2 2 (8) ring motif. These motifs are further linked with adjacent neutral 3-amino-5,6-dimethyl-1,2,4-triazine molecules by N—HO and N—HN hydrogen bonds to produce centrosymmetric sixmembered units, enclosing R2 2(8) and R3 4(9) ring motifs. They are reinforced by a C—HN hydrogen bond and stack up the b-axis direction

    Bis(2,3-diamino­pyridinium) succinate trihydrate

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    In the title salt, 2C5H8N3 +·C4H4O4 2−·3H2O, the asymmetric unit contains a protonated 2,3-diamino­pyridinium cation, half of a succinate dianion (disposed about a centre of inversion), and one and a half water mol­ecules. One of the water mol­ecules is disordered over two sites with occupancies of 0.670 (17) and 0.330 (17). The other water mol­ecule has an occupancy of 0.5 (from refinement). The pyridine N atom of the 2,3-diamino­pyridine mol­ecule is protonated. The protonated N atom and one of the 2-amino H atoms are hydrogen bonded to the succinate anion through a pair of N—H⋯O hydrogen bonds, forming an R 2 2(8) ring motif. In the crystal, mol­ecules are consolidated into a three-dimensional network by N—H⋯O and O—H⋯O inter­actions

    2,3-Diamino­pyridinium 4-nitro­benzoate

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    In the title salt, C5H8N3 +·C7H4NO4 −, the pyridine N atom of the 2,3-diamino­pyridine mol­ecule is protonated. The protonated N atom and one of the two 2-amino groups are hydrogen bonded to the 4-nitro­benzoate anion through a pair of N—H⋯O hydrogen bonds, forming an R 2 2(8) ring motif. The carboxyl­ate mean plane of the 4-nitro­benzoate anion is twisted by 3.77 (5)° from the attached ring and the nitro group is similarly twisted by 2.28 (10)°. In the crystal, the mol­ecules are linked by N—H⋯O and C—H⋯O inter­actions into sheets parallel to (100)

    2,3-Diamino­pyridinium 4-hydroxy­benzoate

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    In the title compound, C5H8N3 +·C7H5O3 −, the pyridine N atom is protonated. In the 4-hydroxy­benzoate anion, the carboxyl­ate group is twisted slightly out of the benzene ring plane by an angle of 3.77 (5)°. The protonated N atom and one of the two amino groups are hydrogen-bonded to the 4-hydroxy­benzoate anion through a pair of N—H⋯O hydrogen bonds, forming an R 2 2(8) ring motif. The crystal structure is further stabilized by O—H⋯O and C—H⋯O hydrogen bonds and π–π inter­actions involving the pyridinium rings [centroid–centroid distance of 3.6277 (5) Å], leading to the formation of a three-dimensional network

    Crystal structure and Hirshfeld surface analysis of 2-amino-4-methoxy-6-methylpyrimidinium 2-hydroxybenzoate

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    In the title molecular salt, C6H10N3O+C7H5O3, the cation is protonated at the N atom lying between the amine and methyl substituents and the dihedral angle between the carboxyl group and its attached ring in the anion is 4.0 (2)�. The anion features an intramolecular O—HO hydrogen bond, which closes an S(6) ring. The cation and anion are linked by two N—HO hydrogen bonds [R2 2 (8) motif] to generate an ion pair in which the dihedral angle between the aromatic rings is 8.34 (9)�. Crystal symmetry relates two ion pairs bridged by further N—HO hydrogen bonds into a tetrameric DDAA array. The tetramers are linked by pairs of C—HO hydrogen bonds to generate [100] chains. Hirshfeld surface and fingerprint plot analyses are presented

    Crystal structure of 2,4-diamino-7-(hydroxymethyl)pteridin-1-ium nitrate

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    In the crystal of the title molecular salt, C7H9N6O+ NO3, the cations and anions are linked via N—HO and O—HO hydrogen bonds, forming sheets parallel to (100). Within the sheets there are numerous hydrogen-bonding ring motifs

    (1Z)-1-(2,4-Dichloro­phen­yl)ethan-1-one semicarbazone

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    In the title compound, C9H9Cl2N3O, the semicarbazone group is approximately planar, with an r.m.s deviation from the mean plane of 0.011 (2) Å. The dihedral angle between the least-squares planes through the semicarbazone group and the benzene ring is 38.76 (9)°. The crystal structure is further stabilized by N—H⋯O and C—H⋯O hydrogen bonding

    2,6-Diamino-4-chloropyrimidinium 4-carboxybutanoate

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    In the title molecular salt, C4H6ClN4+.C5H7O4 -, the cation is essentially planar, with a maximum deviation of 0.037 (1) A ° for all non-H atoms. The anions are self-assembled through O—H...O hydrogen bonds, forming a supramolecular zigzag chain with graph-set notation C(8). In the crystal, the protonated N atom and the 2-amino group of the cation are hydrogen bonded to the carboxylate O atoms of the anion via a pair of N—H...O hydrogen bonds with an R2 2(8) ring motif. This motif further self-organizes through N—H...O and O—H...O hydrogen bonds, generating an array of six hydrogen bonds, the rings having graph-set notation R3 2(8), R2 2(8), R4 2(8), R2 2(8) and R3 2(8). In addition, another type of R2 2(8) motif is formed by inversion-related pyrimidinium cations via N—H...N hydrogen bonds, forming a two-dimensional network parallel to (101)

    3,4-Diamino­pyridinium hydrogen succinate

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    In the title compound, C5H8N3 +·C4H5O4 −, the pyridine N atom of the 3,4-diamino­pyridine mol­ecule is protonated. The protonated N atom participates in an N—H⋯O hydrogen bond to a succinate O atom of the singly deprotonated succinate anion. Each of the two amino groups are hydrogen-bonded to the O atoms of two different sets of succinate groups.. The crystal structure is further stabilized by O—H⋯O and C—H⋯O hydrogen bonds
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