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1.
Kaliyaperumal Thanigaimani Annamalai Subashini Packianathan Thomas Muthiah Daniel E. Lynch Ray J. Butcher 《Acta Crystallographica. Section C, Structural Chemistry》2009,65(2):o42-o45
In the crystal structures of 2‐amino‐4,6‐dimethoxypyrimidinium 2,4,6‐trinitrophenolate (picrate), C6H10N3O2+·C6H2N3O7−, (I), and 2,4‐diamino‐5‐(4‐chlorophenyl)‐6‐ethylpyrimidin‐1‐ium (pyrimethaminium or PMN) picrate dimethyl sulfoxide solvate, C12H14ClN4+·C6H2N3O7−·C2H6OS, (II), the 2‐amino‐4,6‐dimethoxypyrimidine and PMN cations are protonated at one of the pyrimidine N atoms. The picrate anion interacts with the protonated cations through bifurcated N—H...O hydrogen bonds, forming R21(6) and R12(6) ring motifs. In (I), Z′ = 2. In (II), two inversion‐related PMN cations are connected through a pair of N—H...N hydrogen bonds involving the 4‐amino group and the uncharged N atom of the pyrimidine ring, forming a cyclic hydrogen‐bonded R22(8) motif. In addition to the pairing, the O atom of the dimethyl sulfoxide solvent molecule bridges the 2‐amino and 4‐amino groups on both sides of the paired bases, resulting in a self‐complementary …DADA… array of quadruple hydrogen‐bonding patterns. 相似文献
2.
《Acta Crystallographica. Section C, Structural Chemistry》2018,74(3):325-331
Aminopyrimidine derivatives are biologically important as they are components of nucleic acids and drugs. The crystals of two new salts, namely cytosinium 6‐chloronicotinate monohydrate, C4H6N3O+·C6H3ClNO2−·H2O, ( I ), and 5‐bromo‐6‐methylisocytosinium hydrogen sulfate (or 2‐amino‐5‐bromo‐4‐oxo‐6‐methylpyrimidinium hydrogen sulfate), C5H7BrN3O+·HSO4−, ( II ), have been prepared and characterized by single‐crystal X‐ray diffraction. The pyrimidine ring of both compounds is protonated at the imine N atom. In hydrated salt ( I ), the primary R22(8) ring motif (supramolecular heterosynthon) is formed via a pair of N—H…O(carboxylate) hydrogen bonds. The cations, anions and water molecule are hydrogen bonded through N—H…O, N—H…N, O—H…O and C—H…O hydrogen bonds, forming R22(8), R32(7) and R55(21) motifs, leading to a hydrogen‐bonded supramolecular sheet structure. The supramolecular double sheet structure is formed via water–carboxylate O—H…O hydrogen bonds and π–π interactions between the anions and the cations. In salt ( II ), the hydrogen sulfate ions are linked via O—H…O hydrogen bonds to generate zigzag chains. The aminopyrimidinium cations are embedded between these zigzag chains. Each hydrogen sulfate ion bridges two cations via pairs of N—H…O hydrogen bonds and vice versa, generating two R22(8) ring motifs (supramolecular heterosynthon). The cations also interact with one another via halogen–halogen (Br…Br) and halogen–oxygen (Br…O) interactions. 相似文献
3.
《Acta Crystallographica. Section C, Structural Chemistry》2018,74(4):487-503
Nine salts of the antifolate drugs trimethoprim and pyrimethamine, namely, trimethoprimium [or 2,4‐diamino‐5‐(3,4,5‐trimethoxybenzyl)pyrimidin‐1‐ium] 2,5‐dichlorothiophene‐3‐carboxylate monohydrate (TMPDCTPC, 1:1), C14H19N4O3+·C5HCl2O2S−, ( I ), trimethoprimium 3‐bromothiophene‐2‐carboxylate monohydrate, (TMPBTPC, 1:1:1), C14H19N4O3+·C5H2BrO2S−·H2O, ( II ), trimethoprimium 3‐chlorothiophene‐2‐carboxylate monohydrate (TMPCTPC, 1:1:1), C14H19N4O3+·C5H2ClO2S−·H2O, ( III ), trimethoprimium 5‐methylthiophene‐2‐carboxylate monohydrate (TMPMTPC, 1:1:1), C14H19N4O3+·C6H5O2S−·H2O, ( IV ), trimethoprimium anthracene‐9‐carboxylate sesquihydrate (TMPAC, 2:2:3), C14H19N4O3+·C15H9O2−·1.5H2O, ( V ), pyrimethaminium [or 2,4‐diamino‐5‐(4‐chlorophenyl)‐6‐ethylpyrimidin‐1‐ium] 2,5‐dichlorothiophene‐3‐carboxylate (PMNDCTPC, 1:1), C12H14ClN4+·C5HCl2O2S−, ( VI ), pyrimethaminium 5‐bromothiophene‐2‐carboxylate (PMNBTPC, 1:1), C12H14ClN4+·C5H2BrO2S−, ( VII ), pyrimethaminium anthracene‐9‐carboxylate ethanol monosolvate monohydrate (PMNAC, 1:1:1:1), C12H14ClN4+·C15H9O2−·C2H5OH·H2O, ( VIII ), and bis(pyrimethaminium) naphthalene‐1,5‐disulfonate (PMNNSA, 2:1), 2C12H14ClN4+·C10H6O6S22−, ( IX ), have been prepared and characterized by single‐crystal X‐ray diffraction. In all the crystal structures, the pyrimidine N1 atom is protonated. In salts ( I )–( III ) and ( VI )–( IX ), the 2‐aminopyrimidinium cation interacts with the corresponding anion via a pair of N—H…O hydrogen bonds, generating the robust R22(8) supramolecular heterosynthon. In salt ( IV ), instead of forming the R22(8) heterosynthon, the carboxylate group bridges two pyrimidinium cations via N—H…O hydrogen bonds. In salt ( V ), one of the carboxylate O atoms bridges the N1—H group and a 2‐amino H atom of the pyrimidinium cation to form a smaller R21(6) ring instead of the R22(8) ring. In salt ( IX ), the sulfonate O atoms mimic the role of carboxylate O atoms in forming an R22(8) ring motif. In salts ( II )–( IX ), the pyrimidinium cation forms base pairs via a pair of N—H…N hydrogen bonds, generating a ring motif [R22(8) homosynthon]. Compounds ( II ) and ( III ) are isomorphous. The quadruple DDAA (D = hydrogen‐bond donor and A = hydrogen‐bond acceptor) array is observed in ( I ). In salts ( II )–( IV ) and ( VI )–( IX ), quadruple DADA arrays are present. In salts ( VI ) and ( VII ), both DADA and DDAA arrays co‐exist. The crystal structures are further stabilized by π–π stacking interactions [in ( I ), ( V ) and ( VII )–( IX )], C—H…π interactions [in ( IV )–( V ) and ( VII )–( IX )], C—Br…π interactions [in ( II )] and C—Cl…π interactions [in ( I ), ( III ) and ( VI )]. Cl…O and Cl…Cl halogen‐bond interactions are present in ( I ) and ( VI ), with distances and angles of 3.0020 (18) and 3.5159 (16) Å, and 165.56 (10) and 154.81 (11)°, respectively. 相似文献
4.
Kaliyaperumal Thanigaimani Periasamy Devi Packianathan Thomas Muthiah Daniel E. Lynch Ray J. Butcher 《Acta Crystallographica. Section C, Structural Chemistry》2010,66(7):o324-o328
In 2,4‐diamino‐6‐methyl‐1,3,5‐triazin‐1‐ium (acetoguanaminium) hydrogen phthalate, C4H8N5+·C8H5O4−, (I), acetoguanaminium hydrogen maleate, C4H8N5+·C4H3O4−, (II), and acetoguanaminium 3‐hydroxypicolinate monohydrate, C4H8N5+·C6H4NO3−·H2O, (III), the acetoguanaminium cations interact with the carboxylate groups of the corresponding anions via a pair of nearly parallel N—H...O hydrogen bonds, forming R22(8) ring motifs. In (II) and (III), N—H...N base‐pairing is observed, while there is none in (I). In (II), a series of fused R32(8), R22(8) and R32(8) hydrogen‐bonded rings plus fused R22(8), R62(12) and R22(8) ring motifs occur alternately, aggregating into a supramolecular ladder‐like arrangement. In (III), R22(8) motifs occur on either side of a further ring formed by pairs of N—H...O hydrogen bonds, forming an array of three fused hydrogen‐bonded rings. In (I) and (II), the anions form a typical intramolecular O—H...O hydrogen bond with graph set S(7), whereas in (III) an intramolecular hydrogen bond with graph set S(6) is formed. 相似文献
5.
Madhukar Hemamalini Packianathan Thomas Muthiah Gabriele Bocelli Andrea Cantoni 《Acta Crystallographica. Section C, Structural Chemistry》2004,60(4):o284-o286
In the title compound, C10H9N2+·C9H5INO4S−·2H2O, the 4,4′‐bipyridine molecule is protonated at one of the pyridine N atoms. These moieties self‐assemble into a supramolecular chain along the a axis through N—H⋯N hydrogen bonds. The quinolinol OH group acts as a donor with respect to a sulfonate O atom [O—H⋯O(sulfonate)] and acts as an acceptor with respect to a C—H group of ferron [C—H⋯O(hydroxy)], forming a supramolecular chain along the b axis. These two types of supramolecular chains (one type made up of bipyridine motifs and the other made up of sulfoxine motifs) interact viaπ–π stacking, generating a three‐dimensional framework. These chains are further crosslinked by C—H⋯O hydrogen bonds and O—H⋯O hydrogen bonds involving water molecules. 相似文献
6.
Genivaldo Julio Perptuo Jan Janczak 《Acta Crystallographica. Section C, Structural Chemistry》2010,66(4):o225-o228
Crystals of 5‐chloropyridin‐2‐amine–(2E)‐but‐2‐enedioate (2/1), 2C5H5ClN2·C4H4O4, (I), and 2‐aminopyridinium dl ‐3‐carboxy‐2‐hydroxypropanoate, C5H7N2+·C4H5O5−, (II), are built from the neutral 5‐chloropyridin‐2‐amine molecule and fumaric acid in the case of (I) and from ring‐N‐protonated 2‐aminopyridinium cations and malate anions in (II). The fumaric acid molecule lies on an inversion centre. In (I), the neutral 5‐chloropyridin‐2‐amine and fumaric acid molecules interact via hydrogen bonds, forming two‐dimensional layers parallel to the (100) plane, whereas in (II), oppositely charged units interact via ionic and hydrogen bonds, forming a three‐dimensional network. 相似文献
7.
The title salts, 4‐chloroanilinium hydrogen phthalate (PCAHP), C6H7ClN+·C8H5O4−, 2‐hydroxyanilinium hydrogen phthalate (2HAHP), C6H8NO+·C8H5O4−, and 3‐hydroxyanilinium hydrogen phthalate (3HAHP), C6H8NO+·C8H5O4−, all crystallize in the space group P21/c. The asymmetric unit of 2HAHP contains two independent ion pairs. The hydrogen phthalate ions of 2HAHP and 3HAHP show a short intramolecular O—H...O hydrogen bond, with O...O distances ranging from 2.3832 (15) to 2.3860 (14) Å. N—H...O and O—H...O hydrogen bonds, together with short C—H...O contacts in PCAHP and 3HAHP, generate extended hydrogen‐bond networks. PCAHP forms a two‐dimensional supramolecular sheet extending in the (100) plane, whereas 2HAHP has a supramolecular chain running parallel to the [100] direction and 3HAHP has a two‐dimensional network extending parallel to the (001) plane. 相似文献
8.
D. Sathya R. Jagan R. Padmavathy R. Mohan Kumar K. Sivakumar 《Acta Crystallographica. Section C, Structural Chemistry》2013,69(8):904-909
In bis(2‐aminoanilinum) fumarate, 2C6H9N2+·C4H2O42−, (I), the asymmetric unit consists of two aminoanilinium cations and one fumarate dianion, whereas in 3‐methylanilinium hydrogen fumarate, C7H10N+·C4H3O4−, (II), and 4‐chloroanilinium hydrogen fumarate, C6H7ClN+·C4H3O4−, (III), the asymmetric unit contains two symmetry‐independent hydrogen fumate anions and anilinium cations with a slight difference in their geometric parameters; the two salts are isostructural. In (II) and (III), the carboxylic acid H atoms of the anions are disordered across both ends of the anion, with equal site occupancies of 0.50. Both the 4‐chloroanilinium cations of (III) are disordered over two orientations with major occupancies fixed at 0.60 in each case. The hydrogen fumarate anions of (II) and (III) form one‐dimensional anionic chains linked through O—H...O hydrogen bonds. Salts (II) and (III) form two‐dimensional supramolecular sheets built from R44(16), R44(18), R55(25) and C22(14) motifs extending parallel to the (010) plane, whereas in (I), an (010) sheet is formed built from two R43(13) motifs, two R22(9) motifs and an R44(18) motif. 相似文献
9.
《Acta Crystallographica. Section C, Structural Chemistry》2017,73(7):536-540
Two new salts, namely 2,6‐diamino‐4‐chloropyrimidinium 2‐carboxy‐3‐nitrobenzoate, C4H6ClN4+·C8H4NO6−, (I), and 2,6‐diamino‐4‐chloropyrimidinium p‐toluenesulfonate monohydrate, C4H6ClN4+·C7H7O3S−·H2O, (II), have been synthesized and characterized by single‐crystal X‐ray diffraction. In both crystal structures, the N atom in the 1‐position of the pyrimidine ring is protonated. In salt (I), the protonated N atom and the amino group of the pyrimidinium cation interact with the carboxylate group of the anion through N—H…O hydrogen bonds to form a heterosynthon with an R 22(8) ring motif. In hydrated salt (II), the presence of the water molecule prevents the formation of the familiar R 22(8) ring motif. Instead, an expanded ring [i.e. R 32(8)] is formed involving the sulfonate group, the pyrimidinium cation and the water molecule. Both salts form a supramolecular homosynthon [R 22(8) ring motif] through N—H…N hydrogen bonds. The molecular structures are further stabilized by π–π stacking, and C=O…π, C—H…O and C—H…Cl interactions. 相似文献
10.
Balasubramanian Sridhar Krishnan Ravikumar 《Acta Crystallographica. Section C, Structural Chemistry》2008,64(10):o566-o569
In cytosinium succinate (systematic name: 4‐amino‐2‐oxo‐2,3‐dihydropyrimidin‐1‐ium 3‐carboxypropanoate), C4H6N3O+·C4H5O4−, (I), the cytosinium cation forms one‐dimensional self‐assembling patterns by intermolecular N—H...O hydrogen bonding, while in cytosinium 4‐nitrobenzoate cytosine monohydrate [systematic name: 4‐amino‐2‐oxo‐2,3‐dihydropyrimidin‐1‐ium 4‐nitrobenzoate 4‐aminopyrimidin‐2(1H)‐one solvate monohydrate], C4H6N3O+·C7H4NO4−·C4H5N3O·H2O, (II), the cytosinium–cytosine base pair, held together by triple hydrogen bonds, leads to one‐dimensional polymeric ribbons via double N—H...O hydrogen bonds. This study illustrates clearly the different alignment of cytosine molecules in the crystal packing and their ability to form supramolecular hydrogen‐bonded networks with the anions. 相似文献
11.
Ping‐ping Shi Li Zhang Qiong Ye 《Acta Crystallographica. Section C, Structural Chemistry》2012,68(7):o266-o269
Mixtures of 4‐carboxypyridinium perchlorate or 4‐carboxypyridinium tetrafluoroborate and 18‐crown‐6 (1,4,7,10,13,16‐hexaoxacyclooctadecane) in ethanol and water solution yielded the title supramolecular salts, C6H6NO2+·ClO4−·C12H24O6·2H2O and C6H6NO2+·BF4−·C12H24O6·2H2O. Based on their similar crystal symmetries, unit cells and supramolecular assemblies, the salts are essentially isostructural. The asymmetric unit in each structure includes one protonated isonicotinic acid cation and one crown ether molecule, which together give a [(C6H6NO2)(18‐crown‐6)]+ supramolecular cation. N—H...O hydrogen bonds between the protonated N atoms and a single O atom of each crown ether result in the 4‐carboxypyridinium cations `perching' on the 18‐crown‐6 molecules. Further hydrogen‐bonding interactions involving the supramolecular cation and both water molecules form a one‐dimensional zigzag chain that propagates along the crystallographic c direction. O—H...O or O—H...F hydrogen bonds between one of the water molecules and the anions fix the anion positions as pendant upon this chain, without further increasing the dimensionality of the supramolecular network. 相似文献
12.
Dominik Cin
i Branko Kaitner 《Acta Crystallographica. Section C, Structural Chemistry》2008,64(2):o101-o104
In the title compounds, C7H8NO2+·Br−, (I), and C7H8NO2+·I−, (II), the asymmetric unit contains a discrete 3‐carboxyanilinium cation, with a protonated amine group, and a halide anion. The compounds are not isostructural, and the crystal structures of (I) and (II) are characterized by different two‐dimensional hydrogen‐bonded networks. The ions in (I) are connected into ladder‐like ribbons via N—H...Br hydrogen bonds, while classic cyclic O—H...O hydrogen bonds between adjacent carboxylic acid functions link adjacent ribbons to give three characteristic graph‐set motifs, viz. C21(4), R42(8) and R22(8). The ions in (II) are connected via N—H...I, N—H...O and O—H...I hydrogen bonds, also with three characteristic graph‐set motifs, viz. C(7), C21(4) and R42(18), but an O—H...O interaction is not present. 相似文献
13.
Genivaldo Júlio Perptuo Jan Janczak 《Acta Crystallographica. Section C, Structural Chemistry》2007,63(5):o271-o273
Crystals of the title compound, C4H8N5+·C2F3O2−, are built up of singly protonated 2,4‐diamino‐6‐methyl‐1,3,5‐triazin‐1‐ium cations and trifluoroacetate anions. The CF3 group of the anion is disordered. The oppositely charged ions interact via almost linear N—H...O hydrogen bonds, forming a CF3COO−...C4H8N5+ unit. Two units related by an inversion centre interact through a pair of N—H...N hydrogen bonds, forming planar (CF3COO−...C4H8N5+...C4H8N5+·CF3COO−) aggregates that are linked by a pair of N—H...O hydrogen bonds into chains running along the c axis. 相似文献
14.
Madhukar Hemamalini Packianathan Thomas Muthiah Urszula Rychlewska Agnieszka Plutecka 《Acta Crystallographica. Section C, Structural Chemistry》2005,61(2):o95-o97
In the title compound, C6H10N3+·HSO4−, the asymmetric unit consists of a hydrogen sulfate anion and a 2‐amino‐4,6‐dimethylpyrimidinium cation. The hydrogen sulfate anions self‐assemble through O—H⋯O hydrogen bonds, forming supramolecular chains along the b axis, while the organic cations form base pairs via N—H⋯N hydrogen bonds. The aminopyrimidinium cations join to the sulfate anions via a pair of hydrogen bonds donated from the pyrimidinium protonation site and from the exo amine group cis to the protonated site. 相似文献
15.
Alexander Briceo Reinaldo Atencio Raquel Gil Alejandra Nobrega 《Acta Crystallographica. Section C, Structural Chemistry》2007,63(8):o441-o444
The structure of trans‐3‐(3‐pyridyl)acrylic acid, C8H7NO2, (I), possesses a two‐dimensional hydrogen‐bonded array of supramolecular ribbons assembled via heterodimeric synthons between the pyridine and carboxyl groups. This compound is photoreactive in the solid state as a result of close contacts between the double bonds of neighbouring molecules [3.821 (1) Å] along the a axis. The crystal structure of the photoproduct, rctt‐3,3′‐(3,4‐dicarboxycyclobutane‐1,2‐diyl)dipyridinium dichloride, C16H16N2O42+·2Cl−, (II), consists of a three‐dimensional hydrogen‐bonded network built from crosslinking of helical chains integrated by self‐assembly of dipyridinium cations and Cl− anions via different O—H...Cl, C—H...Cl and N+—H...Cl hydrogen‐bond interactions. 相似文献
16.
Magdalena Wilk Jan Janczak Veneta Videnova‐Adrabinska 《Acta Crystallographica. Section C, Structural Chemistry》2012,68(9):o351-o354
The asymmetric unit of the title compound, 3C10H12N22+·2C10H11N2+·8C6H5NO5P−, contains one and a half naphthalene‐1,5‐diaminium cations, in which the half‐molecule has inversion symmetry, one 5‐aminonaphthalen‐1‐aminium cation and four hydrogen (5‐carboxypyridin‐3‐yl)phosphonate anions. The crystal structure is layered and consists of hydrogen‐bonded anionic monolayers between which the cations are arranged. The acid monoanions are organized into one‐dimensional chains along the [101] direction via hydrogen bonds established between the phosphonate sites. (C)O—H...Npy hydrogen bonds (py is pyridine) crosslink the chains to form an undulating (010) monolayer. The cations serve both to balance the charge of the anionic network and to connect neighbouring layers via multiple hydrogen bonds to form a three‐dimensional supramolecular architecture. 相似文献
17.
Rafal Kruszynski Agata Trzesowska‐Kruszynska 《Acta Crystallographica. Section C, Structural Chemistry》2010,66(9):o449-o454
In the title compounds, C7H6ClN2O+·NO3− and C7H6ClN2O+·ClO4−, the ions are connected by N—H...O hydrogen bonds and halogen interactions. Additionally, in the first compound, co‐operative π–π stacking and halogen...π interactions are observed. The energies of the observed interactions range from a value typical for very weak interactions (1.80 kJ mol−1) to one typical for mildly strong interactions (53.01 kJ mol−1). The iminium cations exist in an equilibrium form intermediate between exo‐ and endocyclic. This study provides structural insights relevant to the biochemical activity of 2‐amino‐5‐chloro‐1,3‐benzoxazole compounds. 相似文献
18.
Xue‐qun Fu Yong‐le Yang Qiong Ye 《Acta Crystallographica. Section C, Structural Chemistry》2010,66(8):o433-o435
In the structure of the complex of dibenzo‐18‐crown‐6 [systematic name: 2,5,8,15,18,21‐hexaoxatricyclo[20.4.0.09,14]hexacosa‐1(26),9,11,13,22,24‐hexaene] with 4‐methoxyanilinium tetrafluoroborate, C7H10NO+·BF4−·C20H24O6, the protonated 4‐methoxyanilinium (MB‐NH3+) cation forms a 1:1 supramolecular rotator–stator complex with the dibenzo‐18‐crown‐6 molecule via N—H...O hydrogen bonds. The MB‐NH3+ group is attached from the convex side of the bowl‐shaped crown, in contrast with similar ammonium cations that nest in the curvature of the bowl. The cations are associated via C—H...π interactions, while the cations and anions are linked by weak C—H...F hydrogen bonds, forming cation–crown–anion chains parallel to [011]. 相似文献
19.
Dominik Cin
i Branko Kaitner 《Acta Crystallographica. Section C, Structural Chemistry》2008,64(10):o561-o565
In the title compounds, namely 3‐acetylanilinium bromide, C8H10NO+·Br−, (I), 3‐acetylanilinium nitrate, C8H10NO+·NO3−, (II), and 3‐acetylanilinium dihydrogen phosphate, C8H10NO+·H2PO4−, (III), each asymmetric unit contains a discrete cation, with a protonated amino group, and an anion. In the crystal structure of (I), the ions are connected via N—H...Br and N—H...O hydrogen bonds into a chain of spiro‐fused R22(14) and R24(8) rings. In compound (II), the non‐H atoms of the cation all lie on a mirror plane in the space group Pnma, while the nitrate ion lies across a mirror plane. The crystal structures of compounds (II) and (III) are characterized by hydrogen‐bonded networks in two and three dimensions, respectively. The ions in (II) are connected via N—H...O hydrogen bonds, with three characteristic graph‐set motifs, viz.C22(6), R21(4) and R46(14). The ions in (III) are connected via N—H...O and O—H...O hydrogen bonds, with five characteristic graph‐set motifs, viz.D, C(4), C12(4), R33(10) and R44(12). The significance of this study lies in its illustration of the differences between the supramolecular aggregations in the bromide, nitrate and dihydrogen phosphate salts of a small organic molecule. The different geometry of the counter‐ions and their different potential for hydrogen‐bond formation result in markedly different hydrogen‐bonding arrangements. 相似文献
20.
Dominik Cin
i Branko Kaitner 《Acta Crystallographica. Section C, Structural Chemistry》2008,64(4):o226-o229
In the title compounds, 4‐carboxyanilinium bromide, C7H8NO2+·Br−, (I), and 4‐acetylanilinium bromide, C8H10NO+·Br−, (II), each asymmetric unit contains a discrete cation with a protonated amino group and a halide anion. Both crystal structures are characterized by two‐dimensional hydrogen‐bonded networks. The ions in (I) are connected via N—H...Br, N—H...O and O—H...Br hydrogen bonds, with three characteristic graph‐set motifs, viz. C(8), C21(4) and R32(8). The centrosymmetric hydrogen‐bonded R22(8) dimer motif characteristic of carboxylic acids is absent. The ions in (II) are connected via N—H...Br and N—H...O hydrogen bonds, with two characteristic graph‐set motifs, viz. C(8) and R42(8). The significance of this study lies in its illustration of the differences between the supramolecular aggregations in two similar compounds. The presence of the methyl group in (II) at the site corresponding to the hydroxyl group in (I) results in a significantly different hydrogen‐bonding arrangement. 相似文献