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Crystal structure of a 1 : 1 salt of 4-aminobenzoic acid (Vitamin B₁₀) with pyrazinoic acid. / Drozd, K. V.; Arkhipov, S. G.; Boldyrevab, E. V. et al.

In: Acta Crystallographica Section E: Crystallographic Communications, Vol. 74, No. Pt 12, 01.12.2018, p. 1923-1927.

Research output: Contribution to journal › Article › peer-review

Harvard

Drozd, KV, Arkhipov, SG, Boldyrevab, EV & Perlovich, GL 2018, 'Crystal structure of a 1: 1 salt of 4-aminobenzoic acid (Vitamin B₁₀) with pyrazinoic acid', Acta Crystallographica Section E: Crystallographic Communications, vol. 74, no. Pt 12, pp. 1923-1927. https://doi.org/10.1107/S2056989018016663

APA

Drozd, K. V., Arkhipov, S. G., Boldyrevab, E. V., & Perlovich, G. L. (2018). Crystal structure of a 1: 1 salt of 4-aminobenzoic acid (Vitamin B₁₀) with pyrazinoic acid. Acta Crystallographica Section E: Crystallographic Communications, 74(Pt 12), 1923-1927. https://doi.org/10.1107/S2056989018016663

Vancouver

Drozd KV, Arkhipov SG, Boldyrevab EV, Perlovich GL. Crystal structure of a 1: 1 salt of 4-aminobenzoic acid (Vitamin B₁₀) with pyrazinoic acid. Acta Crystallographica Section E: Crystallographic Communications. 2018 Dec 1;74(Pt 12):1923-1927. doi: 10.1107/S2056989018016663

Author

Drozd, K. V. ; Arkhipov, S. G. ; Boldyrevab, E. V. et al. / Crystal structure of a 1 : 1 salt of 4-aminobenzoic acid (Vitamin B₁₀) with pyrazinoic acid. In: Acta Crystallographica Section E: Crystallographic Communications. 2018 ; Vol. 74, No. Pt 12. pp. 1923-1927.

BibTeX

@article{15b70c400e22419ea442452e58d6dc62,

title = "Crystal structure of a 1: 1 salt of 4-aminobenzoic acid (Vitamin B10) with pyrazinoic acid",

abstract = "The title 1:1 salt, C7H8NO2 +·C5H3N2O2 - (systematic name: 4-carboxyanilinium pyrazine-2-carboxylate), was synthesized successfully by slow evaporation of a saturated solution from water-ethanol (1:1 v/v) mixture and characterized by X-ray diffraction (SCXRD, PXRD) and calorimetry (DSC). The crystal structure of the salt was solved and refined at 150 and 293 K. The salt crystallizes with one molecule of 4-aminobenzoic acid (PABA) and one molecule of pyrazinoic acid (POA) in the asymmetric unit. In the crystal, the PABA and POA molecules are associated via COOH⋯Narom heterosynthons, which are connected by N - H⋯O hydrogen bonds, creating zigzag chains. The chains are further linked by N - H⋯O hydrogen bonds and π-π stacking interactions along the b axis [centroid-to-centroid distances = 3.7377 (13) and 3.8034 (13) {\AA} at 150 and 293 K, respectively] to form a layered three-dimensional structure.",

keywords = "4-aminobenzoic acid, crystal structure, hydrogen bonding, melting point, pyrazinoic acid, salt, STABILITY, PH, PARA-AMINOBENZOIC ACID, COCRYSTAL, SOLUBILITY",

author = "Drozd, {K. V.} and Arkhipov, {S. G.} and Boldyrevab, {E. V.} and Perlovich, {G. L.}",

year = "2018",

month = dec,

day = "1",

doi = "10.1107/S2056989018016663",

language = "English",

volume = "74",

pages = "1923--1927",

journal = "Acta Crystallographica Section E: Crystallographic Communications",

issn = "2056-9890",

publisher = "International Union of Crystallography",

number = "Pt 12",

}

RIS

TY - JOUR

T1 - Crystal structure of a 1

T2 - 1 salt of 4-aminobenzoic acid (Vitamin B10) with pyrazinoic acid

AU - Drozd, K. V.

AU - Arkhipov, S. G.

AU - Boldyrevab, E. V.

AU - Perlovich, G. L.

PY - 2018/12/1

Y1 - 2018/12/1

N2 - The title 1:1 salt, C7H8NO2 +·C5H3N2O2 - (systematic name: 4-carboxyanilinium pyrazine-2-carboxylate), was synthesized successfully by slow evaporation of a saturated solution from water-ethanol (1:1 v/v) mixture and characterized by X-ray diffraction (SCXRD, PXRD) and calorimetry (DSC). The crystal structure of the salt was solved and refined at 150 and 293 K. The salt crystallizes with one molecule of 4-aminobenzoic acid (PABA) and one molecule of pyrazinoic acid (POA) in the asymmetric unit. In the crystal, the PABA and POA molecules are associated via COOH⋯Narom heterosynthons, which are connected by N - H⋯O hydrogen bonds, creating zigzag chains. The chains are further linked by N - H⋯O hydrogen bonds and π-π stacking interactions along the b axis [centroid-to-centroid distances = 3.7377 (13) and 3.8034 (13) Å at 150 and 293 K, respectively] to form a layered three-dimensional structure.

AB - The title 1:1 salt, C7H8NO2 +·C5H3N2O2 - (systematic name: 4-carboxyanilinium pyrazine-2-carboxylate), was synthesized successfully by slow evaporation of a saturated solution from water-ethanol (1:1 v/v) mixture and characterized by X-ray diffraction (SCXRD, PXRD) and calorimetry (DSC). The crystal structure of the salt was solved and refined at 150 and 293 K. The salt crystallizes with one molecule of 4-aminobenzoic acid (PABA) and one molecule of pyrazinoic acid (POA) in the asymmetric unit. In the crystal, the PABA and POA molecules are associated via COOH⋯Narom heterosynthons, which are connected by N - H⋯O hydrogen bonds, creating zigzag chains. The chains are further linked by N - H⋯O hydrogen bonds and π-π stacking interactions along the b axis [centroid-to-centroid distances = 3.7377 (13) and 3.8034 (13) Å at 150 and 293 K, respectively] to form a layered three-dimensional structure.

KW - 4-aminobenzoic acid

KW - crystal structure

KW - hydrogen bonding

KW - melting point

KW - pyrazinoic acid

KW - salt

KW - STABILITY

KW - PH

KW - PARA-AMINOBENZOIC ACID

KW - COCRYSTAL

KW - SOLUBILITY

UR - http://www.scopus.com/inward/record.url?scp=85058009433&partnerID=8YFLogxK

U2 - 10.1107/S2056989018016663

DO - 10.1107/S2056989018016663

M3 - Article

C2 - 30574402

AN - SCOPUS:85058009433

VL - 74

SP - 1923

EP - 1927

JO - Acta Crystallographica Section E: Crystallographic Communications

JF - Acta Crystallographica Section E: Crystallographic Communications

SN - 2056-9890

IS - Pt 12

ER -

ID: 17828505