4.1 Article

Crystal structure of 4-ethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-6-oxo-1,6-dihydropyrimidine-5-carbonitrile, C14H12N4O3S

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Publisher

WALTER DE GRUYTER GMBH
DOI: 10.1515/ncrs-2022-0272

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2059188

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  1. Princess Nourah bint Abdulrahman University, Riyadh, Saudi Arabia [PNURSP2022R3]

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The compound is monoclinic with a molecular formula of C14H12N4O3S. The cell parameters are a = 12.2777(3) Å, b = 9.4312(2) Å, c = 12.9412(2) Å, and β = 107.945(2) degrees. The volume of the unit cell is 1425.61(5) Å^3, with a space group of P2(1)/n. The data was collected at 160 K.
C14H12N4O3S, monoclinic, P2(1)/n (no. 14), a = 12.2777(3) angstrom, b = 9.4312(2) angstrom, c = 12.9412(2) angstrom, beta = 107.945(2)degrees, V = 1425.61(5) angstrom(3), Z = 4, R ( gt )(F) = 0.0305, wR ( ref )(F (2)) = 0.0837, T = 160 K.

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