Synthesis, crystal and supramolecular structure of rac-N-acetyl-2-thiohydantoin-asparagine

Gerzon E. Delgado; Kristal N. Varela; Rohixa V. Araque; Jesús A. Rodríguez; Asiloé J. Mora; Luis E. Seijas

Synthesis, crystal and supramolecular structure of rac-N-acetyl-2-thiohydantoin-asparagine

Gerzon E. Delgado, Kristal N. Varela, Rohixa V. Araque, Jesús A. Rodríguez, Asiloé J. Mora, Luis E. Seijas

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

Abstract

The title compound, C₇H₉N₃O₃S, also known as rac-N-acetyl-5-propionamide-2-thioxo-imidazolidin-4-one, crystallize in the monoclinic system with space group P21/n (N°14), Z=4, and unit cell parameters a= 9.338 (7) Å, b= 7.545 (5) Å, c= 13.212 (10) Å, β= 97.10 (2)°, V= 932.8 (12) Å³. The acetyl group and the mean plane of the ureido group form an angle of 81.0 (2)°. In the supramolecular structure, the molécules are joined by N--H···O hydrógen bonds into cyclic structures with graph-set R²₂(14) and R²₂(16), forming a three-dimensional network.

Original language	English (US)
Pages (from-to)	3-6
Number of pages	4
Journal	Avances en Quimica
Volume	9
Issue number	1
State	Published - 2014
Externally published	Yes

All Science Journal Classification (ASJC) codes

General Chemistry

Cite this

@article{68972bd56e534e948d8abf7b088941c4,

title = "Synthesis, crystal and supramolecular structure of rac-N-acetyl-2-thiohydantoin-asparagine",

abstract = "The title compound, C7H9N3O3S, also known as rac-N-acetyl-5-propionamide-2-thioxo-imidazolidin-4-one, crystallize in the monoclinic system with space group P21/n (N°14), Z=4, and unit cell parameters a= 9.338 (7) {\AA}, b= 7.545 (5) {\AA}, c= 13.212 (10) {\AA}, β= 97.10 (2)°, V= 932.8 (12) {\AA}3. The acetyl group and the mean plane of the ureido group form an angle of 81.0 (2)°. In the supramolecular structure, the mol{\'e}cules are joined by N--H···O hydr{\'o}gen bonds into cyclic structures with graph-set R22(14) and R22(16), forming a three-dimensional network.",

author = "Delgado, {Gerzon E.} and Varela, {Kristal N.} and Araque, {Rohixa V.} and Rodr{\'i}guez, {Jes{\'u}s A.} and Mora, {Asilo{\'e} J.} and Seijas, {Luis E.}",

year = "2014",

language = "English (US)",

volume = "9",

pages = "3--6",

journal = "Avances en Quimica",

issn = "1856-5301",

publisher = "Universidad de los Andes Colombia",

number = "1",

}

TY - JOUR

T1 - Synthesis, crystal and supramolecular structure of rac-N-acetyl-2-thiohydantoin-asparagine

AU - Delgado, Gerzon E.

AU - Varela, Kristal N.

AU - Araque, Rohixa V.

AU - Rodríguez, Jesús A.

AU - Mora, Asiloé J.

AU - Seijas, Luis E.

PY - 2014

Y1 - 2014

N2 - The title compound, C7H9N3O3S, also known as rac-N-acetyl-5-propionamide-2-thioxo-imidazolidin-4-one, crystallize in the monoclinic system with space group P21/n (N°14), Z=4, and unit cell parameters a= 9.338 (7) Å, b= 7.545 (5) Å, c= 13.212 (10) Å, β= 97.10 (2)°, V= 932.8 (12) Å3. The acetyl group and the mean plane of the ureido group form an angle of 81.0 (2)°. In the supramolecular structure, the molécules are joined by N--H···O hydrógen bonds into cyclic structures with graph-set R22(14) and R22(16), forming a three-dimensional network.

AB - The title compound, C7H9N3O3S, also known as rac-N-acetyl-5-propionamide-2-thioxo-imidazolidin-4-one, crystallize in the monoclinic system with space group P21/n (N°14), Z=4, and unit cell parameters a= 9.338 (7) Å, b= 7.545 (5) Å, c= 13.212 (10) Å, β= 97.10 (2)°, V= 932.8 (12) Å3. The acetyl group and the mean plane of the ureido group form an angle of 81.0 (2)°. In the supramolecular structure, the molécules are joined by N--H···O hydrógen bonds into cyclic structures with graph-set R22(14) and R22(16), forming a three-dimensional network.

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UR - http://www.scopus.com/inward/citedby.url?scp=84902123083&partnerID=8YFLogxK

M3 - Article

AN - SCOPUS:84902123083

SN - 1856-5301

VL - 9

SP - 3

EP - 6

JO - Avances en Quimica

JF - Avances en Quimica

IS - 1

ER -

Synthesis, crystal and supramolecular structure of rac-N-acetyl-2-thiohydantoin-asparagine

Abstract

All Science Journal Classification (ASJC) codes

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