dc.creator | Estrada de Oya, María Dolores | es |
dc.creator | Conde Amiano, Alejandro | es |
dc.creator | Márquez Delgado, Rafael | es |
dc.date.accessioned | 2017-12-12T17:25:08Z | |
dc.date.available | 2017-12-12T17:25:08Z | |
dc.date.issued | 1986 | |
dc.identifier.citation | Estrada de Oya, M.D., Conde Amiano, A. y Márquez, R. (1986). X-ray Structure and Molecular-Packing Analysis of a Glucofuranosoimidazolidine- 2-thione. Acta crystallographica. Section C, Crystal structure communications, 42 (4), 454-457. | |
dc.identifier.issn | 0108-2701 | es |
dc.identifier.uri | http://hdl.handle.net/11441/67535 | |
dc.description.abstract | 1-(4-Bromophenyl)-3-ethyl-(3,5,6-tri-Oacetyl-
1,2-dideoxy-~t-L-glucofuranoso)[2,1-d]imidazolidine-
2-thione,* C21H25BrN2OTS, M,= 529.40, orthorhombic,
P2~2121, a= 12.056 (7), b= 22.420 (9), c
=8.841 (2)A, V=2390(2) A3, z=4, Dm= 1.47 (2),
D x = 1.47 Mg m -3, 2(Mo Ktx) = 0.7107 A, # =
1.82mm -1, F(000)= 1088, room temperature, final
R = 0.070 for 1668 observed reflexions. The sugar ring
adopts the 4E conformation and the imidazolidine ring
is almost planar. The dihedral angle in the bicyclic
system is 71.1 (4) °. The crystal cohesion is mainly due
to van der Waals interactions. The lattice energy was
computed in the atom:--atom approach using van der
Waals potential functions and the calculations account
satisfactorily for the features of the crystal packing. | es |
dc.format | application/pdf | es |
dc.language.iso | eng | es |
dc.publisher | International Union of Crystallography | es |
dc.relation.ispartof | Acta crystallographica. Section C, Crystal structure communications, 42 (4), 454-457. | |
dc.rights | Attribution-NonCommercial-NoDerivatives 4.0 Internacional | * |
dc.rights.uri | http://creativecommons.org/licenses/by-nc-nd/4.0/ | * |
dc.title | X-ray Structure and Molecular-Packing Analysis of a Glucofuranosoimidazolidine- 2-thione | es |
dc.type | info:eu-repo/semantics/article | es |
dcterms.identifier | https://ror.org/03yxnpp24 | |
dc.type.version | info:eu-repo/semantics/publishedVersion | es |
dc.rights.accessRights | info:eu-repo/semantics/openAccess | es |
dc.contributor.affiliation | Universidad de Sevilla. Departamento de Física de la Materia Condensada | es |
dc.relation.publisherversion | http://dx.doi.org/10.1107/S0108270186095811 | es |
dc.identifier.doi | 10.1107/S0108270186095811 | es |
idus.format.extent | 4 p. | es |
dc.journaltitle | Acta crystallographica. Section C, Crystal structure communications | es |
dc.publication.volumen | 42 | es |
dc.publication.issue | 4 | es |
dc.publication.initialPage | 454 | es |
dc.publication.endPage | 457 | es |