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Crystal structure of [Y6(μ6-O)(μ3-OH)8(H2O)24]I8·8H2O. [Y6(μ6-O)(μ3-OH)8(H2O)24]I8·8H2O的晶体结构。
IF 0.9
Acta crystallographica. Section E, Structure reports online Pub Date : 2014-11-26 eCollection Date: 2014-12-01 DOI: 10.1107/S1600536814025434
François Le Natur, Guillaume Calvez, Olivier Guillou, Carole Daiguebonne, Kevin Bernot
{"title":"Crystal structure of [Y6(μ6-O)(μ3-OH)8(H2O)24]I8·8H2O.","authors":"François Le Natur,&nbsp;Guillaume Calvez,&nbsp;Olivier Guillou,&nbsp;Carole Daiguebonne,&nbsp;Kevin Bernot","doi":"10.1107/S1600536814025434","DOIUrl":"https://doi.org/10.1107/S1600536814025434","url":null,"abstract":"<p><p>The crystal structure of the title compound {systematic name: octa-μ3-hydroxido-μ6-oxido-hexa-kis-[tetra-aqua-yttrium(III)] octa-iodide octa-hydrate}, is characterized by the presence of the centrosymmetric mol-ecular entity [Y6(μ6-O)(μ3-OH)8(H2O)24](8+), in which the six Y(3+) cations are arranged octa-hedrally around a μ6-O atom at the centre of the cationic complex. Each of the eight faces of the Y6 octa-hedron is capped by an μ3-OH group in the form of a distorted cube. In the hexa-nuclear entity, the Y(3+) cations are coordinated by the central μ6-O atom, the O atoms of four μ3-OH and of four water mol-ecules. The resulting coordination sphere of the metal ions is a capped square-anti-prism. The crystal packing is quite similar to that of the ortho-rhom-bic [Ln 6(μ6-O)(μ3-OH)8(H2O)24]I8·8H2O structures with Ln = La-Nd, Eu-Tb, Dy, except that the title compound exhibits a slight monoclinic distortion. The proximity of the cationic complexes and the lattice water mol-ecules leads to the formation of a three-dimensional hydrogen-bonded network of medium strength. </p>","PeriodicalId":7117,"journal":{"name":"Acta crystallographica. Section E, Structure reports online","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2014-11-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1107/S1600536814025434","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"32946967","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 2
Crystal structure of 2-(di-phenyl-phos-phanyl)phenyl 4-(hy-droxy-meth-yl)benzoate. 2-(二苯基-磷-苯基)苯基4-(羟基-甲基)苯甲酸酯的晶体结构。
IF 0.9
Acta crystallographica. Section E, Structure reports online Pub Date : 2014-11-26 eCollection Date: 2014-12-01 DOI: 10.1107/S1600536814024623
Constantin Mamat, Anke Flemming, Martin Köckerling
{"title":"Crystal structure of 2-(di-phenyl-phos-phanyl)phenyl 4-(hy-droxy-meth-yl)benzoate.","authors":"Constantin Mamat,&nbsp;Anke Flemming,&nbsp;Martin Köckerling","doi":"10.1107/S1600536814024623","DOIUrl":"https://doi.org/10.1107/S1600536814024623","url":null,"abstract":"<p><p>The title compound, C26H21O3P, was obtained as by-product due to the hydrolysis of the desired tosyl-ated compound. The dihedral angles between the three aromatic rings attached to the P atom lie in the range 78.1 (1)-87.6 (1)°. The hy-droxy-methyl group is disordered between two conformations in a 0.719 (9):0.281 (9) ratio. The hy-droxy H atom is not involved in inter-molecular inter-actions, while the hy-droxy O atom serves as a donor for weak C-H⋯O hydrogen bonds, which link the mol-ecules into chains propagating in [0-11]. </p>","PeriodicalId":7117,"journal":{"name":"Acta crystallographica. Section E, Structure reports online","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2014-11-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257391/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"32946133","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Crystal structure of 4-amino-1-(4-methyl-benz-yl)pyridinium bromide. 4-氨基-1-(4-甲基苄基)溴化吡啶的晶体结构。
IF 0.9
Acta crystallographica. Section E, Structure reports online Pub Date : 2014-11-26 eCollection Date: 2014-12-01 DOI: 10.1107/S1600536814025343
N Sharmila, T V Sundar, A Yasodha, A Puratchikody, B Sridhar
{"title":"Crystal structure of 4-amino-1-(4-methyl-benz-yl)pyridinium bromide.","authors":"N Sharmila,&nbsp;T V Sundar,&nbsp;A Yasodha,&nbsp;A Puratchikody,&nbsp;B Sridhar","doi":"10.1107/S1600536814025343","DOIUrl":"https://doi.org/10.1107/S1600536814025343","url":null,"abstract":"<p><p>The title mol-ecular salt, C13H15N2 (+)·Br(-), crystallized with two independent ion pairs (A and B) in the asymmetric unit. In the cations, the planes of the pyridine and benzene rings are inclined to one another by 79.32 (8) and 82.30 (10)° in ion pairs A and B, respectively. In the crystal, the anions and cations are connected by N-H⋯Br hydrogen bonds, forming a centrosymmetric tetra-mer-like unit enclosing an R 8 (4)(16) ring motif. These units are linked via C-H⋯Br hydrogen bonds, forming a three-dimensional network. </p>","PeriodicalId":7117,"journal":{"name":"Acta crystallographica. Section E, Structure reports online","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2014-11-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1107/S1600536814025343","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"32946136","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 4
Crystal structure of (Z)-1-(ferrocenylethyn-yl)-10-(phenyl-imino)-anthracen-9(10H)-one from synchrotron X-ray powder diffraction. 同步x射线粉末衍射(Z)-1-(二茂铁乙炔基)-10-(苯基亚胺)-蒽-9(10H)- 1的晶体结构。
IF 0.9
Acta crystallographica. Section E, Structure reports online Pub Date : 2014-11-26 eCollection Date: 2014-12-01 DOI: 10.1107/S1600536814025252
Eiji Nishibori, Shinobu Aoyagi, Makoto Sakata, Ryota Sakamoto, Hiroshi Nishihara
{"title":"Crystal structure of (Z)-1-(ferrocenylethyn-yl)-10-(phenyl-imino)-anthracen-9(10H)-one from synchrotron X-ray powder diffraction.","authors":"Eiji Nishibori,&nbsp;Shinobu Aoyagi,&nbsp;Makoto Sakata,&nbsp;Ryota Sakamoto,&nbsp;Hiroshi Nishihara","doi":"10.1107/S1600536814025252","DOIUrl":"https://doi.org/10.1107/S1600536814025252","url":null,"abstract":"<p><p>In the title compound, [Fe(C5H5)(C27H16NO)], designed and synthesized to explore a new electron-donor (D) and -acceptor (A) conjugated complex, the two cyclo-penta-dienyl rings adopt an eclipsed conformation. The anthracene tricycle is distorted towards a butterfly conformation and the mean planes of the outer benzene rings are inclined each to other at 22.7 (3)°. In the crystal, mol-ecules are paired into inversion dimers via π-π inter-actions. Weak inter-molecular C-H⋯π inter-actions link further these dimers into one-dimensional columns along the b axis, with the ferrocenylethynyl arms arranged between the stacks to fill the voids. </p>","PeriodicalId":7117,"journal":{"name":"Acta crystallographica. Section E, Structure reports online","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2014-11-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257377/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"32946966","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Crystal structure of (Z)-3-benz-yloxy-6-[(2-hy-droxy-anilino)methyl-idene]cyclo-hexa-2,4-dien-1-one. (Z)-3-苄基氧基-6-[(2-羟基苯胺)甲基二烯]环己-2,4-二烯-1- 1的晶体结构。
IF 0.9
Acta crystallographica. Section E, Structure reports online Pub Date : 2014-11-26 eCollection Date: 2014-12-01 DOI: 10.1107/S1600536814024568
Nadir Ghichi, Ali Benboudiaf, Hocine Merazig
{"title":"Crystal structure of (Z)-3-benz-yloxy-6-[(2-hy-droxy-anilino)methyl-idene]cyclo-hexa-2,4-dien-1-one.","authors":"Nadir Ghichi,&nbsp;Ali Benboudiaf,&nbsp;Hocine Merazig","doi":"10.1107/S1600536814024568","DOIUrl":"https://doi.org/10.1107/S1600536814024568","url":null,"abstract":"<p><p>In the title compound, C20H17NO3, the methyl-idene-cyclo-hexa-2,4-dienone moiety is approximately planar [maximum deviation = 0.0615 (10) Å] and is oriented at diherdral angles of 69.60 (7) and 1.69 (9)° to the phenyl and hy-droxy-benzene rings, respectively. The amino group links with the carbonyl O atom via an intra-molecular N-H⋯O hydrogen bond, forming an S(6) ring motif. In the crystal, the mol-ecules are linked by O-H⋯O hydrogen bonds and weak C-H⋯O and C-H⋯π inter-actions, forming a three-dimensional supra-molecular architecture. </p>","PeriodicalId":7117,"journal":{"name":"Acta crystallographica. Section E, Structure reports online","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2014-11-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1107/S1600536814024568","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"32946135","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 2
Crystal structure of ethyl 4-[(1H-pyrazol-1-yl)meth-yl]benzoate. 4-[(1H- 吡唑-1-基)甲基]苯甲酸乙酯的晶体结构。
IF 0.9
Acta crystallographica. Section E, Structure reports online Pub Date : 2014-11-26 eCollection Date: 2014-12-01 DOI: 10.1107/S1600536814025100
Ju-Xian Wang, Chao Feng
{"title":"Crystal structure of ethyl 4-[(1H-pyrazol-1-yl)meth-yl]benzoate.","authors":"Ju-Xian Wang, Chao Feng","doi":"10.1107/S1600536814025100","DOIUrl":"10.1107/S1600536814025100","url":null,"abstract":"<p><p>In the title mol-ecule, C13H14N2O2, the dihedral angle between the pyrazole and benzene ring mean planes is 76.06 (11)°, and the conformation of the ethyl side chain is anti [C-O-C-C = -175.4 (3)°]. In the crystal, the only directional inter-actions are very weak C-H ⋯π inter-actions involving both the pyrazole and benzene rings, leading to the formation of a three-dimensional network. </p>","PeriodicalId":7117,"journal":{"name":"Acta crystallographica. Section E, Structure reports online","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2014-11-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257449/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"32946132","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Crystal structure of 9-butyl-3-(9-butyl-9H-carbazol-3-yl)-9H-carbazole. 9-丁基-3-(9-丁基- 9h -咔唑-3-基)- 9h -咔唑的晶体结构。
IF 0.9
Acta crystallographica. Section E, Structure reports online Pub Date : 2014-11-21 eCollection Date: 2014-12-01 DOI: 10.1107/S1600536814025367
K Stalindurai, C Ramalingan, B Sridhar, S Selvanayagam
{"title":"Crystal structure of 9-butyl-3-(9-butyl-9H-carbazol-3-yl)-9H-carbazole.","authors":"K Stalindurai,&nbsp;C Ramalingan,&nbsp;B Sridhar,&nbsp;S Selvanayagam","doi":"10.1107/S1600536814025367","DOIUrl":"https://doi.org/10.1107/S1600536814025367","url":null,"abstract":"<p><p>In the title carbazole derivative, C32H32N2, the mol-ecule resides on a crystallographic twofold axis, which runs through the central C-C bond. The carbazole ring system is almost planar, with a maximum deviation of 0.041 (1) Å for one of the ring-junction C atoms. The crystal packing is stabilized by C-H⋯π inter-actions only, which form a C(7) chain-like arrangement along [110] in the unit cell. </p>","PeriodicalId":7117,"journal":{"name":"Acta crystallographica. Section E, Structure reports online","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2014-11-21","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1107/S1600536814025367","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"32946130","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Crystal structure of (-)-(2R,3S,4R,5R)-5-(1,3-di-thian-2-yl)-3-methyl-1-(triiso-propyl-sil-yloxy)hexane-2,4-diol. (-)-(2R,3S,4R,5R)-5-(1,3-二噻烷-2-基)-3-甲基-1-(三异丙基硅氧基)己烷-2,4-二醇的晶体结构。
IF 0.9
Acta crystallographica. Section E, Structure reports online Pub Date : 2014-11-21 eCollection Date: 2014-12-01 DOI: 10.1107/S160053681402443X
Alejandra Cruz-Montanez, Dalice M Piñero Cruz, Jose A Prieto
{"title":"Crystal structure of (-)-(2R,3S,4R,5R)-5-(1,3-di-thian-2-yl)-3-methyl-1-(triiso-propyl-sil-yloxy)hexane-2,4-diol.","authors":"Alejandra Cruz-Montanez, Dalice M Piñero Cruz, Jose A Prieto","doi":"10.1107/S160053681402443X","DOIUrl":"10.1107/S160053681402443X","url":null,"abstract":"<p><p>The title compound, C20H42O3S2Si, crystallized with two independent mol-ecules (A and B) in the asymmetric unit. They consist of syn,anti,anti-stereo-tetrads with a 1,3-di-thiane motif and a primary alcohol protected as the triisopropyl silyl ether. The 1,3-di-thiane ring adopts a chair conformation, while the rest of each mol-ecule displays a common zigzag conformation. There is an intra-molecular O-H⋯O hydrogen bond in each mol-ecule. In the crystal, the A and B mol-ecules are linked via O-H⋯O hydrogen bonds, forming -A-B-A--B-- chains along [010]. The absolute structure was determined by resonant scattering (anomalous scattering) [Flack parameter = 0.035 (8)]. </p>","PeriodicalId":7117,"journal":{"name":"Acta crystallographica. Section E, Structure reports online","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2014-11-21","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257393/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"32946131","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Crystal structure of 4,6-bis-[(E)-4-bromo-styr-yl]-2-(butyl-sulfan-yl)pyrimidine. 4,6-二-[(E)-4-溴-苯乙烯基]-2-(丁基磺基)嘧啶的晶体结构。
IF 0.9
Acta crystallographica. Section E, Structure reports online Pub Date : 2014-11-21 eCollection Date: 2014-12-01 DOI: 10.1107/S1600536814024714
Wang Yu, Jingbao Song, Aijian Wang
{"title":"Crystal structure of 4,6-bis-[(E)-4-bromo-styr-yl]-2-(butyl-sulfan-yl)pyrimidine.","authors":"Wang Yu,&nbsp;Jingbao Song,&nbsp;Aijian Wang","doi":"10.1107/S1600536814024714","DOIUrl":"https://doi.org/10.1107/S1600536814024714","url":null,"abstract":"<p><p>In the title compound, C24H22Br2N2S, the dihedral angles between the central pyrimidine ring and the pendant bromo-benzene rings are 11.02 (11) and 13.20 (12)°. The butyl side chain adopts a gauche conformation [C-C-C-C = -67.4 (4)°]. In the crystal, weak aromatic π-π stacking is observed between the pyrimidine ring and one of the benzene rings [centroid-centroid separation = 3.6718 (17) Å]. </p>","PeriodicalId":7117,"journal":{"name":"Acta crystallographica. Section E, Structure reports online","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2014-11-21","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1107/S1600536814024714","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"32946129","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Crystal structure of 2,2,3,3-tetra-methyl-1,1,1,4,4,4-hexa-phenyl-tetra-germane. 2,2,3,3-四甲基-1,1,1,4,4,4-六苯基四日耳曼的晶体结构。
IF 0.9
Acta crystallographica. Section E, Structure reports online Pub Date : 2014-11-21 eCollection Date: 2014-12-01 DOI: 10.1107/S160053681402501X
Kirill V Zaitsev, Sergey S Karlov, Galina S Zaitseva, Ali Alizade, Yuri L Slovokhotov
{"title":"Crystal structure of 2,2,3,3-tetra-methyl-1,1,1,4,4,4-hexa-phenyl-tetra-germane.","authors":"Kirill V Zaitsev,&nbsp;Sergey S Karlov,&nbsp;Galina S Zaitseva,&nbsp;Ali Alizade,&nbsp;Yuri L Slovokhotov","doi":"10.1107/S160053681402501X","DOIUrl":"https://doi.org/10.1107/S160053681402501X","url":null,"abstract":"<p><p>The mol-ecule of the title compound, C40H42Ge4, lies with its central Ge-Ge bond on an inversion centre giving rise to a zigzag backbone of four tetra-hedrally coordinated Ge atoms. The symmetrically independent Ge-Ge bonds are slightly shorter than in other organo-tetra-germanes whereas the Ge-CPh (Ph = phen-yl) and Ge-CMe (Me = meth-yl) distances have their usual values. In the crystal, (010) layers of Ph6Me4Ge4 mol-ecules with a parallel orientation of the Ge4 backbone exist, held together by van der Waals forces only. Main bond lengths in organo-substituted oligogermanes are compared. </p>","PeriodicalId":7117,"journal":{"name":"Acta crystallographica. Section E, Structure reports online","volume":null,"pages":null},"PeriodicalIF":0.9,"publicationDate":"2014-11-21","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1107/S160053681402501X","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"32945116","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 1
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