Crystal structures of anhydrous and hydrated N-benzyl-cinchonidinium bromide [0.03%]
无水和水合N-苯甲基奎尼диnum溴化物的晶体结构
Daron E Janzen,Maya S Butler,Eric W Reinheimer
Daron E Janzen
N-benzyl-cinchonidinium bromide, C26H29N2O+·Br-, with the systematic name (R)-[(2S,4S,5R)-1-benzyl-5-ethenyl-1-azoniabi-cyclo-[2.2.2]octan-2-yl](quinolin-4-yl)-methanol bromide, is a quaternary ammonium salt of the cinchona alkaloid cincho...
Mixed crystal of bis-(ammonium/oxonium) tetra-aqua-μ3-fluorido-dodeca-kis-(μ2-tri-fluoro-acetato) octa-hedro-hexa-ytterbiate(III) tetra-hydrate, [(NH4)1- x (H3O) x ]2[Yb6F8(O2CCF3)12(H2O)4]·4H2O (x = 1/4), containing a hexa-nuclear ytterbium(III) carboxyl-ate complex with face-capping fluoride ligands and comprising an unusual kind of substitutional dis [0.03%]
含脸位氟桥配体的六核稀土羧酸盐簇合物中的置换型双掺杂及其混合晶体[(NH4)(1-x)(H3O)x]2[Yb6F8(O2CCF3)12(H2O)4]·4H2O(x=1/4)
Florian Morsbach,Walter Frank
Florian Morsbach
The reaction of ytterbium metal with ammonium tri-fluoro-acetate in liquid ammonia resulted in a green substance comprising a substantial amount of ytterbium(II) tri-fluoro-acetate that is a useful precursor for the oxidative synthesis of t...
First hydrogen-bonded adduct of sterically hindered 2- tert-butyl-4-methyl-phenol (TBMP) with 1,3,6,8-tetra-aza-tri-cyclo-[4.4.1.13,8]dodecane (TATD) via coupling of classical hydrogen bonds and C-H⋯π non-covalent inter-actions [0.03%]
通过经典氢键和C-H⋯π非共价相互作用耦合得到的第一个2- tert-丁基-4-甲基苯酚(TBMP)与1,3,6,8-四氮杂三环[4.4.1.13,8]十二烷(TATD)的立体位阻加合物
Augusto Rivera,Jaime Ríos-Motta,Michael Bolte
Augusto Rivera
The title compound, C8H16N4·2C11H16O, was synthesized from the corres-ponding sterically crowded phenol by treatment with the aminal cage polyamine. Single-crystal X-ray diffraction structural analysis revealed the three-mol-ecule aggregat...
Hagen Poddig,Thomas Doert
Hagen Poddig
Single crystals of LaTe1.9 (lanthanum telluride) have been obtained by chemical transport reactions with iodine as transport agent. LaTe1.9 adopts the CeSe1.9 structure type and crystallizes in the space group P42/n with lattice parameters ...
Crystal structure and Hirshfeld surface analysis of 2-(4-chloro-phen-yl)-4-(di-meth-oxy-meth-yl)-5-phenyl-1,3-thia-zole [0.03%]
2-(4-氯苯基)-4-(二甲氧亚甲基)-5-苯基-1,3-噻唑的晶体结构和Hirshfeld面分析
Firudin I Guseinov,Konstantin I Kobrakov,Elena V Shuvalova et al.
Firudin I Guseinov et al.
In the title compound, C18H16ClNO2S, the thia-zole ring subtends dihedral angles of 13.12 (14) and 43.79 (14) ° with the attached chloro-phenyl and phenyl rings, respectively. In the crystal, C-H⋯π inter-actions link the mol-ecules, form...
Crystal structures of dimetal terephthalate di-hydroxides, M 2(C8H4O4)(OH)2 (M = Co, Ni, Zn) from powder diffraction data and DFT calculations [0.03%]
基于粉末衍射数据和DFT计算的二金属对苯二甲酸二氢氧化物(M₂(C₈H₄O₄)(OH)₂，M=Co、Ni、Zn))晶体结构
Emma L Markun,Drew A Jensen,Joshua D Vegetabile et al.
Emma L Markun et al.
The crystal structure of poly[di-hydroxido(μ6-terepthalato)dizinc], [Zn2(C8H4O4)(OH)2] n , was solved and refined using synchrotron powder data, and the structures of the isostructural Co and Ni analogues were refined using laboratory powd...
Crystal structure and Hirshfeld analysis of (1a S,3a R,4a S,5a R)-15-acet-oxy-linden-7(11),8-trieno-12,8-lactone [0.03%]
（1aS，3aR，4aS，5aR）-15-乙酰氧基苦参内酯-7（11），8-二烯-12，8-内酯的晶体结构及Hirshfeld面分析
Qiang-Qiang Lu,Xin-Wei Shi,Ya-Fu Zhou et al.
Qiang-Qiang Lu et al.
The structure of the title com-pound, C17H20O4 [systematic name: (1aS,3aR,4aS,5aR)-15-(acet-oxy)linden-7(11),8-trieno-12,8-lactone or (4aR,5S,5aR,6aS,6bR)-5-(acet-oxy-meth-yl)-4a,5,5a,6,6a,6b-hexa-hydro-3,6b-di-methyl-cyclo-propa[2,3]indeno...
Crystal structure and Hirshfeld surface analysis of N-{[5-(4-methyl-phen-yl)-1,2-oxazol-3-yl]meth-yl}-1-phenyl- N-(prop-2-en-1-yl)methane-sulfonamide [0.03%]
N-{[5-(4-甲基苯基)-1，2-噁唑-3-基]甲基}-1-苯基-N-(丙-2-烯-1-基)甲烷磺酰胺的晶体结构和Hirshfeld面分析
Victor N Khrustalev,Sevim Türktekin Çelikesir,Mehmet Akkurt et al.
Victor N Khrustalev et al.
In the title compound, C21H22N2O3S, the 1,2-oxazole ring makes the dihedral angles of 9.16 (16) and 87.91 (17)°, respectively, with the toluene and phenyl rings, while they form a dihedral angle of 84.42 (15)° with each other. The C-S-N-C...
Crystal structure and void analysis of tris-(2-amino-1-methyl-benzimidazolium) hexa-kis-(nitrato-κ2 O, O')lanthanate(III) [0.03%]
三(2-氨基-1-甲基苯并咪唑鎓)-六氟合镧(III)酸盐的晶体结构和空穴分析
Bakhtigul Ruzieva,Rishad Kunafiev,Zukhra Kadirova et al.
Bakhtigul Ruzieva et al.
The organic-inorganic complex salt, (C8H10N3)3[La(NO3)6], comprises a network of N-protonated 2-amino-1-methyl-benzimidazolium cations and hexa-kis-(nitrato)lanthanate(III) anions. The LaIII atom is twelve-coordinate within a distorted icos...
Crystal structure of 2-amino-5,6,7,8-tetra-hydro-7,7-dimethyl-4-(naphthalen-2-yl)-5-oxo-4 H-chromene-3-carbo-nitrile [0.03%]
2-氨基-5,6,7,8-四氢-7,7-二甲基-4-(萘-2-基)-5-氧代-4H-环烯并吡喃-3-腈的晶体结构
Ali M S Hebishy,Galal H Elgemeie,Rasha A E Ali et al.
Ali M S Hebishy et al.
In the title compound, C22H20N2O2, both six-membered rings of the fused heterocyclic system display envelope conformations; the two carbon atoms bearing the methyl groups and the naphthyl substituent both lie outside the planes of the other...