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排序方式: 共有141条查询结果,搜索用时 15 毫秒
1.
Vasyl Kinzhybalo Jan Janczak 《Acta Crystallographica. Section C, Structural Chemistry》2007,63(3):m105-m107
The crystals of the title compound, [Mg(C32H16N8)(H2O)]·2C3H9N, are built up from MgPc(H2O) [Pc is phthalocyaninate(2−)] and n‐propylamine molecules that interact via O—H⋯N hydrogen bonds. The MgPc(H2O) molecule is non‐planar. The central Mg atom is coordinated by the four equatorial isoindole N atoms of the Pc ring system and by the O atom of an axial water molecule. The Mg atom is displaced by 0.509 (1) Å from the N4 plane towards the water O atom. MgPc(H2O)·2(n‐propylamine) molecules related by the inversion centre are linked by N—H⋯O hydrogen bonds to form a dimeric aggregate. 相似文献
2.
Andrzej Czopnik Nataly Shitsevalova Alexander Krivchikov Vasyl Pluzhnikov Yuriy Paderno 《Journal of solid state chemistry》2004,177(2):507-514
We have measured heat capacity and thermal expansion of rare earth dodecaborides REB12 (RE=Y, Tb-Tm, Lu). YB12 and LuB12 are diamagnetics whereas the other dodecaborides are ordered antiferromagnetically. The amplitude of the heat capacity discontinuity at the Néel temperature and the shape of the heat capacity variation in the critical region for all these antiferromagnetics are characteristics for amplitude-modulated magnetic structures. In the ordered state TbB12 reveals two first-order phase transitions, most likely due to magnetic structure changes. The heat capacity of ErB12 just below the Néel point shows an anomaly of unclear origin. From the Schottky contribution to the heat capacity we have determined crystal field parameters. They are completely different than that is estimated from Point Charge Model. 相似文献
3.
Vasyl Kinzhybalo Jan Janczak 《Acta Crystallographica. Section C, Structural Chemistry》2007,63(8):m357-m360
The structure of the title compound, [Mg(C32H16N8)(H2O)]·2C5H4ClN, comprises MgPcH2O [Pc is phthalocyaninate(2−)] and 3‐chloropyridine solvent molecules interacting via O—H...N hydrogen bonds and π–π interactions. The central Mg atom is (4+1)‐coordinated by four equatorial isoindole N atoms of the macrocycle and by the O atom of an axial water molecule. The MgPcH2O molecule is not planar, the Mg atom being displaced by 0.496 (2) Å from the isoindole N4 plane towards the water O atom. MgPcH2O molecules related by a twofold screw axis interact via O—H...Nazamethine hydrogen bonds, forming a polymeric chain along the b axis, while those related by inversion centres form π–π interacting dimers. 相似文献
4.
5.
We solve an analogue of the Barker–Larman problem for convex polygons in the hyperbolic plane. 相似文献
6.
Nataliya Zelisko Dmytro Atamanyuk Olexandr Vasylenko Andriy Bryhas Vasyl Matiychuk Andrzej Gzella Roman Lesyk 《Tetrahedron》2014
Various novel thiopyrano[2,3-d][1,3]thiazol-2-one-6-carboxylic acids derivatives were synthesized in 54–86% yields via hetero-Diels–Alder reactions and related acylation-based tandem processes of 5-arylidene-4-thioxo-2-thiazolidinones with crotonic, propiolic, and cynnamic acids derivatives. Stereo- and regioselectivity of cycloaddition were investigated. 相似文献
7.
Vasyl Hreb Vira Shved Oleh Buryy Olga Pekinchak Leonid Vasylechko 《无机化学与普通化学杂志》2020,646(14):1138-1143
Crystal structure parameters of the mixed cobaltite–chromite SmCo0.5Cr0.5O3 in the temperature range of 298–1173 K were derived from in situ high-resolution X-ray synchrotron powder diffraction data. Similar to the parent SmCoO3 compound, SmCo0.5Cr0.5O3 reveals anomalous thermal expansion reflected in abnormal temperature dependence of the unit cell dimensions and the selected interatomic distances and angles. These anomalies are associated with temperature induced changes of spin state of Co3+ ions and coupled insulator-metal transition. Observed decreasing behavior of the bandwidth W points on the increasing population of the exited spin states of Co3+ ions in SmCo0.5Cr0.5O3 with increasing temperature. First principle calculations revealed antiferromagnetic ground state of SmCo0.5Cr0.5O3 as the most stable. 相似文献
8.
Fielding AJ Brodhun F Koch C Pievo R Denysenkov V Feussner I Bennati M 《Journal of the American Chemical Society》2011,133(23):9052-9062
PpoA is a fungal dioxygenase that produces hydroxylated fatty acids involved in the regulation of the life cycle and secondary metabolism of Aspergillus nidulans . It was recently proposed that this novel enzyme employs two different heme domains to catalyze two separate reactions: within a heme peroxidase domain, linoleic acid is oxidized to (8R)-hydroperoxyoctadecadienoic acid [(8R)-HPODE]; in the second reaction step (8R)-HPODE is isomerized within a P450 heme thiolate domain to 5,8-dihydroxyoctadecadienoic acid. In the present study, pulsed EPR methods were applied to find spectroscopic evidence for the reaction mechanism, thought to involve paramagnetic intermediates. We observe EPR resonances of two distinct heme centers with g-values typical for Fe(III) S = (5)/(2) high-spin (HS) and Fe(III) S = (1)/(2) low-spin (LS) hemes. (14)N ENDOR spectroscopy on the S = (5)/(2) signal reveals resonances consistent with an axial histidine ligation. Reaction of PpoA with the substrate leads to the formation of an amino acid radical on the early millisecond time scale concomitant to a substantial reduction of the S = (5)/(2) heme signal. High-frequency EPR (95- and 180-GHz) unambiguously identifies the new radical as a tyrosyl, based on g-values and hyperfine couplings from spectral simulations. The radical displays enhanced T(1)-spin-lattice relaxation due to the proximity of the heme centers. Further, EPR distance measurements revealed that the radical is distributed among the monomeric subunits of the tetrameric enzyme at a distance of approximately 5 nm. The identification of three active paramagnetic centers involved in the reaction of PpoA supports the previously proposed reaction mechanism based on radical chemistry. 相似文献
9.
Kovalenko OO Brusylovets OA Kinzhybalo V Lis T Brusilovets AI 《Dalton transactions (Cambridge, England : 2003)》2011,40(18):4814-4817
The low-coordinate phosphorus compounds (Me(3)Si)(2)N-P=NSiMe(3), (Me(3)Si)(2)N-P(=S)=N(t)Bu and (Me(3)Si)(2)N-P(=NSiMe(3))(2) react with ((i)PrO)(3)M≡M(O(i)Pr)(3) (M = Mo, W) to form four- and five-membered metallacycles with intact endocyclic or exocyclic M≡M triple bonds. The first four-membered planar metallacycles, containing an M≡M triple bond were obtained in reaction with (Me(3)Si)(2)N-P=NSiMe(3). 相似文献
10.
Stepan Dmytrovych Ivasyshen Vasyl?? Vasyl??ovych Layuk 《Journal of Mathematical Sciences》2011,173(4):341-370
For a class of ultraparabolic equations of the Kolmogorov type, we prove the theorems on the correct solvability and the integral representation of solutions of the Cauchy problem, whose initial data belong to special weight spaces of functions and generalized Borel measures. On the basis of these theorems, we obtained the full characterization of appropriate classes of solutions of the equations under consideration. 相似文献