FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2802134847> ?p ?o ?g. }

• W2802134847 endingPage "424" @default.
• W2802134847 startingPage "369" @default.
• W2802134847 abstract "Vibrational spectroscopic study of crystalline copper hexacyanoferrate complexes of composition K4CuII6 [FeII(CN)6]4·nH2O (1) and CuII6[FeIII(CN)6]4·nH2O (2) with -Cu-N≡C-Fe- bridging structures have been performed. The cubic Fm3¯m (Oh5) unit-cells contain ideally 4 Fe and 4 Cu ions which were calculated by periodic density functional theory (DFT) (using the Gaussian09 C.01 software package) for ideal lattice compositions of K8CuII4[FeII(CN)6]4 (1a), K4CuII4[FeIII(CN)6]4 (2a) and with lattice water molecules KCuII4[FeIII(CN)6]3·6H2O (3a). Systematically, non-linear Cu-N≡C structure was fitted with Cu-N≡C bond angles about 155° for complexes 1a, 2a, and 3a. Practically, all optically active internal modes of Fe(CN6)n− moieties resulted from factor group analysis as 4A1g + 6Eg + 4F1g + 10F1u were experimentally observed and assigned. Some low-frequency translatory and librational modes were also interpreted. Vibrational bands were assigned to cis- and trans-Cu(NC)4(OH2) complexes which are formed in the lattice holes of both complexes. Vibrational spectra and force constants of a great number of transition metal hexacyano complexes of compositions K4[MII(CN)6], K3[MIII(CN)6], CsLi2[MIII(CN)6] and Prussian blue analogues have been reexamined and recalculated. Internal and external modes of 6 different lattice water species (coordinated, hydrogen bonded, or zeolitic type) have been interpreted for complex 2 using results of periodic DFT calculation of model complex 3a." @default.
• W2802134847 created "2018-05-17" @default.
• W2802134847 creator A5000348186 @default.
• W2802134847 creator A5000579108 @default.
• W2802134847 creator A5007422735 @default.
• W2802134847 creator A5012453189 @default.
• W2802134847 creator A5015166131 @default.
• W2802134847 creator A5044497172 @default.
• W2802134847 creator A5046022969 @default.
• W2802134847 creator A5057554153 @default.
• W2802134847 date "2018-05-09" @default.
• W2802134847 modified "2023-10-16" @default.
• W2802134847 title "Vibrational properties and bonding analysis of copper hexacyanoferrate complexes in solid state" @default.
• W2802134847 cites W1514794966 @default.
• W2802134847 cites W1552010050 @default.
• W2802134847 cites W1593631089 @default.
• W2802134847 cites W1614336064 @default.
• W2802134847 cites W167886035 @default.
• W2802134847 cites W1686656074 @default.
• W2802134847 cites W1912800395 @default.
• W2802134847 cites W1970112539 @default.
• W2802134847 cites W1978382294 @default.
• W2802134847 cites W1981368803 @default.
• W2802134847 cites W1983853045 @default.
• W2802134847 cites W1984647809 @default.
• W2802134847 cites W1984893367 @default.
• W2802134847 cites W1985002544 @default.
• W2802134847 cites W1986164181 @default.
• W2802134847 cites W1987815060 @default.
• W2802134847 cites W1988683428 @default.
• W2802134847 cites W1989060947 @default.
• W2802134847 cites W1991088998 @default.
• W2802134847 cites W1991588548 @default.
• W2802134847 cites W1996880321 @default.
• W2802134847 cites W1998350544 @default.
• W2802134847 cites W1998524463 @default.
• W2802134847 cites W2000770615 @default.
• W2802134847 cites W2002913022 @default.
• W2802134847 cites W2005222050 @default.
• W2802134847 cites W2012777271 @default.
• W2802134847 cites W2014166972 @default.
• W2802134847 cites W2015025315 @default.
• W2802134847 cites W2015087683 @default.
• W2802134847 cites W2015255313 @default.
• W2802134847 cites W2017044807 @default.
• W2802134847 cites W2022185872 @default.
• W2802134847 cites W2023271753 @default.
• W2802134847 cites W2027875795 @default.
• W2802134847 cites W2033990154 @default.
• W2802134847 cites W2038533471 @default.
• W2802134847 cites W2039264687 @default.
• W2802134847 cites W2040932712 @default.
• W2802134847 cites W2041560160 @default.
• W2802134847 cites W2045882451 @default.
• W2802134847 cites W2046412723 @default.
• W2802134847 cites W2046823376 @default.
• W2802134847 cites W2048344128 @default.
• W2802134847 cites W2050359331 @default.
• W2802134847 cites W2054516514 @default.
• W2802134847 cites W2055852366 @default.
• W2802134847 cites W2055878451 @default.
• W2802134847 cites W2061445178 @default.
• W2802134847 cites W2062824148 @default.
• W2802134847 cites W2064943127 @default.
• W2802134847 cites W2065993889 @default.
• W2802134847 cites W2071095959 @default.
• W2802134847 cites W2074971064 @default.
• W2802134847 cites W2077828759 @default.
• W2802134847 cites W2080628510 @default.
• W2802134847 cites W2082002130 @default.
• W2802134847 cites W2082285855 @default.
• W2802134847 cites W2083338119 @default.
• W2802134847 cites W2084448061 @default.
• W2802134847 cites W2086691720 @default.
• W2802134847 cites W2087083548 @default.
• W2802134847 cites W2090179754 @default.
• W2802134847 cites W2092378388 @default.
• W2802134847 cites W2094409244 @default.
• W2802134847 cites W2094640953 @default.
• W2802134847 cites W2114542492 @default.
• W2802134847 cites W2118465233 @default.
• W2802134847 cites W2120757859 @default.
• W2802134847 cites W2137825448 @default.
• W2802134847 cites W2143981217 @default.
• W2802134847 cites W2147674312 @default.
• W2802134847 cites W2148284063 @default.
• W2802134847 cites W2159164161 @default.
• W2802134847 cites W2162079584 @default.
• W2802134847 cites W2162943549 @default.
• W2802134847 cites W2169715370 @default.
• W2802134847 cites W2312954603 @default.
• W2802134847 cites W2329751528 @default.
• W2802134847 cites W2335438204 @default.
• W2802134847 cites W2410055834 @default.
• W2802134847 cites W2586620310 @default.
• W2802134847 cites W2949357441 @default.
• W2802134847 cites W2950003929 @default.
• W2802134847 cites W2950374028 @default.

• next