نتایج جستجو برای: tautomer

تعداد نتایج: 566  

Journal: :Physical chemistry chemical physics : PCCP 2011
Gábor Bazsó György Tarczay Géza Fogarasi Péter G Szalay

We have measured the IR and UV spectra of cytosine in a low-temperature argon matrix. An attempt was made to determine the tautomeric ratios existing in the matrix, making use of the matrix-isolation IR spectrum and computed IR intensities of the tautomers in a least squares fitting procedure. The mole fractions are about 0.22 for oxo(-amino) form, 0.26 and 0.44 for the two rotamers, respective...

2012
Bi Jing Yuao-Chao Du Ai-Xin Zhu

The mol-ecule of the title compound, C(4)H(7)N(3)S, exists as the thione tautomer in the solid state. The asymmetric unit consits of one mol-ecule in which all atoms are located on a crystallographic mirror plane. In the crystal, adjacent mol-ecules are linked by N-H⋯N and N-H⋯S hydrogen bonds into chains running along the a axis. π-π stacking inter-actions between the triazole rings [centroid-...

2015
Jamie S. Foster Justyna M. Żurek Nuno M. S. Almeida Wouter E. Hendriksen Vincent A. A. le Sage Vasudevan Lakshminarayanan Amber L. Thompson Rahul Banerjee Rienk Eelkema Helen Mulvana Martin J. Paterson Jan H. van Esch Gareth O. Lloyd

Simultaneous control of the kinetics and thermodynamics of two different types of covalent chemistry allows pathway selectivity in the formation of hydrogelating molecules from a complex reaction network. This can lead to a range of hydrogel materials with vastly different properties, starting from a set of simple starting compounds and reaction conditions. Chemical reaction between a trialdehy...

Journal: :The Journal of organic chemistry 2004
Theodore A Martinot Steven A Benner

The tautomerism of 2'-deoxy-7-deaza-isoguanosine (2) was studied and compared to that of 2'-deoxyisoguanosine (1). The fixed (1)N-methyl (8) and O-methyl (4) derivatives were synthesized to represent the pure extremes of each tautomer. The replacement of the imidazole ring in 1 with a pyrrole ring in 2 makes the keto form in the latter more favored by 2 orders of magnitude (K(TAUT) for 2 approx...

2011
Hualing Zhu Zhan Wang Junjie Ren Miao Zhang Wei Xu

In the title compound, C(21)H(21)N(3)O(2), an intra-molecular N-H⋯O inter-action generates an S(6) ring, which stablizes the enamine-keto tautomer. The S(6) ring makes dihedral angles of 33.07 (7), 56.50 (8) and 38.59 (8)°, respectively, with the benzoyl-acetone benzene ring and the anti-pyrine pyrazole and benzene rings.

Journal: :Chemical communications 2014
Fillmore Freeman

The density functionals B3LYP, B3PW91, M062X, and CAM-B3LYP with the 6-311+G(d,p) basis set predict the cysteine sulfenic acid O-sulfenylation of the s-cis-ketoenol tautomer of 1,3-cyclohexanedione proceeds through a cyclic 14-membered transition state structure containing three water molecules.

Journal: :Chemical science 2015
Zhang-Pei Chen Mu-Wang Chen Lei Shi Chang-Bin Yu Yong-Gui Zhou

An efficient palladium-catalyzed asymmetric hydrogenation of fluorinated aromatic pyrazol-5-ols has been developed via capture of the active tautomers. A wide variety of 2,5-disubstituted and 2,4,5-trisubstituted pyrazolidinones have been synthesized with up to 96% and 95% ee, respectively. The hydrogenation pathway includes Brønsted acid promoted tautomerization of pyrazol-5-ols and Pd-catalyz...

نمودار تعداد نتایج جستجو در هر سال

با کلیک روی نمودار نتایج را به سال انتشار فیلتر کنید