Results 31 to 40 of about 477,351 (168)

Crystal structures of three 3-chloro-3-methyl-2,6-diarylpiperidin-4-ones

Acta Crystallographica Section E: Crystallographic Communications, 2017
The syntheses and crystal structure of 3-chloro-3-methyl-r-2,c-6-diphenylpiperidin-4-one, C18H18ClNO, (I), 3-chloro-3-methyl-r-2,c-6-di-p-tolylpiperidin-4-one, C20H22ClNO, (II), and 3-chloro-3-methyl-r-2,c-6-bis(4-chlorophenyl)piperidin-4-one ...
R. Arulraj, S. Sivakumar, Manpreet Kaur, A. Thiruvalluvar, Jerry P. Jasinski   +4 more
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Neural structure fields with application to crystal structure autoencoders

Communications Materials, 2023
Representing crystal structures of materials to facilitate determining them via neural networks is crucial for enabling machine-learning applications involving crystal structure estimation.
Naoya Chiba, Yuta Suzuki, Tatsunori Taniai, Ryo Igarashi, Yoshitaka Ushiku, Kotaro Saito, Kanta Ono   +6 more
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Crystal structure of fluroxypyr [PDF]

Acta Crystallographica Section E Crystallographic Communications, 2016
In the title pyridine herbicide {systematic name: 2-[(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxy]acetic acid}, C7H5Cl2FN2O3, the mean plane of the carboxylic acid substituent and the pyridyl ring plane subtend a dihedral angle of 77.5 (1)°. In the crystal, pairs of O—H...O hydrogen bonds form inversion dimers withR22(8) ring motifs.
Hyunjin Park, Myong Yong Choi, Eunjin Kwon, Tae Ho Kim   +3 more
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Crystal structures of two 2,3-diaryl-2,3-dihydro-4H-1,3-benzothiazin-4-ones

Acta Crystallographica Section E: Crystallographic Communications, 2018
The syntheses and crystal structures of 2,3-bis[3-(trifluoromethyl)phenyl]-2,3-dihydro-4H-1,3-benzothiazin-4-one (di-m-CF3; C22H13F6NOS) (1) and 2,3-bis(4-methylphenyl)-2,3-dihydro-4H-1,3-benzothiazin-4-one (di-p-CH3; C22H19NOS) (2) are reported.
Hemant P. Yennawar, Michaela J. Buchwalter, Baylee K. Colburn, Lee J. Silverberg   +3 more
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Crystal structures of two (Z)-2-(4-oxo-1,3-thiazolidin-2-ylidene)acetamides

Acta Crystallographica Section E: Crystallographic Communications, 2017
The crystal structures of two (oxothiazolidin-2-ylidene)acetamides, namely (Z)-2-[2-(morpholin-4-yl)-2-oxoethylidene]thiazolidin-4-one, C9H12N2O3S, (I), and (Z)-N-(4-methoxyphenyl)-2-(4-oxothiazolidin-2-ylidene)acetamide, C12H12N2O3S, (II), are described
Aleksei Galushchinskiy, Pavel Slepukhin, Konstantin Obydennov   +2 more
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Crystal structures of two (±)-exo-N-isobornylacetamides

Acta Crystallographica Section E: Crystallographic Communications, 2015
The title compounds consist of a bornane skeleton with attached acetamide, C12H21NO (±)-(1) {systematic name: (±)-N-[(1RS,2RS,4RS)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl]acetamide}, and chloroacetamide, C12H20ClNO (±)-(2) {systematic name: (±)-2-chloro-
Dmitrijs Stepanovs, Daniels Posevins, Maris Turks   +2 more
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Crystal structure of mandipropamid [PDF]

Acta Crystallographica Section E Crystallographic Communications, 2015
In the title compound, C23H22ClNO4(systematic name: (RS)-2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-ynyloxy)acetamide), an amide fungicide, the dihedral angle between the chlorobenzene and benzene rings is 65.36 (6)°.
Hyunjin Park, Jineun Kim, Gihaeng Kang, Tae Ho Kim   +3 more
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Crystal structures of three N-(arylsulfonyl)-4-fluorobenzamides

Acta Crystallographica Section E: Crystallographic Communications, 2016
The crystal structures of three N-arylsulfonyl-4-fluorobenzamides, namely 4-fluoro-N-(2-methylphenylsulfonyl)benzamide, C14H12FNO3S, (I), N-(2-chlorophenylsulfonyl)-4-fluorobenzamide, C13H9ClFNO3S, (II), and N-(4-chlorophenylsulfonyl)-4-fluorobenzamide ...
P. A. Suchetan, S. Naveen, N. K. Lokanath, K. S. Srivishnu, G. M. Supriya, H. N. Lakshmikantha   +5 more
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Crystal structure of cafenstrole [PDF]

Acta Crystallographica Section E Crystallographic Communications, 2015
The title compound (systematic name:N,N-diethyl-3-mesitylsulfonyl-1H-1,2,4-triazole-1-carboxamide), C16H22N4O3S, is a triazole herbicide. The dihedral angle between the planes of the triazole and benzene ring planes is 88.14 (10)°. In the crystal, C—H...O hydrogen bonds and weak C—H...π interactions link adjacent molecules, forming one-dimensional ...
Gihaeng Kang, Jineun Kim, Hyunjin Park, Tae Ho Kim   +3 more
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Crystal structures of two triazola-dioxola-benzenacyclononaphanes

Acta Crystallographica Section E: Crystallographic Communications, 2015
In the title compounds, C25H29BrN5O7, (I) [systematic name: (Z)-15-bromo-32,32-dimethyl-21-nitro-22,23,25,26,27,27a,33a,35,36,36a-decahydro-21H,61H-4,9-dioxa-2(3,2)-pyrrolizina-6(4,1)-triazola-3(5,6)-furo[2,3-d][1,3]dioxola-1(1,2)-benzenacyclononaphane],
Vijayan Viswanathan, Naga Siva Rao, Raghavachary Raghunathan, Devadasan Velmurugan   +3 more
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