Crystallography Open Database

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2021414 CIF
HKL
Paper
C28 H22 O8 S2C 1 2/c 18.2311; 13.322; 22.7038
90; 95.864; 90
2476.55Tan, Sang Loon; Tiekink, Edward R. T.
A 1:2 co-crystal of 2,2′-dithiodibenzoic acid and benzoic acid: crystal structure, Hirshfeld surface analysis and computational study
Acta Crystallographica Section E Crystallographic Communications, 2019, 75, 1
2021424 CIF
HKL
Paper
C54 H48 Cl Ir N2 P4P 1 21/n 118.3264; 13.6459; 19.301
90; 101.803; 90
4724.74Partl, Gabriel Julian; Nussbaumer, Felix; Schuh, Walter; Kopacka, Holger; Wurst, Klaus; Peringer, Paul
Crystal structures of two PCN pincer iridium complexes and one PCP pincer carbodiphosphorane iridium intermediate: substitution of one phosphine moiety of a carbodiphosphorane by an organic azide
Acta Crystallographica Section E Crystallographic Communications, 2019, 75, 75
2021425 CIF
HKL
Paper
C62 H55 Cl5 Ir N3 P4P b c n28.1283; 19.0989; 23.6339
90; 90; 90
12696.6Partl, Gabriel Julian; Nussbaumer, Felix; Schuh, Walter; Kopacka, Holger; Wurst, Klaus; Peringer, Paul
Crystal structures of two PCN pincer iridium complexes and one PCP pincer carbodiphosphorane iridium intermediate: substitution of one phosphine moiety of a carbodiphosphorane by an organic azide
Acta Crystallographica Section E Crystallographic Communications, 2019, 75, 75
2021426 CIF
HKL
Paper
C60 H56 Cl Ir N4 O2 P4P -111.1683; 12.7805; 20.0591
98.475; 93.122; 109.336
2655.76Partl, Gabriel Julian; Nussbaumer, Felix; Schuh, Walter; Kopacka, Holger; Wurst, Klaus; Peringer, Paul
Crystal structures of two PCN pincer iridium complexes and one PCP pincer carbodiphosphorane iridium intermediate: substitution of one phosphine moiety of a carbodiphosphorane by an organic azide
Acta Crystallographica Section E Crystallographic Communications, 2019, 75, 75
2021433 CIF
HKL
Paper
C98 H94 N8 O16C 1 2/c 119.173; 20.756; 21.771
90; 110.718; 90
8103.6Pinalli, Roberta; Trzciński, Jakub W.; Dalcanale, Enrico; Massera, Chiara
A new, deep quinoxaline-based cavitand receptor for the complexation of benzene
Acta Crystallographica Section E Crystallographic Communications, 2019, 75, 103
2021536 CIF
HKL
Paper
C62 H80 Gd2 N8 O16P -19.8778; 12.872; 14.8025
69.092; 74.786; 70.324
1633.7Barbosa, Guilherme Augusto; Santana, Francielli Sousa; Nunes, Giovana Gioppo; Soares, Jaísa Fernandes
Crystal structures of binuclear complexes of gadolinium(III) and dysprosium(III) with oxalate bridges and chelating N,N′-bis(2-oxidobenzyl)-N,N′-bis(pyridin-2-ylmethyl)ethylenediamine (bbpen2−)
Acta Crystallographica Section E Crystallographic Communications, 2019, 75, 418
2021537 CIF
HKL
C62 H80 Dy2 N8 O16P -19.883; 12.838; 14.832
68.213; 74.653; 70.552
1626.2Barbosa, Guilherme Augusto; Santana, Francielli Sousa; Nunes, Giovana Gioppo; Soares, Jaísa Fernandes
Crystal structures of binuclear complexes of gadolinium(III) and dysprosium(III) with oxalate bridges and chelating N,N′-bis(2-oxidobenzyl)-N,N′-bis(pyridin-2-ylmethyl)ethylenediamine (bbpen2−)
Acta Crystallographica Section E Crystallographic Communications, 2019, 75, 418
2021560 CIF
Paper
C8 H3 F2 Mn O6 SP 1 21/c 16.3503; 14.9583; 12.3127
90; 97.149; 90
1160.49Daran, Jean-Claude; Morales-Cerrada, Roberto; Fliedel, Christophe; Gayet, Florence; Ladmiral, Vincent; Ameduri, Bruno; Poli, Rinaldo
Crystal structure of pentacarbonyl(2,2-difluoropropanethioato-κS)manganese(I)
Acta Crystallographica Section E Crystallographic Communications, 2019, 75, 529
2021615 CIF
HKL
Paper
C23 H34 N2 O4F d d d14.358; 17.333; 38.902
90; 90; 90
9681Wang, Haijing; Yin, Zhenming
Crystal structure and Hirshfeld surface analysis of dibutyl 5,5′-(pentane-3,3-diyl)bis(1H-pyrrole-5-carboxylate)
Acta Crystallographica Section E Crystallographic Communications, 2019, 75, 711
2021657 CIF
HKL
Paper
C20 H18 N O3 PP 21 21 218.317; 12.657; 16.763
90; 90; 90
1764.6Trush, Victor A.; Kariaka, Nataliia S.; Dyakonenko, Viktoriya V.; Shishkina, Svitlana V.; Amirkhanov, Vladimir M.
Crystal structure of N-(diphenylphosphoryl)-2-methoxybenzamide
Acta Crystallographica Section E Crystallographic Communications, 2019, 75, 939
2021694 CIF
HKL
Paper
C8 H6 Cl F3 N2 O SP 1 21/c 115.737; 8.526; 7.761
90; 100.45; 90
1024Mondal, Pradip Kumar; T, Athulbabu; Rao, Varun; Chopra, Deepak
Crystal structure analysis of the biologically active drug molecule riluzole and riluzolium chloride
Acta Crystallographica Section E Crystallographic Communications, 2019, 75, 1084
2021695 CIF
HKL
C8 H5 F3 N2 O SP -18.0824; 11.788; 19.745
78.449; 84.378; 89.318
1834.2Mondal, Pradip Kumar; T, Athulbabu; Rao, Varun; Chopra, Deepak
Crystal structure analysis of the biologically active drug molecule riluzole and riluzolium chloride
Acta Crystallographica Section E Crystallographic Communications, 2019, 75, 1084
2021760 CIF
HKL
Paper
C30 H29 N OP 21 21 217.3009; 11.0552; 30.006
90; 90; 90
2421.9Ben Ali, Karim; Retailleau, Pascal
Crystal structure of (1S,2R)-2-[(3R,4S)-3-methyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-yl]-1,2-diphenylethanol
Acta Crystallographica Section E Crystallographic Communications, 2019, 75, 1399
2021794 CIF
Paper
C15 H24 O3P 63 c m9.9966; 9.9966; 7.9461
90; 90; 120
687.68Shorunov, Sergey V.; Bermeshev, Maxim V.; Demchuk, Dmitry V.; Nelyubina, Yulia V.
Synthesis and structure of 2,4,6-tricyclobutyl-1,3,5-trioxane
Acta Crystallographica Section E Crystallographic Communications, 2019, 75, 1578
2242776 CIF
HKL
Paper
C9 H10 O3P 1 21/c 17.6152; 15.5513; 7.5891
90; 115.883; 90
808.59Brugman, Sander J. T.; Engwerda, Anthonius H. J.; Kalkman, Emma; de Ronde, Erik; Tinnemans, Paul; Vlieg, Elias
The crystal structures of four dimethoxybenzaldehyde isomers
Acta Crystallographica Section E, 2019, 75, 38-42
2242777 CIF
HKL
C9 H10 O3P 1 21/c 115.1575; 3.9638; 14.6181
90; 113.839; 90
803.35Brugman, Sander J. T.; Engwerda, Anthonius H. J.; Kalkman, Emma; de Ronde, Erik; Tinnemans, Paul; Vlieg, Elias
The crystal structures of four dimethoxybenzaldehyde isomers
Acta Crystallographica Section E, 2019, 75, 38-42
2242778 CIF
HKL
C9 H10 O3P 1 21/n 13.878; 11.5513; 17.8153
90; 91.808; 90
797.66Brugman, Sander J. T.; Engwerda, Anthonius H. J.; Kalkman, Emma; de Ronde, Erik; Tinnemans, Paul; Vlieg, Elias
The crystal structures of four dimethoxybenzaldehyde isomers
Acta Crystallographica Section E, 2019, 75, 38-42
2242779 CIF
HKL
C9 H10 O3P 1 21/c 111.7602; 13.8957; 11.4352
90; 118.642; 90
1640.03Brugman, Sander J. T.; Engwerda, Anthonius H. J.; Kalkman, Emma; de Ronde, Erik; Tinnemans, Paul; Vlieg, Elias
The crystal structures of four dimethoxybenzaldehyde isomers
Acta Crystallographica Section E, 2019, 75, 38-42
2242780 CIF
HKL
Paper
C10 H8 Cl2 N2 OP 1 21/n 112.1783; 5.7217; 14.8258
90; 95.74; 90
1027.89Chkirate, Karim; Kansiz, Sevgi; Karrouchi, Khalid; Mague, Joel T.; Dege, Necmi; Essassi, El Mokhtar
Crystal structure and Hirshfeld surface analysis of a new benzodiazepine derivative: 4-dichloromethyl-2,3-dihydro-1<i>H</i>-1,5-benzodiazepin-2-one
Acta Crystallographica Section E, 2019, 75, 33-37
2242781 CIF
HKL
Paper
C8 H8 O3P 1 21/c 13.8018; 15.6027; 11.9755
90; 90.889; 90
710.28Chia, Tze Shyang; Kwong, Huey Chong; Wong, Qin Ai; Quah, Ching Kheng; Arafath, Md. Azharul
Crystal structure of a second monoclinic polymorph of 3-methoxybenzoic acid with <i>Z</i>' = 1
Acta Crystallographica Section E, 2019, 75, 8-11
2242782 CIF
HKL
Paper
C21 H25 N3 OC 1 2/c 144.4837; 4.7293; 18.3432
90; 106.965; 90
3691.05Rayni, Ibtissam; El Bakri, Youness; Lai, Chin-Hung; El Ghayati, L'houssaine; Essassi, El Mokhtar; Mague, Joel T.
Synthesis, crystal structure, DFT calculations and Hirshfeld surface analysis of 2-(1-decyl-2-oxoindolin-3-ylidene)propanedinitrile
Acta Crystallographica Section E, 2019, 75, 21-25
2242783 CIF
HKL
Ca2 O8 Te3C m c m18.7368; 6.8399; 18.5652
90; 90; 90
2379.3Weil, Matthias
Ca~2~Te~3~O~8~, a new phase in the CaO‒TeO~2~ system
Acta Crystallographica Section E, 2019, 75, 26-29
2242784 CIF
HKL
Paper
O3 Pd Sr2I m m m3.5342; 3.9822; 12.8414
90; 90; 90
180.73Thakur, Gohil S.; Reuter, Hans; Felser, Claudia; Jansen, Martin
Redetermination of Sr~2~PdO~3~ from single-crystal X-ray data
Acta Crystallographica Section E, 2019, 75, 30-32
2242785 CIF
HKL
Paper
C15 H10 F N O3P 1 21/c 13.886; 13.2324; 24.199
90; 91.963; 90
1243.6Wong, Qin Ai; Chia, Tze Shyang; Kwong, Huey Chong; Chidan Kumar, C. S.; Quah, Ching Kheng; Arafath, Md. Azharul
Crystal structure and Hirshfeld surface analysis of a chalcone derivative: (<i>E</i>)-3-(4-fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one
Acta Crystallographica Section E, 2019, 75, 53-57
2242786 CIF
HKL
Paper
C18 H54 Er2 O36R -314.0947; 14.0947; 18.0603
90; 90; 120
3107.19Ponjan, Nutcha; Kodchasanthong, Kenika; Jiajaroen, Suwadee; Chainok, Kittipong
Crystal structure of poly[[hexaaquatris(μ-3,6-dioxocyclohexa-1,4-diene-1,4-diolato)dierbium(III)] octadecahydrate]
Acta Crystallographica Section E, 2019, 75, 64-67
2242787 CIF
HKL
Paper
C15 H11 Br Cl N3P -17.6218; 8.5238; 11.1093
95.739; 98.88; 94.979
705.66Bourichi, Selma; Kandri Rodi, Youssef; Hökelek, Tuncer; Haoudi, Amal; Renard, Catherine; Capet, Frédéric
Crystal structure and Hirshfeld surface analysis of 4-allyl-6-bromo-2-(4-chlorophenyl)-4<i>H</i>-imidazo[4,5-<i>b</i>]pyridine
Acta Crystallographica Section E, 2019, 75, 43-48
2242788 CIF
HKL
Paper
C15 H10 Br F OP -16.009; 10.8695; 20.5616
102.803; 96.938; 97.276
1283.57Zaini, Muhamad Fikri; Razak, Ibrahim Abdul; Anis, Mohamad Zahid; Arshad, Suhana
Crystal structure, Hirshfeld surface analysis and DFT studies of (<i>E</i>)-1-(4-bromophenyl)-3-(3-fluorophenyl)prop-2-en-1-one
Acta Crystallographica Section E, 2019, 75, 58-63
2242789 CIF
HKL
Paper
C17 H10 N2 O4C 1 2/c 126.296; 7.9996; 16.987
90; 129.165; 90
2770.5Chia, Tze Shyang; Kwong, Huey Chong; Sim, Ai Jia; Ng, Weng Zhun; Wong, Qin Ai; Chidan Kumar, C. S.; Quah, Ching Kheng; Arafath, Md. Azharul
Conformational dimorphism of 2,2'-methylenebis(isoindoline-1,3-dione)
Acta Crystallographica Section E, 2019, 75, 49-52
2242790 CIF
HKL
Paper
C25 H24 F3 N3 O7P 1 21/n 110.4324; 16.5656; 14.0448
90; 100.707; 90
2385Feng, Sheng; Zhu, Gui-Liang; Sun, Jia-Jia; Chen, Chen; Zhang, Zhi-Hui
Crystal structure of (<i>RS</i>)-4-(3-carboxy-1-ethyl-6,8-difluoro-4-oxo-1,4-dihydroquinolin-7-yl)-2-methylpiperazin-1-ium 3-carboxy-5-fluorobenzoate
Acta Crystallographica Section E, 2019, 75, 68-70
2242791 CIF
HKL
Paper
C12 H10 N6P 1 21/n 15.4603; 12.7845; 15.6474
90; 97.281; 90
1083.49Wzgarda-Raj, Kinga; Rybarczyk-Pirek, Agnieszka J.; Wojtulewski, Sławomir; Palusiak, Marcin
Crystal structure of 3,6-bis(pyridin-2-yl)-1,4-dihydro-1,2,4,5-tetrazine
Acta Crystallographica Section E, 2019, 75, 86-88
2242792 CIF
HKL
Paper
C16 H20 N2 O6 S2C 1 2/c 116.3393; 13.4977; 9.7461
90; 113.442; 90
1972Meral, Seher; Kansiz, Sevgi; Dege, Necmi; Alaman Agar, Aysen; Tsapyuk, Galyna G.
Crystal structure and Hirshfeld surface analysis of <i>N</i>,<i>N</i>'-[ethane-1,2-diylbis(oxy)]bis(4-methylbenzenesulfonamide)
Acta Crystallographica Section E, 2019, 75, 81-85
2242793 CIF
HKL
Paper
C20 H17 N3 O3P 1 21/c 110.509; 7.435; 21.367
90; 103.041; 90
1626El Ghayati, Lhoussaine; Ramli, Youssef; Hökelek, Tuncer; Labd Taha, Mohamed; Mague, Joel T.; Essassi, El Mokhtar
Crystal structure and Hirshfeld surface analysis of 3,4-dihydro-2-(2,4-dioxo-6-methylpyran-3-ylidene)-4-(4-pyridin-4-yl)-1,5-benzodiazepine
Acta Crystallographica Section E, 2019, 75, 94-98
2242794 CIF
HKL
Paper
C17 H14 N4 O3P 1 21/c 17.8595; 11.8831; 15.5716
90; 101.853; 90
1423.3Boulhaoua, Mohammed; Kansiz, Sevgi; El Hafi, Mohamed; Lahmidi, Sanae; Dege, Necmi; Benchidmi, Mohammed; Mague, Joel T.
Crystal structure and Hirshfeld surface analysis of 5-[(5-nitro-1<i>H</i>-indazol-1-yl)methyl]-3-phenyl-4,5-dihydroisoxazole
Acta Crystallographica Section E, 2019, 75, 71-74
2242795 CIF
HKL
C15 H9 N3 S2P 1 21/c 15.25147; 14.1093; 17.769
90; 92.0296; 90
1315.76Popek, Rafal; Crundwell, Guy
Crystal structures of 2,3-bis(thiophen-2-yl)pyrido[2,3-<i>b</i>]pyrazine and 7-bromo-2,3-bis(thiophen-2-yl)pyrido[2,3-<i>b</i>]pyrazine
Acta Crystallographica Section E, 2019, 75, 89-93
2242796 CIF
HKL
C15 H8 Br N3 S2P 1 21/c 15.8336; 29.4731; 8.316
90; 95.466; 90
1423.3Popek, Rafal; Crundwell, Guy
Crystal structures of 2,3-bis(thiophen-2-yl)pyrido[2,3-<i>b</i>]pyrazine and 7-bromo-2,3-bis(thiophen-2-yl)pyrido[2,3-<i>b</i>]pyrazine
Acta Crystallographica Section E, 2019, 75, 89-93
2242797 CIF
HKL
Paper
C20 H21 N O2P 1 21/c 112.8487; 10.8187; 11.8469
90; 112.248; 90
1524.2Lamoureux, Guy; Alvarado-Rojas, Mónica; Pineda, Leslie W.
Crystal structure of 4-[(adamantan-1-yl)amino]naphthalene-1,2-dione
Acta Crystallographica Section E, 2019, 75, 99-102
2242798 CIF
HKL
C48 H34 Co N14 O2C 1 2/c 122.335; 10.9454; 18.721
90; 110.691; 90
4281.4Benabdallah, Jamila; Setifi, Zouaoui; Setifi, Fatima; Boughzala, Habib; Titi, Abderrahim
Crystal structure of tris(2,2'-bipyridine)cobalt(II) bis(1,1,3,3-tetracyano-2-ethoxypropenide)
Acta Crystallographica Section E, 2019, 75, 142-145
2242799 CIF
HKL
Paper
C42 H34 N6 O11 Sc2P b c a13.6092; 21.588; 26.5297
90; 90; 90
7794.3Lorenz, Volker; Liebing, Phil; Hilfert, Liane; Busse, Sabine; Edelmann, Frank T.
An unsymmetrical dinuclear scandium complex comprising salophen ligands [H~2~salophen = <i>N</i>,<i>N</i>'-bis(salicylidene)-1,2-phenylenediamine]
Acta Crystallographica Section E, 2019, 75, 175-178
2242800 CIF
HKL
Paper
C15 H17 N O2C 1 2/c 125.913; 5.9021; 19.0842
90; 114.692; 90
2651.9Hess, David; Mayer, Peter
The crystal structures of benzylammonium phenylacetate and its hydrate
Acta Crystallographica Section E, 2019, 75, 194-201
2242801 CIF
HKL
C15 H19 N O3P 1 21/n 16.8235; 7.8766; 26.364
90; 93.218; 90
1414.7Hess, David; Mayer, Peter
The crystal structures of benzylammonium phenylacetate and its hydrate
Acta Crystallographica Section E, 2019, 75, 194-201
2242802 CIF
HKL
Paper
C8 H5 Ag N2 O4 S2P 1 21/c 15.8613; 5.018; 18.278
90; 98.303; 90
531.96Meundaeng, Natthaya; Rujiwatra, Apinpus; Prior, Timothy J.
Crystal structure of (1,3-thiazole-2-carboxylato-κ<i>N</i>)(1,3-thiazole-2-carboxylic acid-κ<i>N</i>)silver(I)
Acta Crystallographica Section E, 2019, 75, 185-188
2242803 CIF
HKL
Paper
C19 H19 F N2 O3P 1 21/n 112.2358; 10.3185; 14.231
90; 111.199; 90
1675.2Mahesha, Ninganayaka; Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Furuya, Tetsundo; Haraguchi, Tomoyuki; Akitsu, Takashiro; Glidewell, Christopher
Three closely related 1-[(1,3-benzodioxol-5-yl)methyl]-4-(halobenzoyl)piperazines: similar molecular structures but different intermolecular interactions
Acta Crystallographica Section E, 2019, 75, 202-207
2242804 CIF
HKL
Paper
C19 H18 F2 N2 O3P c a 2114.2762; 15.9821; 7.3753
90; 90; 90
1682.78Mahesha, Ninganayaka; Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Furuya, Tetsundo; Haraguchi, Tomoyuki; Akitsu, Takashiro; Glidewell, Christopher
Three closely related 1-[(1,3-benzodioxol-5-yl)methyl]-4-(halobenzoyl)piperazines: similar molecular structures but different intermolecular interactions
Acta Crystallographica Section E, 2019, 75, 202-207
2242805 CIF
HKL
Paper
C19 H18 Cl2 N2 O3P 1 21/n 112.2889; 12.3034; 13.3667
90; 116.295; 90
1811.9Mahesha, Ninganayaka; Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Furuya, Tetsundo; Haraguchi, Tomoyuki; Akitsu, Takashiro; Glidewell, Christopher
Three closely related 1-[(1,3-benzodioxol-5-yl)methyl]-4-(halobenzoyl)piperazines: similar molecular structures but different intermolecular interactions
Acta Crystallographica Section E, 2019, 75, 202-207
2242806 CIF
HKL
Paper
C15 H10 Br F OP -15.9255; 7.5867; 14.1427
89.774; 82.671; 87.712
630.09Atioğlu, Zeliha; Bindya, S.; Akkurt, Mehmet; Chidan Kumar, C. S.
Crystal structure and Hirshfeld surface analysis of (2<i>E</i>)-1-(3-bromophenyl)-3-(4-fluorophenyl)prop-2-en-1-one
Acta Crystallographica Section E, 2019, 75, 146-149
2242807 CIF
HKL
Paper
C13 H7 Cl3 O SP 1 21/c 13.9017; 22.038; 15.127
90; 96.998; 90
1291Murthy, T. N. Sanjeeva; Atioğlu, Zeliha; Akkurt, Mehmet; Veeraiah, M. K.; Quah, Ching Kheng; Chidan Kumar, C. S.; Siddaraju, B. P.
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-3-(2-chlorophenyl)-1-(2,5-dichlorothiophen-3-yl)prop-2-en-1-one
Acta Crystallographica Section E, 2019, 75, 124-128
2242808 CIF
HKL
Paper
C34 H28 Cl N3 O3 SP -111.8222; 14.7535; 19.5055
68.396; 78.555; 87.302
3099Vishnupriya, R.; Venkateshan, M.; Suresh, J.; Sumesh, R. V.; Kumar, R. Ranjith; Lakshman, P. L. Nilantha
Crystal structure of 7'-(4-chlorophenyl)-2''-(4-methoxyphenyl)-7',7a',7'',8''-tetrahydro-1'<i>H</i>,3'<i>H</i>,5''<i>H</i>-dispiro[indoline-3,5'-pyrrolo[1,2-<i>c</i>]thiazole-6',6''-quinoline]-2,5''-dione and an unknown solvent
Acta Crystallographica Section E, 2019, 75, 189-193
2242809 CIF
HKL
Paper
C11 H13 Cl Co N O3P c a 2114.7269; 6.7024; 11.7607
90; 90; 90
1160.85Jochriem, Markus; Wurst, Klaus; Kopacka, Holger; Bildstein, Benno
Crystal structures of 1'-aminocobaltocenium-1-carboxylic acid chloride monohydrate and of its azo dye 1'-[2-(1-amino-2,6-dimethylphenyl)diazen-1-yl]cobaltocenium-1-carboxylic acid hexafluoridophosphate monohydrate
Acta Crystallographica Section E, 2019, 75, 208-213
2242810 CIF
HKL
Paper
C19 H21 Co F6 N3 O3 PP -17.9891; 9.431; 15.5425
74.415; 78.183; 73.798
1072.48Jochriem, Markus; Wurst, Klaus; Kopacka, Holger; Bildstein, Benno
Crystal structures of 1'-aminocobaltocenium-1-carboxylic acid chloride monohydrate and of its azo dye 1'-[2-(1-amino-2,6-dimethylphenyl)diazen-1-yl]cobaltocenium-1-carboxylic acid hexafluoridophosphate monohydrate
Acta Crystallographica Section E, 2019, 75, 208-213
2242811 CIF
HKL
Paper
F8 Li4 ZrP n m a9.5959; 9.6218; 5.6735
90; 90; 90
523.83Chemey, Alexander T.; Albrecht-Schmitt, Thomas E.
Redetermination of the crystal structure of tetralithium octafluoridozirconate(IV), Li~4~ZrF~8~, from single-crystal X-ray data
Acta Crystallographica Section E, 2019, 75, 139-141
2242812 CIF
HKL
C21 H17 Cl2 N3P -110.5375; 10.8479; 16.8936
82.261; 88.543; 84.93
1905.85Rajesh, Rajagopal; Sella, E. S.; Blacque, Olivier; Rajesh, Kunjanpillai
Crystal structure of a new 2,6-bis(imino)pyridine derivative: (1<i>E</i>,1'<i>E</i>)-1,1'-(pyridine-2,6-diyl)bis[<i>N</i>-(4-chlorophenyl)ethan-1-imine]
Acta Crystallographica Section E, 2019, 75, 115-118
2242813 CIF
HKL
C34 H38 O9P 21 21 2111.8027; 13.2843; 19.0835
90; 90; 90
2992.1Kumar, Rajesh; Ogbeide, K. Osahon; Mujeeb-Ur-Rehman; Owolabi, Bodunde; Falodun, Abiodun; Choudhary, M. Iqbal; Yousuf, Sammer
Crystal structure, Hirshfeld surface analysis and electrostatic potential study of naturally occurring cassane-type diterpenoid Pulcherrimin C monohydrate at 100K
Acta Crystallographica Section E, 2019, 75, 119-123
2242814 CIF
HKL
Paper
C15 H16 N O4.5C 1 2/c 124.742; 5.5002; 19.387
90; 98.292; 90
2610.7Kamaal, Saima; Faizi, Md. Serajul Haque; Ali, Arif; Ahmad, Musheer; Gupta, Mayank; Dege, Necmi; Iskenderov, Turganbay
Crystal structure of 4-[(2-hydroxy-3-methoxybenzyl)amino]benzoic acid hemihydrate
Acta Crystallographica Section E, 2019, 75, 159-162
2242815 CIF
HKL
Paper
C20 H21 N4 O1.5P -111.546; 12.564; 13.172
101.991; 97.535; 99.847
1813.8Chkirate, Karim; Kansiz, Sevgi; Karrouchi, Khalid; Mague, Joel T.; Dege, Necmi; Essassi, El Mokhtar
Crystal structure and Hirshfeld surface analysis of <i>N</i>-{2-[(<i>E</i>)-(4-methylbenzylidene)amino]phenyl}-2-(5-methyl-1-<i>H</i>-pyrazol-3-yl)acetamide hemihydrate
Acta Crystallographica Section E, 2019, 75, 154-158
2242816 CIF
HKL
Paper
C17 H17 N3 OP -110.214; 10.5133; 15.3297
106.652; 99.111; 97.416
1530.51Saritha, S. R.; Anitha, L.; Layana, S. R.; Sithambaresan, M.; Sudarsanakumar, M. R.
Crystal structure of 2-[(2<i>E</i>)-2-methyl-3-phenylprop-2-en-1-ylidene]-<i>N</i>-phenylhydrazinecarboxamide
Acta Crystallographica Section E, 2019, 75, 163-166
2242817 CIF
HKL
Paper
C15 H15 I N4 OP 1 21/n 19.6417; 13.604; 12.174
90; 105.155; 90
1541.3Mahesha, Ninganayaka; Yathirajan, Hemmige S.; Furuya, Tetsundo; Akitsu, Takashiro; Glidewell, Christopher
The crystal structure of 1-(2-iodobenzoyl)-4-(pyrimidin-2-yl)piperazine: a three-dimensional hydrogen-bonded framework, augmented by π‒π stacking interactions and I···N halogen bonds
Acta Crystallographica Section E, 2019, 75, 129-133
2242818 CIF
HKL
Paper
C4 H10 Cl Li N2 O8P 1 21/c 112.7792; 5.2144; 15.6368
90; 111.808; 90
967.4Revathi, Palanisamy; Mohan, Janani S.; Balakrishnan, Thangavelu; Ramamurthi, Kandasamy; Thamotharan, Subbiah
Crystal structure and Hirshfeld surface analysis of poly[[di-μ~3~-glycine-lithium] perchlorate]
Acta Crystallographica Section E, 2019, 75, 134-138
2242819 CIF
Paper
C15 H13 Br N2 OP n a 219.6002; 11.5584; 12.5823
90; 90; 90
1396.2Anitha, Azhagan Ganapathi; Arunagiri, Chidambaram; Subashini, Annamalai
Synthesis, X-ray crystal structure, Hirshfeld surface analysis and DFT studies of (<i>E</i>)-<i>N</i>'-(2-bromobenzylidene)-4-methylbenzohydrazide
Acta Crystallographica Section E, 2019, 75, 109-114
2242820 CIF
Paper
C32 H25 Cl N2 O4P -110.6777; 11.6095; 12.6037
98.383; 105.378; 115.522
1297.32Syed Abuthahir, S.; NizamMohideen, M.; Viswanathan, V.; Velmurugan, D.; Nagasivarao, J.
The crystal structures of 6'-(4-chlorophenyl)- and 6'-(4-methoxyphenyl)-6a'-nitro-6a',6b',7',9',10',12a'-hexahydro-2<i>H</i>,6'<i>H</i>,8'<i>H</i>-spiro[acenaphthylene-1,12'-chromeno[3,4-<i>a</i>]indolizin]-2-one
Acta Crystallographica Section E, 2019, 75, 218-222
2242821 CIF
Paper
C33 H28 N2 O5P 1 21/n 119.8942; 13.6097; 20.7822
90; 107.268; 90
5373.2Syed Abuthahir, S.; NizamMohideen, M.; Viswanathan, V.; Velmurugan, D.; Nagasivarao, J.
The crystal structures of 6'-(4-chlorophenyl)- and 6'-(4-methoxyphenyl)-6a'-nitro-6a',6b',7',9',10',12a'-hexahydro-2<i>H</i>,6'<i>H</i>,8'<i>H</i>-spiro[acenaphthylene-1,12'-chromeno[3,4-<i>a</i>]indolizin]-2-one
Acta Crystallographica Section E, 2019, 75, 218-222
2242822 CIF
Paper
C6 H6 Na O7 RbP -15.9864; 8.4104; 10.2903
74.798; 76.756; 72.878
471.28Cigler, Andrew J.; Kaduk, James A.
Sodium rubidium hydrogen citrate, NaRbHC~6~H~5~O~7~, and sodium caesium hydrogen citrate, NaCsHC~6~H~5~O~7~: crystal structures and DFT comparisons
Acta Crystallographica Section E, 2019, 75, 223-227
2242823 CIFC6 H6 Na O7 RbP -15.9859; 8.4102; 10.2904
74.7995; 76.7573; 72.8749
471.234Cigler, Andrew J.; Kaduk, James A.
Sodium rubidium hydrogen citrate, NaRbHC~6~H~5~O~7~, and sodium caesium hydrogen citrate, NaCsHC~6~H~5~O~7~: crystal structures and DFT comparisons
Acta Crystallographica Section E, 2019, 75, 223-227
2242824 CIF
Paper
C6 H6 Cs Na O7I 1 2 110.8913; 5.5168; 17.7908
90; 97.014; 90
1060.96Cigler, Andrew J.; Kaduk, James A.
Sodium rubidium hydrogen citrate, NaRbHC~6~H~5~O~7~, and sodium caesium hydrogen citrate, NaCsHC~6~H~5~O~7~: crystal structures and DFT comparisons
Acta Crystallographica Section E, 2019, 75, 223-227
2242825 CIFC6 H6 Cs Na O7I 1 2 110.8918; 5.5166; 17.7909
90; 97.016; 90
1060.97Cigler, Andrew J.; Kaduk, James A.
Sodium rubidium hydrogen citrate, NaRbHC~6~H~5~O~7~, and sodium caesium hydrogen citrate, NaCsHC~6~H~5~O~7~: crystal structures and DFT comparisons
Acta Crystallographica Section E, 2019, 75, 223-227
2242826 CIF
HKL
Paper
C17 H14 OP 21 21 216.10537; 7.58687; 26.8196
90; 90; 90
1242.3Kikuchi, Takuya; Gontani, Saori; Miyanaga, Kyohei; Kurata, Takaaki; Akatani, Yoshiki; Matsumoto, Shinya
Crystal structure of benzyl 2-naphthyl ether, a sensitiser for thermal paper
Acta Crystallographica Section E, 2019, 75, 242-245
2242827 CIF
HKL
Paper
C17 H18 N2 O3P 1 21/n 15.5373; 24.0197; 11.7815
90; 103.488; 90
1523.77Samba, Mohamed; Minnih, Mohamed Said; Hökelek, Tuncer; Kaur, Manpreet; Jasinski, Jerry P.; Sebbar, Nada Kheira; Essassi, El Mokhtar
Synthesis, crystal structure and Hirshfeld surface analysis of 3-(4,4-dimethyl-2,3,4,5-tetrahydro-1<i>H</i>-1,5-benzodiazepin-2-ylidene)-6-methyl-3,4-dihydro-2<i>H</i>-pyran-2,4-dione
Acta Crystallographica Section E, 2019, 75, 228-232
2242828 CIF
HKL
Paper
C14 H8 Cl2 F N3 O2P 1 21/c 115.8644; 7.2242; 12.7595
90; 97.038; 90
1451.32Atioğlu, Zeliha; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Suleymanova, Gulnar T.; Bagirova, Khanim N.; Toze, Flavien A. A.
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-1-[2,2-dichloro-1-(4-nitrophenyl)ethenyl]-2-(4-fluorophenyl)diazene
Acta Crystallographica Section E, 2019, 75, 237-241
2242829 CIF
HKL
Paper
C20 H16 N2 O3 SP 1 21/n 111.3058; 10.0905; 15.1957
90; 101.072; 90
1701.3Pangajavalli, S.; Ranjithkumar, R.; Srinivasan, N.; Ramaswamy, S.; Selvanayagam, S.
Crystal structures of 6a,6b,7,11a-tetrahydro-6<i>H</i>,9<i>H</i>-spiro[chromeno[3',4':3,4]pyrrolo[1,2-<i>c</i>]thiazole-11,3'-indoline]-2',6-dione and 5'-methyl-6a,6b,7,11a-tetrahydro-6<i>H</i>,9<i>H</i>-spiro[chromeno[3',4':3,4]pyrrolo[1,2-<i>c</i>]thiazole-11,3'-indoline]-2',6-dione
Acta Crystallographica Section E, 2019, 75, 246-250
2242830 CIF
HKL
Paper
C21 H18 N2 O3 SP -18.3648; 9.7648; 11.9677
112.622; 99.388; 91.885
885.31Pangajavalli, S.; Ranjithkumar, R.; Srinivasan, N.; Ramaswamy, S.; Selvanayagam, S.
Crystal structures of 6a,6b,7,11a-tetrahydro-6<i>H</i>,9<i>H</i>-spiro[chromeno[3',4':3,4]pyrrolo[1,2-<i>c</i>]thiazole-11,3'-indoline]-2',6-dione and 5'-methyl-6a,6b,7,11a-tetrahydro-6<i>H</i>,9<i>H</i>-spiro[chromeno[3',4':3,4]pyrrolo[1,2-<i>c</i>]thiazole-11,3'-indoline]-2',6-dione
Acta Crystallographica Section E, 2019, 75, 246-250
2242831 CIF
Paper
C14 H12 N4 SP 1 21/n 18.921; 11.6792; 24.702
90; 90.051; 90
2573.7Majoumo-Mbe, Felicite; Ngwang Nfor, Emmanuel; Kenfack Tsobnang, Patrice; Nguepmeni Eloundou, Valoise Brenda; Ngwain Yong, Joseph; Iris Efeti, Ikome
Synthesis, molecular and crystal structure of 1-(1,2-dihydrophthalazin-1-ylidene)-2-[1-(thiophen-2-yl)ethylidene]hydrazine
Acta Crystallographica Section E, 2019, 75, 251-254
2242832 CIF
HKL
Paper
C35 H27 Cl N4 O3P 1 21/c 114.188; 23.445; 18.371
90; 104.541; 90
5915.14Syed Abuthahir, S.; NizamMohideen, M.; Viswanathan, V.; Velmurugan, D.; Nagasivarao, J.
Crystal structure of 6-(4-chlorophenyl)-6a-nitro-6a,6b,8,9,10,12a-hexahydro-6<i>H</i>,7<i>H</i>-spiro[chromeno[3,4-<i>a</i>]indolizine-12,11'-indeno[1,2-<i>b</i>]quinoxaline]
Acta Crystallographica Section E, 2019, 75, 255-259
2242833 CIF
HKL
Paper
C28 H32 N2 O4P 1 21/c 15.7307; 19.733; 22.436
90; 92.4; 90
2534.9Geiger, David K.; Geiger, H. Cristina; Moore, Shawn M.
Intermolecular interactions in a phenol-substituted benzimidazole
Acta Crystallographica Section E, 2019, 75, 272-276
2242834 CIF
HKL
Paper
C12 H13 B Fe O3P 1 21/n 17.7627; 11.7335; 12.7969
90; 98.527; 90
1152.7Preuss, Andrea; Korb, Marcus; Lang, Heinrich
Crystal structure of (2-acetylferrocen-1-yl)boronic acid
Acta Crystallographica Section E, 2019, 75, 268-271
2242835 CIF
HKL
Paper
C80 H88 Cl N O14 P4P 1 21/c 117.5353; 22.4798; 21.2031
90; 109.455; 90
7880.8Biavardi, Elisa; Massera, Chiara
Crystal structure of a host‒guest complex between mephedrone hydrochloride and a tetraphosphonate cavitand
Acta Crystallographica Section E, 2019, 75, 277-283
2242836 CIF
HKL
Paper
C29 H30 N4 Ni O5 S2P 1 21/n 112.0588; 7.5515; 33.0408
90; 94.021; 90
3001.4Wellm, Carsten; Näther, Christian
Crystal structure of bis(4-benzoylpyridine-κ<i>N</i>)bis(methanol-κ<i>O</i>)bis(thiocyanato-κ<i>N</i>)nickel(II) methanol monosolvate
Acta Crystallographica Section E, 2019, 75, 299-303
2242837 CIF
HKL
Paper
C27 H35 N3 O7P -111.2743; 11.2898; 12.6478
111.923; 114.325; 95.903
1296.6Shaibah, Mohammed A. E.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Furuya, Tetsundo; Haraguchi, Tomoyuki; Akitsu, Takashiro; Glidewell, Christopher
Co-crystallization of 3,5-dinitrobenzoic acid with two antipsychotic agents: a simple 1:1 salt with trihexyphenidyl and a 1:2 acid salt containing a very short O—H···O hydrogen bond with chlorprothixene
Acta Crystallographica Section E, 2019, 75, 292-298
2242838 CIF
HKL
Paper
C32 H26 Cl N5 O12 SP 1 21/c 111.3454; 24.3857; 11.6098
90; 93.691; 90
3205.4Shaibah, Mohammed A. E.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Furuya, Tetsundo; Haraguchi, Tomoyuki; Akitsu, Takashiro; Glidewell, Christopher
Co-crystallization of 3,5-dinitrobenzoic acid with two antipsychotic agents: a simple 1:1 salt with trihexyphenidyl and a 1:2 acid salt containing a very short O—H···O hydrogen bond with chlorprothixene
Acta Crystallographica Section E, 2019, 75, 292-298
2242839 CIF
HKL
Paper
C12 H7 Br F4 N2 O2P 1 21/c 113.723; 6.5757; 15.3224
90; 111.841; 90
1283.42Bosch, Eric
Crystal structure of the co-crystal salt 2-amino-6-bromopyridinium 2,3,5,6-tetrafluorobenzoate
Acta Crystallographica Section E, 2019, 75, 284-287
2242840 CIF
HKL
Paper
C15 H16 F6 N O PP 1 21 16.432; 9.3645; 13.607
90; 101.868; 90
802.06Mani, J. Arul Martin; Mercina, M.; Inglebert, S. Antony; Narayanan, P.; Joseph, V.; Sagayaraj, P.
Crystal structure determination of two pyridine derivatives: 4-[(<i>E</i>)-2-(4-methoxyphenyl)ethenyl]-1-methylpyridin-1-ium hexafluoro-λ^6^-phosphane and 4-[(<i>E</i>)-2-[4-(dimethylamino)phenyl]ethenyl]-1-phenyl-1λ^5^-pyridin-1-ylium hexafluoro-λ^6^-phosphane
Acta Crystallographica Section E, 2019, 75, 288-291
2242841 CIF
HKL
Paper
C21 H21 F6 N2 PC 1 c 119.4596; 10.7416; 11.9654
90; 125.864; 90
2026.9Mani, J. Arul Martin; Mercina, M.; Inglebert, S. Antony; Narayanan, P.; Joseph, V.; Sagayaraj, P.
Crystal structure determination of two pyridine derivatives: 4-[(<i>E</i>)-2-(4-methoxyphenyl)ethenyl]-1-methylpyridin-1-ium hexafluoro-λ^6^-phosphane and 4-[(<i>E</i>)-2-[4-(dimethylamino)phenyl]ethenyl]-1-phenyl-1λ^5^-pyridin-1-ylium hexafluoro-λ^6^-phosphane
Acta Crystallographica Section E, 2019, 75, 288-291
2242842 CIF
HKL
C41 H63 N10 O13 PP -115.2043; 17.4555; 18.1232
83.797; 79.818; 89.191
4706.3Wang, Ruyu; Shu, Xi; Fan, Yu; Li, Shoujian; Jin, Yongdong; Xia, Chuanqin; Huang, Chao
Crystal structure of a host‒guest complex of the tris-urea receptor, 3-(4-nitrophenyl)-1,1-bis{2-[3-(4-nitrophenyl)ureido]ethyl}urea, that encapsulates hydrogen-bonded chains of dihydrogen phosphate anions with separate tetra-<i>n</i>-butylammonium counter-ions
Acta Crystallographica Section E, 2019, 75, 319-323
2242843 CIF
HKL
Paper
C32 H41 Cl2 N3 RuC 1 2/c 135.8175; 10.5633; 24.0946
90; 131.781; 90
6797.9Polyanskii, Kirill B.; Alekseeva, Kseniia A.; Kumandin, Pavel A.; Atioğlu, Zeliha; Akkurt, Mehmet; Toze, Flavien A. A.
Crystal structure of [1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ylidene]dichlorido{2-[1-(dimethylamino)ethyl]benzylidene}ruthenium including an unknown solvate
Acta Crystallographica Section E, 2019, 75, 342-345
2242844 CIF
HKL
Paper
C33 H34 Cl N O S SnP 1 21/c 115.36; 18.879; 10.992
90; 102.524; 90
3111.6Yennawar, Hemant P.; Tierney, John; Cannon, Kevin C.
Crystal structure of a 1:1 adduct of triphenyltin chloride with 3-cyclohexhyl-2-phenyl-1,3-thiazolidin-4-one
Acta Crystallographica Section E, 2019, 75, 338-341
2242845 CIF
HKL
C18 H12 F6 N2 Ni O4P 1 21/n 17.0709; 19.8158; 13.1957
90; 99.089; 90
1825.71Demir Kanmazalp, Sibel; Meral, Seher; Dege, Necmi; Alaman Agar, Aysen; Fritsky, Igor O.
Crystal structure and Hirshfeld surfaces analysis of the nickel(II) complex of the Shiff base ligand 6,6'-{(1<i>E</i>,1'<i>E</i>)-[ethane-1,2-diylbis(azanylylidene)]bis(methanylylidene)}bis[2-(trifluoromethoxy)phenol]
Acta Crystallographica Section E, 2019, 75, 328-331
2242846 CIF
HKL
Paper
As2 Cs Ga H2 O8R 3 2 :H8.481; 8.481; 27.05
90; 90; 120
1685Schwendtner, Karolina; Kolitsch, Uwe
CsGa(HAsO~4~)~2~, the first Ga representative of the RbAl(HAsO~4~)~2~ structure type
Acta Crystallographica Section E, 2019, 75, 346-349
2242847 CIF
HKL
Paper
C14 H9 Br Cl2 N2 OP 1 21/c 111.1952; 14.055; 9.305
90; 96.446; 90
1454.9Sivajeyanthi, Palaniyappan; Jeevaraj, Muthaiah; Edison, Bellarmin; Balasubramani, Kasthuri
Crystal structure, Hirshfeld surface analysis and frontier molecular orbital analysis of (<i>E</i>)-4-bromo-<i>N</i>'-(2,3-dichlorobenzylidene)benzohydrazide
Acta Crystallographica Section E, 2019, 75, 324-327
2242848 CIF
HKL
Paper
C32 H74 Cl4 N8 Ni2 O17P 1 21/c 18.906; 29.412; 19.505
90; 107.03; 90
4885Corfield, Peter W. R.; Goedken, Virgil L.
Crystal structures of two nickel(II) macrocyclic salts: (5,7,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane)nickel(II) bis(perchlorate) monohydrate and (5,7,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane)nickel(II) dibromide trihydrate
Acta Crystallographica Section E, 2019, 75, 332-337
2242849 CIF
HKL
C16 H42 Br2 N4 Ni O3F d d 260.3649; 19.8364; 7.9773
90; 90; 90
9552.2Corfield, Peter W. R.; Goedken, Virgil L.
Crystal structures of two nickel(II) macrocyclic salts: (5,7,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane)nickel(II) bis(perchlorate) monohydrate and (5,7,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane)nickel(II) dibromide trihydrate
Acta Crystallographica Section E, 2019, 75, 332-337
2242850 CIF
HKL
Paper
C10 H12 N4 O2 SP 1 21/n 19.051; 11.526; 10.893
90; 90.345; 90
1136.4Phiromphu, Nutchanikan; Chainok, Kittipong; Songsasen, Apisit; Duangthongyou, Tanwawan
Crystal structure of 3-methoxy-4-[2-(thiazol-2-yl)diazen-1-yl]aniline monohydrate
Acta Crystallographica Section E, 2019, 75, 354-357
2242851 CIF
HKL
Paper
C14 H12 Cl N O3P 1 21/c 114.7251; 14.4444; 6.1698
90; 98.241; 90
1298.74Demir Kanmazalp, Sibel; Doĝan, Onur Erman; Taşdemir, Volkan; Dege, Necmi; Aĝar, Erbil; Fritsky, Igor O.
Crystal structure and Hirshfeld surface analysis of a Schiff base: (<i>Z</i>)-6-[(5-chloro-2-methoxyanilino)methylidene]-2-hydroxycyclohexa-2,4-dien-1-one
Acta Crystallographica Section E, 2019, 75, 362-366
2242852 CIF
HKL
Paper
C27 H41 F12 Fe N10 O3 P2P 1 21/c 115.82801; 14.36708; 17.421
90; 112.078; 90
3671.09Znovjyak, Kateryna; Fritsky, Igor O.; Golenya, Iryna A.; Sliva, Tatiana Y.; Haukka, Matti
Crystal structure and magnetic properties of (tris{4-[1-(2-methoxyethyl)imidazol-2-yl]-3-azabut-3-enyl}amine)iron(II) bis(hexafluoridophosphate)
Acta Crystallographica Section E, 2019, 75, 358-361
2242853 CIF
HKL
Paper
C21 H22 K N6 O3.5 S3P -111.8407; 12.6001; 18.8671
90.16; 102.361; 117.933
2411.88Azzam, Rasha A.; Elgemeie, Galal H.; Osman, Rokia R.; Jones, Peter G.
Crystal structure of potassium [4-amino-5-(benzo[<i>d</i>]thiazol-2-yl)-6-(methylsulfanyl)pyrimidin-2-yl](phenylsulfonyl)azanide dimethylformamide monosolvate hemihydrate
Acta Crystallographica Section E, 2019, 75, 367-371
2242854 CIF
HKL
Paper
C16 H18 N2 O3P 1 21/n 17.4069; 8.1959; 24.133
90; 90.295; 90
1465Zaoui, Younes; Ramli, Youssef; Taoufik, Jamal; Mague, Joel T.; Jotani, Mukesh M.; Tiekink, Edward R. T.; Ansar, M'hammed
Ethyl 2-(4-benzyl-3-methyl-6-oxo-1,6-dihydropyridazin-1-yl)acetate: crystal structure and Hirshfeld surface analysis
Acta Crystallographica Section E, 2019, 75, 392-396
2242855 CIF
HKL
Paper
C62 H84 N4 O4P 1 21/n 118.48641; 15.8431; 39.4611
90; 93.0666; 90
11540.9Gall, James H.; MacNicol, David D.; MacSween, Ross; Frampton, Christopher S.
Synthesis and crystal structure of 2,4,6,8-tetrakis(3,5-di-<i>tert</i>-butylphenoxy)pyrimido[5,4-<i>d</i>]pyrimidine: expansion of the Piedfort concept
Acta Crystallographica Section E, 2019, 75, 383-387
2242856 CIF
HKL
Paper
C18 H12 F N O SP -14.0602; 13.8983; 14.262
117.809; 93.155; 94.416
705.96Hni, Brahim; Sebbar, Nada Kheira; Hökelek, Tuncer; Ouzidan, Younes; Moussaif, Ahmed; Mague, Joel T.; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis and DFT study of (2<i>Z</i>)-2-(4-fluorobenzylidene)-4-(prop-2-yn-1-yl)-3,4-dihydro-2<i>H</i>-1,4-benzothiazin-3-one
Acta Crystallographica Section E, 2019, 75, 372-377
2242857 CIF
HKL
Paper
C30 H48 La2 O24P -19.1197; 11.1231; 11.9434
107.049; 107.729; 106.622
1005.21Camara, Magatte; Badiane, Insa; Diallo, Mamoudou; Daiguebonne, Carole; Guillou, Olivier
Synthesis and crystal structure of a new coordination polymer based on lanthanum and 1,4-phenylenediacetate ligands
Acta Crystallographica Section E, 2019, 75, 378-382
2242858 CIF
HKL
C41 H40 O14P -111.7576; 11.9561; 14.1979
91.71; 105.728; 111.98
1762.13Pedrini, Alessandro
Host‒guest supramolecular interactions between a resorcinarene-based cavitand bearing a ‒COOH moiety and acetic acid
Acta Crystallographica Section E, 2019, 75, 397-401
2242859 CIF
HKL
Paper
Fe K3 Ni6 O24 P6C 1 2/m 110.6853; 14.1009; 6.5481
90; 103.842; 90
957.97Ouaatta, Said; Assani, Abderrazzak; Saadi, Mohamed; El Ammari, Lahcen
Crystal structure of a new tripotassium hexanickel iron hexaphosphate
Acta Crystallographica Section E, 2019, 75, 402-404
2242860 CIF
HKL
Paper
C20 H28 Cl N2 P SiC 1 c 113.4004; 15.6272; 10.3817
90; 95.739; 90
2163.14Mo, Dennis; Frank, Walter
Synthesis and crystal structure of 1,3-di-<i>tert</i>-butyl-2-chloro-4,4-diphenyl-1,3,2λ^3^,4-diazaphosphasiletidine
Acta Crystallographica Section E, 2019, 75, 405-409
2242861 CIF
Paper
C6 H5 K Li2 O7P -16.4842; 6.6833; 9.8171
87.637; 80.606; 83.109
416.59Cigler, Andrew J.; Kaduk, James A.
Crystal structure of dilithium potassium citrate, Li~2~KC~6~H~5~O~7~ determined from powder diffraction data and DFT calculations
Acta Crystallographica Section E, 2019, 75, 410-413
2242862 CIFC6 H5 K Li2 O7P -16.4842; 6.6833; 9.8171
87.637; 80.606; 83.109
416.593Cigler, Andrew J.; Kaduk, James A.
Crystal structure of dilithium potassium citrate, Li~2~KC~6~H~5~O~7~ determined from powder diffraction data and DFT calculations
Acta Crystallographica Section E, 2019, 75, 410-413
2242863 CIF
HKL
Paper
C26 H32 F N7 O4C 1 2 121.3758; 9.2781; 13.9722
90; 102.654; 90
2703.75Nerdinger, Sven; Stefinovic, Marijan; Richter, Frank; Olma, Jacek; Brysz, Michal; Walker, Tracy; Kahlenberg, Volker; Gelbrich, Thomas
Crystal structure of idelalisib <i>tert</i>-butanol monosolvate dihydrate
Acta Crystallographica Section E, 2019, 75, 414-417
2242864 CIF
HKL
Paper
C17 H17 N O3P -17.7842; 8.8802; 22.2112
94.791; 97.62; 90.043
1516.37Yaman, Mavişe; Cakmak, Şukriye; Dege, Necmi; Odabaşoğlu, Mustafa; Pavlenko, Vadim A.; Kutuk, Halil
Synthesis, crystal structure, spectroscopic features and Hirshfeld surfaces of 2-methyl-3-[(2-methylphenyl)carbamoyl]phenyl acetate
Acta Crystallographica Section E, 2019, 75, 423-427
2242865 CIF
HKL
Paper
C3 H5 Cl N2 O SP b c a7.5106; 9.314; 17.343
90; 90; 90
1213.2Muthukumar, Manickam; Karthikeyan, Ammasai; Poovarasan, Madehswaran; Ruckmani, Vadivel; Rajaram, Dhanakotti; Jegan Jeniferc, Simson; Abdul Razak, Ibrahim
Redetermination of the crystal structure of 2-oxo-1,3-thiazolidin-4-iminium chloride
Acta Crystallographica Section E, 2019, 75, 443-446
2242866 CIF
HKL
Paper
C29 H30 Fe N7 Ni O5 PP 1 21/c 111.5584; 12.9709; 20.761
90; 103.161; 90
3030.8Sutthirat, Natwara; Ziller, Joseph W.; Yang, Jenny Y.; Thammavongsy, Zachary
Crystal structure of NiFe(CO)~5~[tris(pyridylmethyl)azaphosphatrane]: a synthetic mimic of the NiFe hydrogenase active site incorporating a pendant pyridine base
Acta Crystallographica Section E, 2019, 75, 438-442
2242867 CIF
HKL
Paper
C12 H17 N2 O2.5P -110.8328; 13.2452; 18.1426
111.276; 90.182; 90.125
2425.7Rajeswari, Balakrishnan; Santhi, Radhakrishnan; Sivajeyanthi, Palaniyappan; Balasubramani, Kasthuri
Crystal structure and Hirshfeld surface analysis of 2-(1<i>H</i>-indol-3-yl)ethanaminium acetate hemihydrate
Acta Crystallographica Section E, 2019, 75, 451-455
2242868 CIF
Paper
C56 H66 Al2 O4P -19.2839; 12.0281; 12.5999
108.79; 109.143; 91.866
1243.25Vinogradov, Alexander A.; Minyaev, Mikhail E.; Lyssenko, Konstantin A.; Nifant'ev, Ilya E.
Crystal structure of bis(μ~2~-triphenylacetato-κ<i>O</i>:κ<i>O</i>')bis(diisobutylaluminium)
Acta Crystallographica Section E, 2019, 75, 456-459
2242869 CIF
Paper
Cl2 O8 SrP b c a14.18206; 9.78934; 9.37624
90; 90; 90
1301.73Hyoung, Jooeun; Lee, Hyeon Woo; Kim, So Jin; Shin, Hong Rim; Hong, Seung-Tae
Crystal structure of strontium perchlorate anhydrate, Sr(ClO~4~)~2~, from laboratory powder X-ray diffraction data
Acta Crystallographica Section E, 2019, 75, 447-450
2242870 CIF
HKL
Paper
C22 H22 OP 1 21/n 19.8037; 8.9815; 18.8946
90; 90.985; 90
1663.5Mahdi, Fatiha; Sid, Assia; Bouchene, Rafika; Mosset, Paul; Roisnel, Thierry
(<i>E</i>,<i>E</i>)-3-Methyl-2,5-bis(4-methylbenzylidene)cyclopentanone: synthesis, characterization, Hirshfeld surface analysis and antibacterial activity
Acta Crystallographica Section E, 2019, 75, 506-511
2242871 CIF
HKL
C15 H10 Cl NP b c n13.3417; 7.103; 25.1418
90; 90; 90
2382.6Udayakumar, Mani; Cerón, Margarita; Ceballos, Paulina; Percino, Judith; Thamotharan, Subbiah
Quantitative analysis of weak non-covalent interactions in (<i>Z</i>)-3-(4-chlorophenyl)-2-phenylacrylonitrile: insights from <i>PIXEL</i> and Hirshfeld surface analysis
Acta Crystallographica Section E, 2019, 75, 499-505
2242872 CIF
HKL
Paper
C13 H9 NP 1 21/n 111.28453; 12.38182; 6.67905
90; 92.0618; 90
932.613Stephens, Peter W.; Schur, Einat; Lapidus, Saul H.; Bernstein, Joel
Acridine form IX
Acta Crystallographica Section E, 2019, 75, 489-491
2242873 CIF
HKL
Paper
C15 H12 F3 N O3P n a 2130.79; 9.0703; 4.8579
90; 90; 90
1356.69Demir Kanmazalp, Sibel; Doĝan, Onur Erman; Dege, Necmi; Aĝar, Erbil; Bulbul, Hakan; Golenya, Irina A.
(<i>Z</i>)-3-({[3-Methoxy-5-(trifluoromethyl)phenyl]imino}methyl)benzene-1,2-diol
Acta Crystallographica Section E, 2019, 75, 470-474
2242874 CIF
HKL
Paper
C17 H19 N3 O5P -18.526; 8.8415; 11.9462
88.66; 69.568; 70.724
792.27Syed Abuthahir, S.; NizamMohideen, M.; Viswanathan, V.; Govindhan, M.; Subramanian, K.
The crystal structures of two new coumarin derivatives: 2-(4-{2-[(2-oxo-2<i>H</i>-chromen-4-yl)oxy]acetyl}piperazin-1-yl)acetamide and <i>N</i>-(2,4-dimethoxybenzyl)-2-[(2-oxo-2<i>H</i>-chromen-4-yl)oxy]acetamide
Acta Crystallographica Section E, 2019, 75, 482-488
2242875 CIF
HKL
Paper
C20 H19 N O6P 1 21 17.2779; 8.5759; 14.4099
90; 93.796; 90
897.41Syed Abuthahir, S.; NizamMohideen, M.; Viswanathan, V.; Govindhan, M.; Subramanian, K.
The crystal structures of two new coumarin derivatives: 2-(4-{2-[(2-oxo-2<i>H</i>-chromen-4-yl)oxy]acetyl}piperazin-1-yl)acetamide and <i>N</i>-(2,4-dimethoxybenzyl)-2-[(2-oxo-2<i>H</i>-chromen-4-yl)oxy]acetamide
Acta Crystallographica Section E, 2019, 75, 482-488
2242876 CIF
HKL
C13 H13 Br N4 OP -16.1446; 9.7407; 11.6801
109.657; 92.325; 91.664
657.13Gumus, Mustafa Kemal; Kansiz, Sevgi; Yuksektepe Ataol, Cigdem; Dege, Necmi; Fritsky, Igor O.
Crystal structure and Hirshfeld surface analysis of two 5,11-methanobenzo[<i>g</i>][1,2,4]triazolo[1,5-<i>c</i>][1,3,5]oxadiazocine derivatives
Acta Crystallographica Section E, 2019, 75, 492-498
2242877 CIF
HKL
C18 H17 N5 O2P b c a11.2814; 12.6299; 22.0008
90; 90; 90
3134.7Gumus, Mustafa Kemal; Kansiz, Sevgi; Yuksektepe Ataol, Cigdem; Dege, Necmi; Fritsky, Igor O.
Crystal structure and Hirshfeld surface analysis of two 5,11-methanobenzo[<i>g</i>][1,2,4]triazolo[1,5-<i>c</i>][1,3,5]oxadiazocine derivatives
Acta Crystallographica Section E, 2019, 75, 492-498
2242878 CIF
HKL
Paper
C14 H8 Cl3 F N2P 1 21/c 13.8617; 24.249; 14.724
90; 94.3; 90
1374.9Shikhaliyev, Namiq Q.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Bagirova, Khanim N.; Suleymanova, Gulnar T.; Toze, Flavien A. A.
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-1-(4-chlorophenyl)-2-[2,2-dichloro-1-(4-fluorophenyl)ethenyl]diazene
Acta Crystallographica Section E, 2019, 75, 465-469
2242879 CIF
HKL
Paper
C24 H22 Cl N O7 S2P -17.7487; 7.8575; 21.4486
86.136; 88.693; 65.08
1181.61Tan, Sang Loon; Tiekink, Edward R. T.
A 1:1:1 co-crystal solvate comprising 2,2'-dithiodibenzoic acid, 2-chlorobenzoic acid and <i>N</i>,<i>N</i>-dimethylformamide: crystal structure, Hirshfeld surface analysis and computational study
Acta Crystallographica Section E, 2019, 75, 475-481
2242880 CIF
HKL
Paper
C9 H11 B10 F7P 21 21 216.7872; 11.6926; 19.4863
90; 90; 90
1546.43Watson, James D.; Benton, Amanda; Tricas, Hugo; Rosair, Georgina M.; Welch, Alan J.
Crystal structure of 1-heptafluorotolyl-<i>closo</i>-1,2-dicarbadodecaborane
Acta Crystallographica Section E, 2019, 75, 512-515
2242881 CIF
HKL
Paper
C8 H4 F3 N O4P c c n12.1612; 14.847; 9.8265
90; 90; 90
1774.2Diehl III, George L.; Je, Lisa; Tanski, Joseph M.
Crystallographic and spectroscopic characterization of 4-nitro-2-(trifluoromethyl)benzoic acid and 4-nitro-3-(trifluoromethyl)benzoic acid
Acta Crystallographica Section E, 2019, 75, 524-528
2242882 CIF
HKL
Paper
C8 H4 F3 N O4P 1 21/n 16.8986; 17.24; 7.6912
90; 107.685; 90
871.5Diehl III, George L.; Je, Lisa; Tanski, Joseph M.
Crystallographic and spectroscopic characterization of 4-nitro-2-(trifluoromethyl)benzoic acid and 4-nitro-3-(trifluoromethyl)benzoic acid
Acta Crystallographica Section E, 2019, 75, 524-528
2242883 CIF
HKL
Paper
C13 H24 B N O2C 1 2/c 134.229; 11.1051; 9.2922
90; 96.526; 90
3509.2Ayudhya, Theppawut I.; Rheingold, Arnold L.; Dingra, Nin N.
Crystal structure of memantine‒carboxyborane
Acta Crystallographica Section E, 2019, 75, 543-546
2242884 CIF
HKL
C19 H15 Cl6 N O4I 41/a29.625; 29.625; 10.2427
90; 90; 90
8989.4Manohar, R.; Harikrishna, M.; Etti, S. Harikrishna; Ramanathan, C.; Gunasekaran, K.
Crystal structure of 4,5,6,7,8,8-hexachloro-2-(3,4-dimethoxyphenethyl)-3a,4,7,7a-tetrahydro-1<i>H</i>-4,7-methanoisoindole-1,3(2<i>H</i>)-dione [+solvent]
Acta Crystallographica Section E, 2019, 75, 562-564
2242885 CIF
HKL
Paper
C33 H44 Cu N6 O8P -19.8877; 12.1406; 14.576
71.594; 81.128; 88.249
1640.06Tsymbal, Liudmyla V.; Andriichuk, Irina L.; Arion, Vladimir B.; Lampeka, Yaroslaw D.
Crystal structure of <i>trans</i>-diaqua(3,10-dimethyl-1,3,5,8,10,12-hexaazacyclotetradecane)copper(II) pamoate
Acta Crystallographica Section E, 2019, 75, 533-536
2242886 CIF
HKL
Paper
Cl2 H14 N2 O14 Sc2P -16.7221; 7.6279; 8.5181
100.904; 110.125; 102.329
383.87Sears, Jeremiah; Cramer, Roger; Boyle, Timothy
Crystal structure of hydroxy scandium nitrate chloride
Acta Crystallographica Section E, 2019, 75, 540-542
2242887 CIF
HKL
Paper
C38 H50 N2 O7P 21 21 2110.993; 13.198; 23.799
90; 90; 90
3453Ivantcova, Polina M.; Sokolov, Mikhail N.; Kudryavtsev, Konstantin V.; Churakov, Andrei V.
Crystal structure of 4-[(1<i>R</i>,2<i>S</i>,5<i>R</i>)-2-isopropyl-5-methylcyclohexyl] 2-methyl (2<i>S</i>,4<i>S</i>,5<i>R</i>)-1-[(2<i>S</i>,3<i>R</i>,5<i>R</i>)-5-methoxycarbonyl-2-(2-methylphenyl)pyrrolidine-3-carbonyl]-5-(2-methylphenyl)pyrrolidine-2,4-dicarboxylate
Acta Crystallographica Section E, 2019, 75, 537-539
2242888 CIF
HKL
Paper
C32 H80 Cl6 Na10 O28 Pd2 S8P 1 21/c 115.9049; 9.9047; 22.6734
90; 94.315; 90
3561.69Thoelen, Felix; Frank, Walter
Crystal engineering with short-chained amphiphiles: decasodium octa-<i>n</i>-butanesulfonate di-μ-chlorido-bis[dichloridopalladate(II)] tetrahydrate, a layered inorganic‒organic hybrid material
Acta Crystallographica Section E, 2019, 75, 557-561
2242889 CIF
HKL
Paper
C11 H24 Cl N2 PP 1 21/c 112.5954; 9.1549; 12.9614
90; 101.547; 90
1464.33Mecke, Erik; Frank, Walter
Crystal structure of 1,3-di-<i>tert</i>-butyl-2-chloro-1,3,2-diazaphosphorinane {-} a saturated six-membered phosphorus nitrogen heterocycle with a partially flattened chair conformation and a long P^III^—Cl bond
Acta Crystallographica Section E, 2019, 75, 552-556
2242890 CIF
HKL
Paper
C4 H8 O4 S2C 1 2/m 19.073; 7.077; 5.597
90; 105.894; 90
345.6Harlow, Richard L.; Oliver, Allen G.; Baker, Jonathan M.; Marshall, William J.; Sammes, Michael P.
Comparison of the C—H···O bonding in two crystalline phases of 1,4-dithiane 1,1,4,4-tetraoxide
Acta Crystallographica Section E, 2019, 75, 576-579
2242891 CIF
HKL
Paper
C4 H8 O4 S2P 1 21/n 17.1308; 5.7245; 8.376
90; 91.138; 90
341.84Harlow, Richard L.; Oliver, Allen G.; Baker, Jonathan M.; Marshall, William J.; Sammes, Michael P.
Comparison of the C—H···O bonding in two crystalline phases of 1,4-dithiane 1,1,4,4-tetraoxide
Acta Crystallographica Section E, 2019, 75, 576-579
2242892 CIF
HKL
Paper
C10 H13 N3 O SI b a 214.6474; 17.522; 8.9048
90; 90; 90
2285.4Arafath, Md. Azharul; Kwong, Huey Chong; Adam, Farook
(<i>E</i>)-2-(2-Hydroxy-3-methylbenzylidene)-<i>N</i>-methylhydrazine-1-carbothioamide: supramolecular assemblies in two-dimensions mediated by N—H···S and C—H···π interactions
Acta Crystallographica Section E, 2019, 75, 571-575
2242893 CIF
HKL
Paper
C28 H30 N8 O3P 1 21/c 111.7007; 7.0419; 31.2567
90; 98.379; 90
2547.9Asiri, Abdullah M.; Alzahrani, Khalid A. H.; Faidallah, Hassan M.; Alamry, Khalid A.; Jotani, Mukesh M.; Tiekink, Edward R. T.
Co-crystallization of a neutral molecule and its zwitterionic tautomer: structure and Hirshfeld surface analysis of 5-methyl-4-(5-methyl-1<i>H</i>-pyrazol-3-yl)-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-3-one 5-methyl-4-(5-methyl-1<i>H</i>-pyrazol-2-ium-3-yl)-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-1-ide monohydrate
Acta Crystallographica Section E, 2019, 75, 565-570
2242894 CIF
HKL
C20 H19 N3 O3P 1 21/c 118.451; 8.169; 11.591
90; 100.059; 90
1720.2Faizi, Md. Serajul Haque; Sen, Pratik; Saxena, Gyanesh Kumar; Golenya, Irina A.
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-2-[1-hydroxy-2-(pyridin-2-yl)ethyl]-4-[2-(4-methoxyphenyl)diazen-1-yl]phenol
Acta Crystallographica Section E, 2019, 75, 600-603
2242895 CIF
HKL
Paper
C3 H9 B12 Cl11 N Na O2 SP 21 21 219.1943; 12.9081; 19.4486
90; 90; 90
2308.18Jenne, Carsten; van Lessen, Valentin
Na^+^[Me~3~NB~12~Cl~11~]^{-^}·SO~2~: a rare example of a sodium‒SO~2~ complex
Acta Crystallographica Section E, 2019, 75, 607-610
2242896 CIF
HKL
C14 H30 Cl Cr N3 O9P 1 21 18.2246; 15.1419; 8.6851
90; 93.339; 90
1079.77Saidi, Meriem; Giorgi, Michel; Boukli-hacene, Leila
Sonochemical synthesis and crystal structure of dimethylammonium bis[3-carboxy-2-(dimethylamino)propanoato-κ^2^<i>N</i>,<i>O</i>^1^]chloridochromium(II) monohydrate
Acta Crystallographica Section E, 2019, 75, 604-606
2242897 CIF
HKL
Paper
C28 H37 N3 O13P 1 21 117.7734; 4.97864; 18.7681
90; 114.226; 90
1514.49Kato, Takuma; Kishimoto, Saki; Asano, Akiko; Doi, Mitsunobu
Crystal structure of <i>N</i>-{<i>N</i>-[<i>N</i>-(<i>tert</i>-butoxycarbonyl)-<small>L</small>-α-aspartyl]-<small>L</small>-α-aspartyl}-<small>L</small>-α-aspartic acid 1^4^,2^4^,3^4^-trimethyl ester 3^1^-2-oxo-2-phenylethyl ester {Boc-[Asp(OMe)]~3~-OPac}
Acta Crystallographica Section E, 2019, 75, 585-588
2242898 CIF
HKL
Paper
C31 H31 N3 O5 SP -17.1314; 13.465; 15.4586
106.533; 97.98; 102.843
1354.61Gautier, Yohan; Maris, Thierry; Skene, W. G.
Crystal structure of diethyl 2-amino-5-{4-[bis(4-methylphenyl)amino]benzamido}thiophene-3,4-dicarboxylate
Acta Crystallographica Section E, 2019, 75, 589-592
2242899 CIF
HKL
Paper
C20 H16 Cl2 N2 O3 SP 1 21/c 118.4615; 12.8567; 7.9251
90; 96.926; 90
1867.33Hni, Brahim; Sebbar, Nada Kheira; Hökelek, Tuncer; El Ghayati, Lhoussaine; Bouzian, Younes; Mague, Joel T.; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis and DFT study of (2<i>Z</i>)-2-(2,4-dichlorobenzylidene)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-3,4-dihydro-2<i>H</i>-1,4-benzothiazin-3-one
Acta Crystallographica Section E, 2019, 75, 593-599
2242900 CIF
HKL
Paper
C14 H12 Cl2C 1 2/c 126.6755; 9.3259; 10.0405
90; 99.56; 90
2463.1Jotani, Mukesh M.; Lee, See Mun; Lo, Kong Mun; Tiekink, Edward R. T.
1-Chloro-4-[2-(4-chlorophenyl)ethyl]benzene and its bromo analogue: crystal structure, Hirshfeld surface analysis and computational chemistry
Acta Crystallographica Section E, 2019, 75, 623-630
2242901 CIF
HKL
Paper
C14 H12 Br2P 1 21/c 110.8761; 7.5157; 15.6131
90; 106.177; 90
1225.71Jotani, Mukesh M.; Lee, See Mun; Lo, Kong Mun; Tiekink, Edward R. T.
1-Chloro-4-[2-(4-chlorophenyl)ethyl]benzene and its bromo analogue: crystal structure, Hirshfeld surface analysis and computational chemistry
Acta Crystallographica Section E, 2019, 75, 623-630
2242902 CIF
HKL
Paper
C33 H40 N4 Ni3 O7 S3P b c a20.396; 16.066; 21.738
90; 90; 90
7123Rusanova, Julia A.; Kokozay, Vladimir N.; Pokas, Olena V.
Tris(μ~2~-2-methoxy-6-{[(2-sulfidoethyl)imino]methyl}phenolato)trinickel(II) dimethylformamide monosolvate: crystal structure, spectroscopic characterization and antibacterial activity
Acta Crystallographica Section E, 2019, 75, 615-618
2242903 CIF
HKL
Paper
C36 H40 N4 Ni2 O8P b c a10.2301; 15.2456; 21.5426
90; 90; 90
3359.87Vassilyeva, Olga Yu.; Kokozay, Vladimir N.; Skelton, Brian W.
Crystal structure of bis{μ-2-methoxy-6-[(methylimino)methyl]phenolato}bis({2-methoxy-6-[(methylimino)methyl]phenolato}nickel(II)) involving different coordination modes of the same Schiff base ligand
Acta Crystallographica Section E, 2019, 75, 619-622
2242904 CIF
HKL
C18 H19 F N2 OP 1 21/c 118.2525; 7.07855; 11.2207
90; 98.556; 90
1433.59Al-Wahaibi, Lamya H.; Alsfouk, Aisha; El-Emam, Ali A.; Blacque, Olivier
Crystal structures and Hirshfeld surface analysis of 2-(adamantan-1-yl)-5-(4-fluorophenyl)-1,3,4-oxadiazole and 2-(adamantan-1-yl)-5-(4-chlorophenyl)-1,3,4-oxadiazole
Acta Crystallographica Section E, 2019, 75, 611-615
2242905 CIF
HKL
C18 H19 Cl N2 OP 1 21/n 113.08241; 6.49259; 18.5129
90; 105.561; 90
1514.82Al-Wahaibi, Lamya H.; Alsfouk, Aisha; El-Emam, Ali A.; Blacque, Olivier
Crystal structures and Hirshfeld surface analysis of 2-(adamantan-1-yl)-5-(4-fluorophenyl)-1,3,4-oxadiazole and 2-(adamantan-1-yl)-5-(4-chlorophenyl)-1,3,4-oxadiazole
Acta Crystallographica Section E, 2019, 75, 611-615
2242906 CIF
HKL
Paper
C18 H12 O3 S2P 1 21/c 16.03; 24.875; 11.239
90; 114.249; 90
1537.1Anizaim, Ainizatul Husna; Zaini, Muhamad Fikri; Laruna, Muhammad Adlan; Razak, Ibrahim Abdul; Arshad, Suhana
(<i>E</i>)-1-(Benzo[<i>d</i>][1,3]dioxol-5-yl)-3-([2,2'-bithiophen]-5-yl)prop-2-en-1-one: crystal structure, UV‒Vis analysis and theoretical studies of a new π-conjugated chalcone
Acta Crystallographica Section E, 2019, 75, 632-637
2242907 CIF
HKL
Paper
C19 H16 N4 OP 1 21/n 16.5227; 7.8979; 30.7774
90; 95.389; 90
1578.51El Hafi, Mohamed; Kansiz, Sevgi; Lahmidi, Sanae; Boulhaoua, Mohammed; Ramli, Youssef; Dege, Necmi; Essassi, El Mokhtar; Mague, Joel T.
Crystal structure and Hirshfeld surface analysis of 3-(4-methoxyphenyl)-1-methyl-4-phenyl-1<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidine
Acta Crystallographica Section E, 2019, 75, 638-641
2242908 CIF
HKL
Paper
C18 H24 N2 O6P b c a11.5504; 13.8047; 22.3899
90; 90; 90
3570.1Faizi, Md. Serajul Haque; Kamaal, Saima; Ali, Arif; Ahmad, Musheer; Golenya, Irina A.
Crystal structure of 4-(2-hydroxy-3-methoxybenzylamino)benzoic acid dimethylformamide monosolvate monohydrate
Acta Crystallographica Section E, 2019, 75, 646-649
2242909 CIF
HKL
Paper
C18 H18 N4 O2 S2P 1 21/c 111.225; 7.2547; 11.1397
90; 100.978; 90
890.55Samb, Issa; Gaye, Nango; Sylla-Gueye, Rokhaya; Thiam, Elhadj Ibrahima; Gaye, Mohamed; Retailleau, Pascal
Crystal structure of <i>N</i>,<i>N</i>'-[(ethane-1,2-diyl)bis(azanediylcarbonothioyl)]bis(benzamide)
Acta Crystallographica Section E, 2019, 75, 642-645
2242910 CIF
HKL
Paper
C17 H12 Cl2 N2 OP 1 21/c 15.8511; 12.5544; 21.069
90; 92.666; 90
1546El Kali, Fouad; Kansiz, Sevgi; Daoui, Said; Saddik, Rafik; Dege, Necmi; Karrouchi, Khalid; Benchat, Noureddine
Crystal structure and Hirshfeld surface analysis of 4-(2,6-dichlorobenzyl)-6-phenylpyridazin-3(2<i>H</i>)-one
Acta Crystallographica Section E, 2019, 75, 650-654
2242911 CIF
HKL
Paper
C16 H15 Br F N3 SP -18.0599; 8.6086; 12.7608
96.548; 92.518; 111.065
817.39Khalilov, Ali N.; Atioğlu, Zeliha; Akkurt, Mehmet; Duruskari, Gulnara Sh.; Toze, Flavien A. A.; Huseynova, Afet T.
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-3-[(4-fluorobenzylidene)amino]-5-phenylthiazolidin-2-iminium bromide
Acta Crystallographica Section E, 2019, 75, 662-666
2242912 CIF
HKL
Paper
C16 H14 Cl N3 O SP -17.8218; 8.4207; 12.3402
99.838; 95.771; 96.515
789.67Zatsu, Ruokuosenuo; Maddela, Prabhakar; Indira Devi, M.; Singh, Ranjit; Pradeep, Chullikkattil P.
Crystal structure and Hirshfeld surface analysis of <i>rac</i>-2-[2-(4-chlorophenyl)-3,4-dihydro-2<i>H</i>-1-benzopyran-4-ylidene]hydrazine-1-carbothioamide
Acta Crystallographica Section E, 2019, 75, 707-710
2242913 CIF
HKL
Paper
C5 H5 Br2 N SeP 1 21/c 18.0971; 12.6116; 8.7325
90; 114.975; 90
808.36Matsulevich, Zhanna V.; Lukiyanova, Julia M.; Naumov, Vladimir I.; Borisova, Galina N.; Osmanov, Vladimir K.; Borisov, Alexander V.; Grishina, Maria M.; Khrustalev, Victor N.
Bromination of bis(pyridin-2-yl) diselenide in methylene chloride: the reaction mechanism and crystal structures of 1<i>H</i>-pyridine-2-selenenyl dibromide and its cycloadduct with cyclopentene (3a<i>SR</i>,9a<i>RS</i>)-2,3,3a,9a-tetrahydro-1<i>H</i>-cyclopenta[4,5][1,3]selenazolo[3,2-<i>a</i>]pyridinium bromide
Acta Crystallographica Section E, 2019, 75, 675-679
2242914 CIF
HKL
Paper
C10 H12 Br N SeP -16.3333; 9.0515; 9.5807
111.35; 93.657; 93.543
508.35Matsulevich, Zhanna V.; Lukiyanova, Julia M.; Naumov, Vladimir I.; Borisova, Galina N.; Osmanov, Vladimir K.; Borisov, Alexander V.; Grishina, Maria M.; Khrustalev, Victor N.
Bromination of bis(pyridin-2-yl) diselenide in methylene chloride: the reaction mechanism and crystal structures of 1<i>H</i>-pyridine-2-selenenyl dibromide and its cycloadduct with cyclopentene (3a<i>SR</i>,9a<i>RS</i>)-2,3,3a,9a-tetrahydro-1<i>H</i>-cyclopenta[4,5][1,3]selenazolo[3,2-<i>a</i>]pyridinium bromide
Acta Crystallographica Section E, 2019, 75, 675-679
2242915 CIF
HKL
C23 H15 N O3P 1 21/c 110.8204; 3.9364; 40.42
90; 97.651; 90
1706.3Zaini, Muhamad Fikri; Razak, Ibrahim Abdul; Khairul, Wan Mohd; Arshad, Suhana
Crystal structure and optical properties of fused-ring chalcone (<i>E</i>)-3-(anthracen-9-yl)-1-(4-nitrophenyl)prop-2-en-1-one
Acta Crystallographica Section E, 2019, 75, 685-689
2242916 CIF
HKL
Paper
C24 H16 B2 O S2P 1 21 113.2989; 12.7097; 23.33
90; 93.727; 90
3935Radtke, Julian; Lerner, Hans-Wolfram; Bolte, Michael
Polymorphism and pseudosymmetry of 10,10'-oxybis(9-thia-10-hydro-10-boraanthracene)
Acta Crystallographica Section E, 2019, 75, 690-694
2242917 CIF
HKL
Paper
C24 H16 B2 O S2P 1 21/c 123.2471; 12.5949; 13.3561
90; 92.217; 90
3907.7Radtke, Julian; Lerner, Hans-Wolfram; Bolte, Michael
Polymorphism and pseudosymmetry of 10,10'-oxybis(9-thia-10-hydro-10-boraanthracene)
Acta Crystallographica Section E, 2019, 75, 690-694
2242918 CIF
HKL
C19 H29 N9 O12.5 VC 1 2/c 138.972; 7.5746; 20.8208
90; 116.551; 90
5498Sehimi, Hiba; Akitsu, Takashiro; Zid, Mohamed Faouzi
Synthesis and structural study of tris(2,6-diaminopyridinium) bis(oxalato)dioxidovanadate(V) 2.5-hydrate
Acta Crystallographica Section E, 2019, 75, 680-684
2242919 CIF
HKL
Paper
C8 H12 N6 O2 SP -15.4252; 9.83; 11.137
74.636; 83.418; 80.255
562.9Cruz, Lorenzo M.; Moore, Raakiyah Y.; Gutierrez, Marcela Torres; Herath, Apsara K.; Lovely, Carl J.; Yousufuddin, Muhammed
Crystal structures of 4-{(<i>E</i>)-3-[(imino-λ^5^-azanylidene)amino]prop-1-enyl}-<i>N</i>,<i>N</i>-dimethylimidazole-1-sulfonamide and 2-[(imino-λ^5^-azanylidene)amino]-4-{(<i>E</i>)-3-[(imino-λ^5^-azanylidene)amino]prop-1-enyl}-<i>N</i>,<i>N</i>-dimethylimidazole-1-sulfonamide
Acta Crystallographica Section E, 2019, 75, 695-699
2242920 CIF
HKL
C8 H11 N9 O2 SP -16.6151; 9.563; 11.634
108.645; 105.994; 93.828
660.6Cruz, Lorenzo M.; Moore, Raakiyah Y.; Gutierrez, Marcela Torres; Herath, Apsara K.; Lovely, Carl J.; Yousufuddin, Muhammed
Crystal structures of 4-{(<i>E</i>)-3-[(imino-λ^5^-azanylidene)amino]prop-1-enyl}-<i>N</i>,<i>N</i>-dimethylimidazole-1-sulfonamide and 2-[(imino-λ^5^-azanylidene)amino]-4-{(<i>E</i>)-3-[(imino-λ^5^-azanylidene)amino]prop-1-enyl}-<i>N</i>,<i>N</i>-dimethylimidazole-1-sulfonamide
Acta Crystallographica Section E, 2019, 75, 695-699
2242921 CIF
HKL
Paper
C8 Br4 N2C 1 2/m 17.85; 9.833; 6.754
90; 90.202; 90
521.33Noland, Wayland E.; Schneerer, Andrew K.; Raberge, Emilie J.; Tritch, Kenneth J.
Crystal structure of 2,3,5,6-tetrabromoterephthalodinitrile
Acta Crystallographica Section E, 2019, 75, 703-706
2242922 CIF
HKL
Paper
C10 H12 N4 O3P 1 21/c 17.2288; 6.8265; 23.922
90; 98.69; 90
1166.9Moreira, Olívia B. O.; Freitas, Maria Clara R.; Souza, Karynne C.; Jordão, Alessandro K.; Resende, Jackson A. L. C.
Crystal structure of 1-anilino-5-methyl-1<i>H</i>-1,2,3-triazole-4-carboxylic acid monohydrate
Acta Crystallographica Section E, 2019, 75, 738-741
2242923 CIF
HKL
Paper
C54 H162 Al2 Cl2 K2 O6 Si24P 1 21/n 118.8247; 13.885; 22.2056
90; 109.413; 90
5474.14Purdy, Andrew P.; Butcher, Raymond J.
Potassium chloridotris(hypersiloxy)aluminate dimer
Acta Crystallographica Section E, 2019, 75, 714-716
2242924 CIF
HKL
Paper
C10 H9 Cl N4 OP 1 21/c 111.9736; 6.8854; 12.2746
90; 92.938; 90
1010.63Yaseen, Ayat; Hassan, Muhammad Murtaza; Lee-Ruff, Edward; Audette, Gerald F.
Crystal structures of the synthetic intermediate 3-[(6-chloro-7<i>H</i>-purin-7-yl)methyl]cyclobutan-1-one, and of two oxetanocin derivatives: 3-[(6-chloro-8,9-dihydro-7<i>H</i>-purin-7-yl)methyl]cyclobutan-1-ol and 3-[(6-chloro-9<i>H</i>-purin-9-yl)methyl]cyclobutan-1-ol
Acta Crystallographica Section E, 2019, 75, 732-737
2242925 CIF
HKL
Paper
C10 H13 Cl N4 OP -16.1101; 8.6075; 11.0083
68.957; 83.799; 87.189
537.15Yaseen, Ayat; Hassan, Muhammad Murtaza; Lee-Ruff, Edward; Audette, Gerald F.
Crystal structures of the synthetic intermediate 3-[(6-chloro-7<i>H</i>-purin-7-yl)methyl]cyclobutan-1-one, and of two oxetanocin derivatives: 3-[(6-chloro-8,9-dihydro-7<i>H</i>-purin-7-yl)methyl]cyclobutan-1-ol and 3-[(6-chloro-9<i>H</i>-purin-9-yl)methyl]cyclobutan-1-ol
Acta Crystallographica Section E, 2019, 75, 732-737
2242926 CIF
Paper
C10 H11 Cl N4 OP 1 21/n 112.7276; 5.9725; 14.819
90; 108.25; 90
1069.81Yaseen, Ayat; Hassan, Muhammad Murtaza; Lee-Ruff, Edward; Audette, Gerald F.
Crystal structures of the synthetic intermediate 3-[(6-chloro-7<i>H</i>-purin-7-yl)methyl]cyclobutan-1-one, and of two oxetanocin derivatives: 3-[(6-chloro-8,9-dihydro-7<i>H</i>-purin-7-yl)methyl]cyclobutan-1-ol and 3-[(6-chloro-9<i>H</i>-purin-9-yl)methyl]cyclobutan-1-ol
Acta Crystallographica Section E, 2019, 75, 732-737
2242927 CIF
Paper
C22 H24 N2 O12P 1 21 14.7724; 14.4069; 15.6857
90; 98.393; 90
1066.9Sylvester, Eric; McGovern, Mitchell; Young Lee, An; Nguyen, Phanxico; Park, Jungeun; Benedict, Jason B.
Partial charge transfer in the salt co-crystal of <small>L</small>-ascorbic acid and 4,4'-bipyridine
Acta Crystallographica Section E, 2019, 75, 728-731
2242928 CIF
HKL
Paper
C18 H12 Cl2 N2 O SP -16.5687; 7.9971; 15.4939
98.105; 94.316; 95.002
799.54Sebbar, Nada Kheira; Hni, Brahim; Hökelek, Tuncer; Jaouhar, Abdelhakim; Labd Taha, Mohamed; Mague, Joel T.; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of 3-{(2<i>Z</i>)-2-[(2,4-dichlorophenyl)methylidene]-3-oxo-3,4-dihydro-2<i>H</i>-1,4-benzothiazin-4-yl}propanenitrile
Acta Crystallographica Section E, 2019, 75, 721-727
2242929 CIF
HKL
Paper
C11 H9 I N2 O SP 1 21/c 117.413; 7.5325; 18.5443
90; 94.567; 90
2424.61Herrera-España, Angel D.; Aguilera-González, Jesús; Mena-Rejón, Gonzalo J.; Hernández-Ortega, Simón; Cáceres-Castillo, David
Crystal structure and Hirshfeld surface analysis of <i>N</i>-(5-iodo-4-phenylthiazol-2-yl)acetamide
Acta Crystallographica Section E, 2019, 75, 717-720
2242930 CIF
HKL
Paper
C24 H24 N2 O6P 1 21 14.9409; 39.015; 5.8447
90; 100.905; 90
1106.33Eissmann, Frank; Seichter, Wilhelm; Weber, Edwin
Crystal structure of dimethyl <i>N</i>,<i>N</i>'-[(ethyne-1,2-diyl)bis(1,4-phenylenecarbonyl)]bis(<small>L</small>-alaninate)
Acta Crystallographica Section E, 2019, 75, 751-754
2242931 CIF
HKL
C14 H10 N4 OC 1 c 111.5047; 23.41; 13.4115
90; 104.305; 90
3500.1Cati, Dilovan S.; Stoeckli-Evans, Helen
The crystal structures of the ligand <i>N</i>-(quinolin-8-yl)pyrazine-2-carboxamide and of a tetranuclear copper(II) complex
Acta Crystallographica Section E, 2019, 75, 755-761
2242932 CIF
HKL
C44 H52 Cu4 N8 O18P -18.1485; 11.2132; 14.2662
98.352; 93.668; 103.578
1247.11Cati, Dilovan S.; Stoeckli-Evans, Helen
The crystal structures of the ligand <i>N</i>-(quinolin-8-yl)pyrazine-2-carboxamide and of a tetranuclear copper(II) complex
Acta Crystallographica Section E, 2019, 75, 755-761
2242933 CIF
HKL
Paper
C17 H12 Br2 OP 1 21/c 117.592; 14.0777; 5.7956
90; 98.742; 90
1418.63Arif Tawfeeq, Nabeel; Kwong, Huey Chong; Mohamed Tahir, Mohamed Ibrahim; Ravoof, Thahira B. S. A.
Crystal structure and Hirshfeld surface analysis of a conformationally unsymmetrical bischalcone: (1<i>E</i>,4<i>E</i>)-1,5-bis(4-bromophenyl)penta-1,4-dien-3-one
Acta Crystallographica Section E, 2019, 75, 774-779
2242934 CIF
HKL
Paper
C20 H20 OP -18.728; 8.757; 12.094
77.768; 80.822; 61.929
795.2Baydere, Cemile; Taşçı, Merve; Dege, Necmi; Arslan, Mustafa; Atalay, Yusuf; Golenya, Irina A.
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-2-(2,4,6-trimethylbenzylidene)-3,4-dihydronaphthalen-1(2<i>H</i>)-one
Acta Crystallographica Section E, 2019, 75, 746-750
2242935 CIF
HKL
C14 H10.5 Cl N4.5 O5C 1 2/c 112.0614; 9.696; 26.688
90; 99.619; 90
3077.2Dege, Necmi; Faizi, Md. Serajul Haque; Doğan, Onur Erman; Ağar, Erbil; Golenya, Irina A.
Crystal structure and DFT study of (<i>E</i>)-2-chloro-4-{[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]methyl}phenol acetonitrile hemisolvate
Acta Crystallographica Section E, 2019, 75, 770-773
2242936 CIF
HKL
Paper
C23 H18 N4 O2 SP n a 2120.9154; 11.4208; 8.8938
90; 90; 90
2124.5Demir Kanmazalp, Sibel; Şen, Pınar; Dege, Necmi; Yildiz, Salih Zeki; Ozdemir, Namık; Golenya, Irina A.
Crystal structure and Hirshfeld surface analysis of 4-[4-(1<i>H</i>-benzo[<i>d</i>]imidazol-2-yl)phenoxy]phthalonitrile dimethyl sulfoxide monosolvate
Acta Crystallographica Section E, 2019, 75, 780-784
2242937 CIF
HKL
Paper
C21 H20 Cl Cu N5 O6P 1 21 19.32; 9.974; 12.949
90; 109.71; 90
1133.2Cioncoloni, Giacomo; Wilson, Claire; Roger, Isolda; Symes, Mark D.
Crystal structure of <i>catena</i>-poly[[(μ-6-{[bis(pyridin-2-ylmethyl)amino]methyl}pyridine-2-carboxylato)copper(II)] perchlorate acetonitrile monosolvate]
Acta Crystallographica Section E, 2019, 75, 789-793
2242938 CIF
HKL
Paper
C15 H15 N O2P 1 21/c 111.3954; 11.746; 10.3067
90; 115.94; 90
1240.6Kansiz, Sevgi; Aydin, Alev Sema; Dege, Necmi; Agar, Erbil; Fritsky, Igor O.
Crystal structure and Hirshfeld surface analysis of (<i>Z</i>)-6-[(2-hydroxy-4-methylanilino)methylidene]-4-methylcyclohexa-2,4-dien-1-one
Acta Crystallographica Section E, 2019, 75, 785-788
2242939 CIF
HKL
Paper
C14 H15 N3 O4P 1 21/c 17.1153; 11.0075; 18.2771
90; 105.766; 90
1377.64Sivajeyanthi, Palaniyappan; Edison, Bellarmin; Balasubramani, Kasthuri; Premkumar, Ganesan; Swu, Toka
Crystal structure, Hirshfeld surface analysis and HOMO‒LUMO analysis of (<i>E</i>)-<i>N</i>'-(3-hydroxy-4-methoxybenzylidene)nicotinohydrazide monohydrate
Acta Crystallographica Section E, 2019, 75, 804-807
2242940 CIF
HKL
Paper
C15 H13 Br O2 SP c a 2118.0683; 8.019; 9.8513
90; 90; 90
1427.35Caracelli, Ignez; Zukerman-Schpector, Julio; Traesel, Henrique J.; Olivato, Paulo R.; Jotani, Mukesh M.; Tiekink, Edward R. T.
2-[(4-Bromophenyl)sulfanyl]-2-methoxy-1-phenylethan-1-one: crystal structure, Hirshfeld surface analysis and computational chemistry
Acta Crystallographica Section E, 2019, 75, 816-822
2242941 CIF
HKL
C12 H20 Cd2 Cl6 N6 O4P 17.154; 8.2591; 10.4459
108.502; 97.499; 94.512
575.54Mohamedi, Nacira; Elleuch, Slim; Boufas, Sihem; Legouira, Messaoud; Djazi, Faiçal
Crystal structure of di-μ-chlorido-bis[dichlorido(<small>L</small>-histidinium-κ<i>O</i>)cadmium(II)]
Acta Crystallographica Section E, 2019, 75, 823-825
2242942 CIF
HKL
Paper
C14 H12 N2 O4P 1 21/n 16.0052; 7.8206; 26.2985
90; 90.303; 90
1235.07Kansiz, Sevgi; Dege, Necmi; Aydin, Alev Sema; Ağar, Erbil; Matushko, Igor P.
Crystal structure and Hirshfeld surface analysis of (<i>Z</i>)-6-[(2-hydroxy-5-nitroanilino)methylidene]-4-methylcyclohexa-2,4-dien-1-one
Acta Crystallographica Section E, 2019, 75, 812-815
2242943 CIF
HKL
Paper
C25 H20C 1 2/c 129.23; 5.8; 22.071
90; 107.248; 90
3574Peloquin, Andrew J.; Adas, Sonya K.; Iacono, Scott T.; Balaich, Gary J.
Crystal structures of a series of 6-aryl-1,3-diphenylfulvenes
Acta Crystallographica Section E, 2019, 75, 838-842
2242944 CIF
HKL
Paper
C25 H20P 1 21/c 119.208; 5.8774; 16.1884
90; 107.71; 90
1740.9Peloquin, Andrew J.; Adas, Sonya K.; Iacono, Scott T.; Balaich, Gary J.
Crystal structures of a series of 6-aryl-1,3-diphenylfulvenes
Acta Crystallographica Section E, 2019, 75, 838-842
2242945 CIF
HKL
Paper
C27 H24P c a 2130.031; 5.6147; 23.494
90; 90; 90
3961.4Peloquin, Andrew J.; Adas, Sonya K.; Iacono, Scott T.; Balaich, Gary J.
Crystal structures of a series of 6-aryl-1,3-diphenylfulvenes
Acta Crystallographica Section E, 2019, 75, 838-842
2242946 CIF
HKL
Paper
C29 H28C 1 2/c 130.987; 5.8273; 23.557
90; 96.192; 90
4228.9Peloquin, Andrew J.; Adas, Sonya K.; Iacono, Scott T.; Balaich, Gary J.
Crystal structures of a series of 6-aryl-1,3-diphenylfulvenes
Acta Crystallographica Section E, 2019, 75, 838-842
2242947 CIF
HKL
Paper
C9 H11 N O2P b c a9.5115; 18.7385; 10.0216
90; 90; 90
1786.2Yaman, Mavise; Dege, Necmi; Ayoob, Mzgin M.; Hussein, Awaz J.; Samad, Mohammed K.; Fritsky, Igor O.
Hirshfeld surface analysis and crystal structure of <i>N</i>-(2-methoxyphenyl)acetamide
Acta Crystallographica Section E, 2019, 75, 830-833
2242948 CIF
HKL
Paper
C10 H13 N OP 1 21/c 18.575; 10.746; 9.798
90; 101.811; 90
883.7Rigin, Sergei; Armijo, Beatrice; Krivoshein, Arcadius V.; Fonari, Marina; Timofeeva, Tatiana
Crystal structure and Hirshfeld surface analysis of new polymorph of racemic 2-phenylbutyramide
Acta Crystallographica Section E, 2019, 75, 826-829
2242949 CIF
HKL
Paper
C16 H15 Cl N2 O3I 41/a15.314; 15.314; 25.736
90; 90; 90
6036Narasimhamurthy, Kereyagalahally H.; Chandra; Sagar, Belakavadi K.; Rangappa, Kanchugarakoppal S.; Yathirajan, Hemmige S.; Glidewell, Christopher
The crystal structure of (<i>RS</i>)-7-chloro-2-(2,5-dimethoxyphenyl)-2,3-dihydroquinazolin-4(1<i>H</i>)-one: two hydrogen bonds generate an elegant three-dimensional framework structure
Acta Crystallographica Section E, 2019, 75, 843-847
2242950 CIF
HKL
Paper
C35 H35 Cu N11 O10P b c a15.582; 20.0517; 23.3082
90; 90; 90
7282.5Marten, Jan; Seichter, Wilhelm; Weber, Edwin
Crystal structure of (<i>N</i>,<i>N</i>'-ethylenebis{3-[2-(3-nitrophenyl)hydrazin-1-ylidene]-4-oxopentan-2-iminato})copper(II)‒3-[2-(3-nitrophenyl)hydrazin-1-ylidene]pentane-2,4-dione (1/1)
Acta Crystallographica Section E, 2019, 75, 834-837
2242951 CIF
HKL
Paper
C19 H18 N2 O6P -19.442; 9.558; 11.419
110.58; 95.669; 108.863
886.3Diana, Rosita; Tuzi, Angela; Panunzi, Barbara; Carella, Antonio; Caruso, Ugo
Crystal structures of butyl 2-amino-5-hydroxy-4-(4-nitrophenyl)benzofuran-3-carboxylate and 2-methoxyethyl 2-amino-5-hydroxy-4-(4-nitrophenyl)benzofuran-3-carboxylate
Acta Crystallographica Section E, 2019, 75, 880-887
2242952 CIF
HKL
Paper
C18 H16 N2 O7P 1 21/c 110.263; 9.086; 20.049
90; 111.577; 90
1738.6Diana, Rosita; Tuzi, Angela; Panunzi, Barbara; Carella, Antonio; Caruso, Ugo
Crystal structures of butyl 2-amino-5-hydroxy-4-(4-nitrophenyl)benzofuran-3-carboxylate and 2-methoxyethyl 2-amino-5-hydroxy-4-(4-nitrophenyl)benzofuran-3-carboxylate
Acta Crystallographica Section E, 2019, 75, 880-887
2242953 CIF
HKL
C27 H37 N O3P -15.8493; 10.7773; 19.3201
92.325; 91.806; 94.145
1213.02Sales, Eric S.; Bortoluzzi, Adailton J.; Merlo, Aloir A.
Crystal structure of 5-(4-<i>tert</i>-butoxyphenyl)-3-(4-<i>n</i>-octyloxyphenyl)-4,5-dihydroisoxazole
Acta Crystallographica Section E, 2019, 75, 896-899
2242954 CIF
HKL
Paper
C3 H4 O3P 1 21/c 110.7486; 5.1925; 6.8302
90; 99.063; 90
376.45Heger, Dominik; Eugene, Alexis J.; Parkin, Sean R.; Guzman, Marcelo I.
Crystal structure of zymonic acid and a redetermination of its precursor, pyruvic acid
Acta Crystallographica Section E, 2019, 75, 858-862
2242955 CIF
HKL
Paper
C6 H6 O5C 1 2/c 124.145; 6.6523; 8.6201
90; 95.169; 90
1378.9Heger, Dominik; Eugene, Alexis J.; Parkin, Sean R.; Guzman, Marcelo I.
Crystal structure of zymonic acid and a redetermination of its precursor, pyruvic acid
Acta Crystallographica Section E, 2019, 75, 858-862
2242956 CIF
HKL
Paper
C12 H20 S5P 1 21/c 19.4174; 9.97; 15.877
90; 98.94; 90
1472.6Hofstetter, Robert; Elvers, Benedict J.; Potlitz, Felix; Link, Andreas; Schulzke, Carola
Crystal structure of 7,8,15,16,17-pentathiadispiro[5.2.5^9^.3^6^]heptadecane
Acta Crystallographica Section E, 2019, 75, 888-891
2242957 CIF
HKL
Paper
C24 H22 O6C 1 2/c 111.7026; 14.6628; 12.7512
90; 107.863; 90
2082.54Iqbal, Saleem; Viswanathan, Vijayan; Velmurugan, Devadasan; Abiraman, Tamilselvan; Balasubramanian, Sengottuvelan; Gunasekaran, Krishnasamy
Crystal structures and Hirshfeld surface analyses of 4,4'-{[1,3-phenylenebis(methylene)]bis(oxy)}bis(3-methoxybenzaldehyde) and 4,4'-{[(1,4-phenylenebis(methylene)]bis(oxy)}bis(3-methoxybenzaldehyde)
Acta Crystallographica Section E, 2019, 75, 875-879
2242958 CIF
HKL
Paper
C24 H22 O6P 1 21/c 112.6668; 7.747; 10.4244
90; 102.126; 90
1000.12Iqbal, Saleem; Viswanathan, Vijayan; Velmurugan, Devadasan; Abiraman, Tamilselvan; Balasubramanian, Sengottuvelan; Gunasekaran, Krishnasamy
Crystal structures and Hirshfeld surface analyses of 4,4'-{[1,3-phenylenebis(methylene)]bis(oxy)}bis(3-methoxybenzaldehyde) and 4,4'-{[(1,4-phenylenebis(methylene)]bis(oxy)}bis(3-methoxybenzaldehyde)
Acta Crystallographica Section E, 2019, 75, 875-879
2242959 CIF
HKL
Paper
C14 H14 O6C 1 2/c 116.1298; 7.8773; 13.5247
90; 123.67; 90
1430.2Hoshide, Mitsutoshi; Masu, Hyuma; Sasanuma, Yuji
Crystal structure of butane-1,4-diyl bis(furan-2-carboxylate)
Acta Crystallographica Section E, 2019, 75, 872-874
2242960 CIF
HKL
Paper
C13 H26 O10P 1 21 113.936; 15.501; 15.988
90; 105.92; 90
3321Eriksson, Lars; Widmalm, Göran
Crystal structure of methyl α-<small>L</small>-rhamnopyranosyl-(1\ρightarrow 2)-α-<small>L</small>-rhamnopyranoside monohydrate
Acta Crystallographica Section E, 2019, 75, 854-857
2242961 CIF
HKL
Paper
C21 H19 Cl N2 O3P -18.841; 10.3043; 11.361
94.801; 103.596; 106.905
949.6El Kalai, Fouad; Baydere, Cemile; Daoui, Said; Saddik, Rafik; Dege, Necmi; Karrouchi, Khalid; Benchat, Noureddine
Crystal structure and Hirshfeld surface analysis of ethyl 2-[5-(3-chlorobenzyl)-6-oxo-3-phenyl-1,6-dihydropyridazin-1-yl]acetate
Acta Crystallographica Section E, 2019, 75, 892-895
2242962 CIF
HKL
Paper
C32 H40 N4 O8P -18.3965; 8.9879; 12.0126
101.73; 100.818; 112.463
784.2Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
Bis(4-acetoxy-<i>N</i>,<i>N</i>-dimethyltryptammonium) fumarate: a new crystalline form of psilacetin, an alternative to psilocybin as a psilocin prodrug
Acta Crystallographica Section E, 2019, 75, 900-902
2242963 CIF
HKL
C22 H22 N2 O4 S2P 1 21/c 18.05; 4.9407; 24.9626
90; 94.333; 90
989.99Park, Juhyeon; Lee, Seung Heon; Choi, Myong Yong; Moon, Cheol Joo; Kim, Tae Ho
Crystal structure of <i>N</i>,<i>N</i>'-bis[3-(methylsulfanyl)propyl]-1,8:4,5-naphthalenetetracarboxylic diimide
Acta Crystallographica Section E, 2019, 75, 934-938
2242964 CIF
HKL
Paper
C22 H50 N6 O8P 1 21/c 18.642; 16.687; 9.734
90; 96.46; 90
1394.8Moon, Dohyun; Jeon, Sunghwan; Ryoo, Keon Sang; Choi, Jong-Ha
Crystal structure of 3,14-diethyl-2,13-diaza-6,17-diazoniatricyclo[16.4.0.0^7,12^]docosane dinitrate dihydrate from synchrotron X-ray data
Acta Crystallographica Section E, 2019, 75, 921-924
2242965 CIF
HKL
Paper
C53 H36 Cl6 N4 Ni O4P 1 21/c 115.4185; 24.9658; 24.3053
90; 90.039; 90
9356Peters, Morten K.; Näther, Christian; Herges, Rainer
Crystal structure of 2^10^,2^20^-bis(2,6-dichlorophenyl)-4,7,12,15-tetraoxa-2(5,15)-nickel(II)porpyhrina-1,3(1,2)-dibenzena-cycloheptadecaphane-9-yne dichloromethane monosolvate
Acta Crystallographica Section E, 2019, 75, 925-929
2242966 CIF
HKL
Paper
C50 H36 Fe N6 O4 S2P 1 21/c 19.061; 20.9844; 11.2527
90; 90.526; 90
2139.5Wellm, Carsten; Näther, Christian
Crystal structure, synthesis and thermal properties of tetrakis(4-benzoylpyridine-κ<i>N</i>)bis(isothiocyanato-κ<i>N</i>)iron(II)
Acta Crystallographica Section E, 2019, 75, 917-920
2242967 CIF
HKL
Paper
C14 H14 Cl N O3C 1 2/c 114.2634; 16.0124; 13.7732
90; 117.748; 90
2783.9Bouzian, Younos; Karrouchi, Khalid; Anouar, El Hassane; Bouhfid, Rachid; Arshad, Suhana; Essassi, El Mokhtar
Crystal structure, DFT study and Hirshfeld surface analysis of ethyl 6-chloro-2-ethoxyquinoline-4-carboxylate
Acta Crystallographica Section E, 2019, 75, 912-916
2242968 CIF
HKL
Paper
C20 H25 N O3 SP 21 21 218.3344; 10.5937; 21.1228
90; 90; 90
1864.98McAdam, C. John; Hanton, Lyall R.; Moratti, Stephen C.; Simpson, Jim; Wickramasinhage, Ravindra N.
Structure and Hirshfeld surface analysis of the salt <i>N</i>,<i>N</i>,<i>N</i>-trimethyl-1-(4-vinylphenyl)methanaminium 4-vinylbenzenesulfonate
Acta Crystallographica Section E, 2019, 75, 946-950
2242969 CIF
HKL
Paper
C17 H14 Cl F O3P 1 21/n 114.9088; 5.7669; 17.9074
90; 104.491; 90
1490.7Çelikesir, Sevim Türktekin; Sheshadri, S. N.; Akkurt, Mehmet; Chidan Kumar, C. S.; Veeraiah, M. K.
Crystal structure and Hirshfeld surface analysis of (2<i>E</i>)-3-(4-chloro-3-fluorophenyl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-one
Acta Crystallographica Section E, 2019, 75, 942-945
2242970 CIF
HKL
Paper
C13 H10 O2 SP b c a11.0808; 9.0251; 22.8157
90; 90; 90
2281.69Vu Quoc, Trung; Tran Thi Thuy, Duong; Dang Thanh, Thuan; Phung Ngoc, Thanh; Nguyen Thien, Vuong; Nguyen Thuy, Chinh; Van Meervelt, Luc
Some chalcones derived from thiophene-3-carbaldehyde: synthesis and crystal structures
Acta Crystallographica Section E, 2019, 75, 957-963
2242971 CIF
HKL
C14 H12 O2 SP 1 21/c 116.4118; 5.8387; 12.6456
90; 97.279; 90
1201.98Vu Quoc, Trung; Tran Thi Thuy, Duong; Dang Thanh, Thuan; Phung Ngoc, Thanh; Nguyen Thien, Vuong; Nguyen Thuy, Chinh; Van Meervelt, Luc
Some chalcones derived from thiophene-3-carbaldehyde: synthesis and crystal structures
Acta Crystallographica Section E, 2019, 75, 957-963
2242972 CIF
HKL
C15 H14 O2 SP 1 21/c 116.512; 7.7851; 10.4913
90; 96.813; 90
1339.11Vu Quoc, Trung; Tran Thi Thuy, Duong; Dang Thanh, Thuan; Phung Ngoc, Thanh; Nguyen Thien, Vuong; Nguyen Thuy, Chinh; Van Meervelt, Luc
Some chalcones derived from thiophene-3-carbaldehyde: synthesis and crystal structures
Acta Crystallographica Section E, 2019, 75, 957-963
2242973 CIF
HKL
C13 H9 Br O SP 1 21/c 114.1245; 14.2016; 5.8809
90; 98.081; 90
1167.94Vu Quoc, Trung; Tran Thi Thuy, Duong; Dang Thanh, Thuan; Phung Ngoc, Thanh; Nguyen Thien, Vuong; Nguyen Thuy, Chinh; Van Meervelt, Luc
Some chalcones derived from thiophene-3-carbaldehyde: synthesis and crystal structures
Acta Crystallographica Section E, 2019, 75, 957-963
2242974 CIF
HKL
Paper
C21 H16 N2 O2P 1 21 110.144; 7.952; 10.928
90; 97.104; 90
874.7Ghandour, Ismail; Bouayad, Abdelouahed; Hökelek, Tuncer; Haoudi, Amal; Capet, Frédéric; Renard, Catherine; Kandri Rodi, Youssef
Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of 5,5-diphenyl-1,3-bis(prop-2-yn-1-yl)imidazolidine-2,4-dione
Acta Crystallographica Section E, 2019, 75, 951-956
2242975 CIF
HKL
C16 H12 Cl N3C 1 c 16.2114; 19.4553; 11.252
90; 91.883; 90
1359.01Akhramez, Soufiane; Hafid, Abderrafia; Khouili, Mostafa; Saadi, Mohamed; El Ammari, Lahcen; Ketatni, El Mostafa
Synthesis, crystal structure and Hirshfeld surface analysis of 2-chloro-3-[(<i>E</i>)-(2-phenylhydrazinylidene)methyl]quinoline
Acta Crystallographica Section E, 2019, 75, 964-968
2242976 CIFC12 H11 N OP 1 21 16.2525; 7.797; 10.281
90; 104.744; 90
484.7Barbero, Mauro; Mossotti, Matteo; Sironi, Angelo; Giovenzana, Giovanni Battista; Colombo, Valentina
Crystal structure of pirfenidone (5-methyl-1-phenyl-1<i>H</i>-pyridin-2-one): an active pharmaceutical ingredient (API)
Acta Crystallographica Section E, 2019, 75, 984-986
2242977 CIF
HKL
Paper
C28 H44 Cu2 N4 O19P 1 21 18.5134; 23.7812; 8.9028
90; 101.401; 90
1766.88Wiedemann, Dennis; Kulko, Roman-David; Grohmann, Andreas
Synthesis, characterization, and crystal structure of aquabis(4,4'-dimethoxy-2,2'-bipyridine)[μ-(2<i>R</i>,3<i>R</i>)-tartrato(4{-})]dicopper(II) octahydrate
Acta Crystallographica Section E, 2019, 75, 972-975
2242978 CIF
HKL
C24 H19 N O3P 1 21/n 15.6101; 19.5523; 17.2761
90; 96.969; 90
1881Bouzian, Younos; Faizi, Md. Serajul Haque; Mague, Joel T.; Otmani, Bouchaib El; Dege, Necmi; Karrouchi, Khalid; Essassi, El Mokhtar
Crystal structure and DFT study of benzyl 1-benzyl-2-oxo-1,2-dihydroquinoline-4-carboxylate
Acta Crystallographica Section E, 2019, 75, 980-983
2242979 CIF
HKL
Paper
C36 H34 N2 O4 P2C 1 2/c 113.0352; 14.1348; 17.0471
90; 90.217; 90
3140.9VanderWeide, Andrew I.; Staples, Richard J.; Biros, Shannon M.
Crystal structures of two bis-carbamoylmethylphosphine oxide (CMPO) compounds
Acta Crystallographica Section E, 2019, 75, 991-996
2242980 CIF
HKL
Paper
C14 H30 N2 O8 P2P b c a8.9401; 15.0535; 15.7314
90; 90; 90
2117.13VanderWeide, Andrew I.; Staples, Richard J.; Biros, Shannon M.
Crystal structures of two bis-carbamoylmethylphosphine oxide (CMPO) compounds
Acta Crystallographica Section E, 2019, 75, 991-996
2242981 CIF
HKL
Paper
C15 H12 N2 O2P 1 21/n 114.3173; 13.0633; 14.545
90; 110.264; 90
2552Faizi, Md. Serajul Haque; Dege, Necmi; Çiçek, Ceren; Agar, Erbil; Fritsky, Igor O.
Crystal structure, DFT and MEP study of (<i>E</i>)-2-[(2-hydroxy-5-methoxybenzylidene)amino]benzonitrile
Acta Crystallographica Section E, 2019, 75, 987-990
2242982 CIF
HKL
C22 H16 Br Cl6 N O3 P ReP 1 21/c 114.194; 12.314; 16.249
90; 92.701; 90
2836.9Palominos, Franco; Muñoz, Carolina; Oyarzun, Poldie; Saldías, Marianela; Vega, Andrés
Crystal structures and Hirshfeld surface analysis of [κ^2^-<i>P</i>,<i>N</i>-{(C~6~H~5~)~2~(C~5~H~5~N)P}Re(CO)~3~Br]·2CHCl~3~ and the product of its reaction with piperidine, [<i>P</i>-{(C~6~H~5~)~2~(C~5~H~5~N)P}(C~5~H~11~N)Re(CO)~3~Br]
Acta Crystallographica Section E, 2019, 75, 1005-1010
2242983 CIF
HKL
C25 H25 Br N2 O3 P ReP -19.1384; 9.8348; 15.671
82.956; 82.047; 69.765
1304.5Palominos, Franco; Muñoz, Carolina; Oyarzun, Poldie; Saldías, Marianela; Vega, Andrés
Crystal structures and Hirshfeld surface analysis of [κ^2^-<i>P</i>,<i>N</i>-{(C~6~H~5~)~2~(C~5~H~5~N)P}Re(CO)~3~Br]·2CHCl~3~ and the product of its reaction with piperidine, [<i>P</i>-{(C~6~H~5~)~2~(C~5~H~5~N)P}(C~5~H~11~N)Re(CO)~3~Br]
Acta Crystallographica Section E, 2019, 75, 1005-1010
2242984 CIF
HKL
Paper
C14 H10 Cl F N2 O SP 1 21/c 18.0785; 12.423; 13.0772
90; 90.551; 90
1312.36Akhter, Sidra; Choudhary, Muhammad Iqbal; Siddiqui, Hina; Yousuf, Sammer
Crystal structure and Hirshfeld surface analysis of <i>N</i>-(2-chlorophenylcarbamothioyl)-4-fluorobenzamide and <i>N</i>-(4-bromophenylcarbamothioyl)-4-fluorobenzamide
Acta Crystallographica Section E, 2019, 75, 1026-1029
2242985 CIF
HKL
Paper
C14 H10 Br F N2 O SP -13.8733; 13.0776; 13.2628
98.817; 94.714; 94.727
658.54Akhter, Sidra; Choudhary, Muhammad Iqbal; Siddiqui, Hina; Yousuf, Sammer
Crystal structure and Hirshfeld surface analysis of <i>N</i>-(2-chlorophenylcarbamothioyl)-4-fluorobenzamide and <i>N</i>-(4-bromophenylcarbamothioyl)-4-fluorobenzamide
Acta Crystallographica Section E, 2019, 75, 1026-1029
2242986 CIF
HKL
Paper
C26 H20 N10 Ni O4 S2P 1 21/c 18.5395; 20.7595; 8.6686
90; 108.908; 90
1453.81Rhoufal, Ferdaousse; Bentiss, Fouad; Guesmi, Salaheddine; Ketatni, El Mostafa; Saadi, Mohamed; El Ammari, Lahcen
Crystal structure, spectroscopic characterization and Hirshfeld surface analysis of <i>trans</i>-diaqua[2,5-bis(pyridin-4-yl)-1,3,4-oxadiazole]dithiocyanatonickel(II)
Acta Crystallographica Section E, 2019, 75, 1046-1050
2242987 CIF
HKL
C23 H22 O2P b c a16.9915; 9.3183; 22.0129
90; 90; 90
3485.3Komarov, Pavel D.; Minyaev, Mikhail E.; Churakov, Andrei V.; Roitershtein, Dmitrii M.; Nifant'ev, Ilya E.
(1<i>R</i>,2<i>S</i>,4<i>r</i>)-1,2,4-Triphenylcyclopentane-1,2-diol and (1<i>R</i>,2<i>S</i>,4<i>r</i>)-4-(2-methoxyphenyl)-1,2-diphenylcyclopentane-1,2-diol: application as initiators for ring-opening polymerization of ε-caprolactone
Acta Crystallographica Section E, 2019, 75, 1035-1040
2242988 CIF
HKL
C24 H24 O3P -111.4136; 14.0145; 19.0339
92.3394; 101.546; 105.013
2867.3Komarov, Pavel D.; Minyaev, Mikhail E.; Churakov, Andrei V.; Roitershtein, Dmitrii M.; Nifant'ev, Ilya E.
(1<i>R</i>,2<i>S</i>,4<i>r</i>)-1,2,4-Triphenylcyclopentane-1,2-diol and (1<i>R</i>,2<i>S</i>,4<i>r</i>)-4-(2-methoxyphenyl)-1,2-diphenylcyclopentane-1,2-diol: application as initiators for ring-opening polymerization of ε-caprolactone
Acta Crystallographica Section E, 2019, 75, 1035-1040
2242989 CIF
HKL
C25 H19 F N2 O2P -15.0575; 10.0973; 38.608
86.237; 86.675; 88.354
1963.4Daoui, Said; Faizi, Md. Serajul Haque; Kalai, Fouad El; Saddik, Rafik; Dege, Necmi; Karrouchi, Khalid; Benchat, Noureddine
Crystal structure and the DFT and MEP study of 4-benzyl-2-[2-(4-fluorophenyl)-2-oxoethyl]-6-phenylpyridazin-3(2<i>H</i>)-one
Acta Crystallographica Section E, 2019, 75, 1030-1034
2242990 CIF
HKL
Paper
C24 H39 Cu N5 O7P 1 21/n 17.2625; 17.8132; 21.1511
90; 92.159; 90
2734.34Andriichuk, Irina L.; Tsymbal, Liudmyla V.; Arion, Vladimir B.; Lampeka, Yaroslaw D.
Crystal structures of <i>trans</i>-diaqua(3-<i>R</i>-1,3,5,8,12-pentaazacyclotetradecane)copper(II) isophthalate hydrates (<i>R</i> = benzyl or pyridin-3-ylmethyl)
Acta Crystallographica Section E, 2019, 75, 1015-1019
2242991 CIF
HKL
Paper
C23 H37.8 Cu N6 O6.9P 1 21/c 17.1955; 19.0463; 19.4426
90; 94.276; 90
2657.15Andriichuk, Irina L.; Tsymbal, Liudmyla V.; Arion, Vladimir B.; Lampeka, Yaroslaw D.
Crystal structures of <i>trans</i>-diaqua(3-<i>R</i>-1,3,5,8,12-pentaazacyclotetradecane)copper(II) isophthalate hydrates (<i>R</i> = benzyl or pyridin-3-ylmethyl)
Acta Crystallographica Section E, 2019, 75, 1015-1019
2242992 CIF
HKL
Paper
C32 H58 Mo7 N16 O26P 1 21/n 116.5325; 17.5842; 19.8873
90; 90.653; 90
5781.08Sarr, Bougar; Mbaye, Abdou; Diallo, Wally; Diop, Cheikh Abdoul Khadir; Sidibe, Mamadou; Michaud, Francois
Synthesis and crystal structure of a new hybrid organic‒inorganic material containing neutral molecules, cations and heptamolybdate anions
Acta Crystallographica Section E, 2019, 75, 1001-1004
2242993 CIF
HKL
Paper
C20 H28 Al2 Cl10 Sn2P -18.7512; 9.1357; 11.2803
85.524; 72.769; 86.926
858.3Merkelbach, Johannes; Frank, Walter
Synthesis, detailed geometric analysis and bond-valence method evaluation of the strength of π-arene bonding of two isotypic cationic prehnitene tin(II) complexes: [{1,2,3,4-(CH~3~)~4~C~6~H~2~}~2~Sn~2~Cl~2~][<i>M</i>Cl~4~]~2~ (<i>M</i> = Al and Ga)
Acta Crystallographica Section E, 2019, 75, 1051-1056
2242994 CIF
HKL
Paper
C20 H28 Cl10 Ga2 Sn2P -18.7572; 9.131; 11.2966
85.424; 72.805; 86.886
859.73Merkelbach, Johannes; Frank, Walter
Synthesis, detailed geometric analysis and bond-valence method evaluation of the strength of π-arene bonding of two isotypic cationic prehnitene tin(II) complexes: [{1,2,3,4-(CH~3~)~4~C~6~H~2~}~2~Sn~2~Cl~2~][<i>M</i>Cl~4~]~2~ (<i>M</i> = Al and Ga)
Acta Crystallographica Section E, 2019, 75, 1051-1056
2242995 CIF
HKL
C15 H21 N3 O SP -110.7799; 10.9481; 14.1895
74.526; 68.246; 80.207
1494.2Arafath, Md. Azharul; Kwong, Huey Chong; Adam, Farook
Crystal structure of (<i>E</i>)-<i>N</i>-cyclohexyl-2-(2-hydroxy-3-methylbenzylidene)hydrazine-1-carbothioamide
Acta Crystallographica Section E, 2019, 75, 1065-1068
2242996 CIF
HKL
Paper
C31 H30 N2 O6 S2C 1 2/c 115.5072; 12.3504; 16.3017
90; 114.868; 90
2832.62Duangthongyou, Tanwawan; Rattanakam, Ramida; Chainok, Kittipong; Suramitr, Songwut; Tuntulani, Thawatchai; Wannalerse, Boontana
5-Methyl-1,3-phenylene bis[5-(dimethylamino)naphthalene-1-sulfonate]: crystal structure and DFT calculations
Acta Crystallographica Section E, 2019, 75, 1079-1083
2242997 CIF
HKL
Paper
C22 H21 N3 O7 S2P 1 21/c 17.2678; 26.5667; 11.359
90; 90.498; 90
2193.13Rybalka, Andrii; Shishkina, Svitlana; Ukrainets, Igor; Sidorenko, Lyudmila; Sim, Galina
Molecular and crystal structure of 5,9-dimethyl-5<i>H</i>-pyrano[3,2-<i>c</i>:5,6-<i>c</i>']bis[2,1-benzothiazin]-7(9<i>H</i>)-one 6,6,8,8-tetroxide dimethylformamide monosolvate
Acta Crystallographica Section E, 2019, 75, 1076-1078
2242998 CIF
HKL
Paper
C12 H21 N O7P 1 21 15.8052; 11.954; 9.6135
90; 95.506; 90
664.05Mossine, Valeri V.; Barnes, Charles L.; Mawhinney, Thomas P.
Multicentered hydrogen bonding in 1-[(1-deoxy-β-<small>D</small>-fructopyranos-1-yl)azaniumyl]cyclopentanecarboxylate (`<small>D</small>-fructose-cycloleucine')
Acta Crystallographica Section E, 2019, 75, 1096-1101
2242999 CIF
HKL
Paper
C13 H12 N2 O2 SP b c a13.082; 8.0287; 24.0442
90; 90; 90
2525.4Vu Quoc, Trung; Nguyen Ngoc, Linh; Tran Thi Thuy, Duong; Vu Quoc, Manh; Vuong Nguyen, Thien; Oanh Doan Thi, Yen; Van Meervelt, Luc
Crystal structure of two <i>N</i>'-(1-phenylbenzylidene)-2-(thiophen-3-yl)acetohydrazides
Acta Crystallographica Section E, 2019, 75, 1090-1095
2243000 CIF
HKL
C14 H14 N2 O2 SP -16.5185; 9.7447; 10.9291
78.327; 83.07; 87.013
674.63Vu Quoc, Trung; Nguyen Ngoc, Linh; Tran Thi Thuy, Duong; Vu Quoc, Manh; Vuong Nguyen, Thien; Oanh Doan Thi, Yen; Van Meervelt, Luc
Crystal structure of two <i>N</i>'-(1-phenylbenzylidene)-2-(thiophen-3-yl)acetohydrazides
Acta Crystallographica Section E, 2019, 75, 1090-1095
2243001 CIF
HKL
Paper
C48 H38 N14 Ni O4C 1 2/c 120.345; 12.439; 19.575
90; 112.8; 90
4566.8Chi-Duran, Ignacio; Setifi, Zouaoui; Setifi, Fatima; Jelsch, Christian; Morgenstern, Bernd; Vega, Andres; Herrera, Felipe; Pratap Singh, Dinesh; Hegetschweiler, Kaspar; Boyaala, Rabab
Crystal structure and Hirshfeld surface analysis of tris(2,2'-bipyridine)nickel(II) bis(1,1,3,3-tetracyano-2-ethoxypropenide) dihydrate
Acta Crystallographica Section E, 2019, 75, 867-871
2243002 CIF
HKL
Paper
C11 H5 F4 N OP 21 21 215.4199; 10.3293; 17.4076
90; 90; 90
974.54Peloquin, Andrew J.; Corley, Cynthia A.; Adas, Sonya K.; Balaich, Gary J.; Iacono, Scott T.
Crystal structures and Hirshfeld surface analysis of a series of 4-<i>O</i>-arylperfluoropyridines
Acta Crystallographica Section E, 2019, 75, 1102-1107
2243003 CIF
HKL
Paper
C11 H4 Br F4 N OP 1 21/n 113.353; 5.8584; 14.8863
90; 113.585; 90
1067.24Peloquin, Andrew J.; Corley, Cynthia A.; Adas, Sonya K.; Balaich, Gary J.; Iacono, Scott T.
Crystal structures and Hirshfeld surface analysis of a series of 4-<i>O</i>-arylperfluoropyridines
Acta Crystallographica Section E, 2019, 75, 1102-1107
2243004 CIF
HKL
Paper
C15 H7 F4 N OP 21 21 215.4703; 9.2548; 24.109
90; 90; 90
1220.56Peloquin, Andrew J.; Corley, Cynthia A.; Adas, Sonya K.; Balaich, Gary J.; Iacono, Scott T.
Crystal structures and Hirshfeld surface analysis of a series of 4-<i>O</i>-arylperfluoropyridines
Acta Crystallographica Section E, 2019, 75, 1102-1107
2243005 CIF
HKL
Paper
C15 H6 Br F4 N OP 1 21 16.0135; 7.4994; 14.6318
90; 101.401; 90
646.84Peloquin, Andrew J.; Corley, Cynthia A.; Adas, Sonya K.; Balaich, Gary J.; Iacono, Scott T.
Crystal structures and Hirshfeld surface analysis of a series of 4-<i>O</i>-arylperfluoropyridines
Acta Crystallographica Section E, 2019, 75, 1102-1107
2243006 CIF
HKL
Paper
C22 H8 F8 N2 O2P b c n18.8516; 10.6512; 9.2196
90; 90; 90
1851.22Peloquin, Andrew J.; Corley, Cynthia A.; Adas, Sonya K.; Balaich, Gary J.; Iacono, Scott T.
Crystal structures and Hirshfeld surface analysis of a series of 4-<i>O</i>-arylperfluoropyridines
Acta Crystallographica Section E, 2019, 75, 1102-1107
2243007 CIF
HKL
Paper
C22 H17 N O2P 1 21/n 19.1652; 16.9764; 10.9687
90; 91.156; 90
1706.3Syed Abuthahir, S.; NizamMohideen, M.; Mayakrishnan, S.; Uma Maheswari, N.; Viswanathan, V.
Crystal structures of two new isocoumarin derivatives: 8-amino-6-methyl-3,4-diphenyl-1<i>H</i>-isochromen-1-one and 8-amino-3,4-diethyl-6-methyl-1<i>H</i>-isochromen-1-one
Acta Crystallographica Section E, 2019, 75, 1117-1122
2243008 CIF
HKL
Paper
C14 H17 N O2P 1 21/c 110.4844; 26.562; 9.3651
90; 105.367; 90
2514.8Syed Abuthahir, S.; NizamMohideen, M.; Mayakrishnan, S.; Uma Maheswari, N.; Viswanathan, V.
Crystal structures of two new isocoumarin derivatives: 8-amino-6-methyl-3,4-diphenyl-1<i>H</i>-isochromen-1-one and 8-amino-3,4-diethyl-6-methyl-1<i>H</i>-isochromen-1-one
Acta Crystallographica Section E, 2019, 75, 1117-1122
2243009 CIF
Paper
C8 H9 N OP 1 21/c 117.635; 7.817; 16.718
90; 110.639; 90
2156.7Jansen van Vuuren, Leandri; Visser, Hendrik G.; Schutte-Smith, Marietjie
Crystal structure of 2-(methylamino)tropone
Acta Crystallographica Section E, 2019, 75, 1128-1132
2243010 CIF
HKL
Paper
C13 H14 O6 SP 1 21/c 123.1461; 8.2631; 14.6374
90; 97.687; 90
2774.4Syed Abuthahir, S.; NizamMohideen, M.; Viswanathan, V.; Govindhan, M.; Subramanian, K.
Crystal structure and Hirshfeld surface analysis of 2-[(2-oxo-2<i>H</i>-chromen-4-yl)oxy]acetic acid dimethyl sulfoxide monosolvate
Acta Crystallographica Section E, 2019, 75, 1123-1127
2243011 CIF
HKL
C24 H20 Au2 Fe N8 O2C 1 2/c 118.5306; 10.4541; 14.2522
90; 107.509; 90
2633Kucheriv, Olesia I.; Barakhtii, Diana D.; Malinkin, Sergey O.; Shova, Sergiu; Gural'skiy, Il'ya A.
Crystal structure of <i>catena</i>-poly[[gold(I)-μ-cyanido-[diaquabis(2-phenylpyrazine)iron(II)]-μ-cyanido] dicyanidogold(I)]
Acta Crystallographica Section E, 2019, 75, 1149-1152
2243012 CIF
HKL
Paper
C14 H8 F4 N2 O2P -17.0347; 10.256; 18.129
78.844; 80.165; 87.242
1264.2Peloquin, Andrew J.; Balaich, Gary J.; Iacono, Scott T.
Syntheses, crystal structures and Hirshfeld surface analyses of (3a<i>R</i>,4<i>S</i>,7<i>R</i>,7a<i>S</i>)-2-(perfluoropyridin-4-yl)-3a,4,7,7a-tetrahydro-4,7-methanoisoindole-1,3-dione and (3a<i>R</i>,4<i>S</i>,7<i>R</i>,7a<i>S</i>)-2-[(perfluoropyridin-4-yl)oxy]-3a,4,7,7a-tetrahydro-4,7-methanoisoindole-1,3-dione
Acta Crystallographica Section E, 2019, 75, 1153-1157
2243013 CIF
HKL
Paper
C14 H8 F4 N2 O3P 1 21/n 112.285; 5.945; 17.888
90; 93.44; 90
1304.1Peloquin, Andrew J.; Balaich, Gary J.; Iacono, Scott T.
Syntheses, crystal structures and Hirshfeld surface analyses of (3a<i>R</i>,4<i>S</i>,7<i>R</i>,7a<i>S</i>)-2-(perfluoropyridin-4-yl)-3a,4,7,7a-tetrahydro-4,7-methanoisoindole-1,3-dione and (3a<i>R</i>,4<i>S</i>,7<i>R</i>,7a<i>S</i>)-2-[(perfluoropyridin-4-yl)oxy]-3a,4,7,7a-tetrahydro-4,7-methanoisoindole-1,3-dione
Acta Crystallographica Section E, 2019, 75, 1153-1157
2243014 CIF
HKL
Paper
C27 H32 N4 O7P 21 21 218.8417; 11.3252; 25.7003
90; 90; 90
2573.47Filali, Mouad; Elmsellem, Hicham; Hökelek, Tuncer; El-Ghayoury, Abdelkrim; Stetsiuk, Oleh; El Hadrami, El Mestafa; Ben-Tama, Abdessalam
Crystal structure, Hirshfeld surface analysis and corrosion inhibition study of 3,6-bis(pyridin-2-yl)-4-{[(3a<i>S</i>,5<i>S</i>,5a<i>R</i>,8a<i>R</i>,8b<i>S</i>)-2,2,7,7-tetramethyltetrahydro-5<i>H</i>-bis[1,3]dioxolo[4,5-<i>b</i>:4',5'-<i>d</i>]pyran-5-yl)methoxy]methyl}pyridazine monohydrate
Acta Crystallographica Section E, 2019, 75, 1169-1174
2243015 CIF
HKL
Paper
C16 H15 Br Cl N3 SP -18.3146; 8.9424; 12.2388
80.988; 76.458; 70.027
828.54Duruskari, Gulnara Sh.; Khalilov, Ali N.; Akkurt, Mehmet; Mammadova, Gunay Z.; Chyrka, Taras; Maharramov, Abel M.
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-3-[(4-chlorobenzylidene)amino]-5-phenylthiazolidin-2-iminium bromide
Acta Crystallographica Section E, 2019, 75, 1175-1179
2243016 CIF
HKL
Paper
C17 H23 N O2P 1 21/c 116.2512; 7.6859; 13.0989
90; 106.64; 90
1567.6Rayni, Ibtissam; El Bakri, Youness; Lai, Chin-Hung; Sebhaoui, Jihad; Essassi, El Mokhtar; Mague, Joel T.
Crystal structure, DFT study and Hirshfeld surface analysis of 1-nonyl-2,3-dihydro-1<i>H</i>-indole-2,3-dione
Acta Crystallographica Section E, 2019, 75, 1140-1144
2243017 CIF
HKL
Paper
C63.5 H32 Cl F10 N5 Ni S2P 1 21/c 114.0919; 22.0127; 17.9648
90; 93.95; 90
5559.46Gutzeit, Florian; Näther, Christian; Herges, Rainer
Crystal structure of (15,20-bis(2,3,4,5,6-pentafluorophenyl)-5,10-{(pyridine-3,5-diyl)bis[(sulfanediylmethylene)[1,1'-biphenyl]-4',2-diyl]}porphyrinato)nickel(II) dichloromethane <i>x</i>-solvate (<i>x</i> > 1/2) showing a rare CN5 coordination
Acta Crystallographica Section E, 2019, 75, 1180-1184
2243018 CIF
HKL
Paper
C40 H44 F12 N4 O7P -110.0405; 14.6482; 14.6547
100.745; 93.83; 98.497
2084.42Wardell, James L.; Jotani, Mukesh M.; Tiekink, Edward R. T.
Bis(mefloquinium) butanedioate ethanol monosolvate: crystal structure and Hirshfeld surface analysis
Acta Crystallographica Section E, 2019, 75, 1162-1168
2243019 CIF
HKL
Paper
C16 H11 Cl2 N3 OP 1 21/c 13.9117; 25.109; 14.968
90; 97.07; 90
1459Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Askerova, Ulviyya F.; Mukhtarova, Sevinc H.; Mammadova, Gunay Z.; Toze, Flavien A. A.
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-4-{[2,2-dichloro-1-(4-methoxyphenyl)ethenyl]diazenyl}benzonitrile
Acta Crystallographica Section E, 2019, 75, 1190-1194
2243020 CIF
HKL
Paper
C16 H16 Cu2 Fe N8C 1 2/c 113.1997; 9.2923; 13.801
90; 92.399; 90
1691.3Partsevska, Sofiia V.; Naumova, Dina D.; Matushko, Igor P.; Kucheriv, Olesia I.; Gural'skiy, Il'ya A.
Crystal structure of a low-spin poly[di-μ~3~-cyanido-di-μ~2~-cyanido-bis(μ~2~-2-ethylpyrazine)dicopper(I)iron(II)]
Acta Crystallographica Section E, 2019, 75, 1205-1208
2243021 CIF
HKL
Paper
C11 H37 Cu5 Gd N11 O24.5P -111.2057; 11.5054; 13.2983
94.026; 94.942; 107.558
1620.2Pavlishchuk, Anna; Naumova, Dina; Zeller, Matthias; Calderon Cazorla, Sebastian; Addison, Anthony W.
The crystal structures of {<i>Ln</i>Cu~5~}^3+^ (<i>Ln</i> = Gd, Dy and Ho) 15-metallacrown-5 complexes and a reevaluation of the isotypic Eu^III^ analogue
Acta Crystallographica Section E, 2019, 75, 1215-1223
2243022 CIF
HKL
Paper
C11 H36.56 Cu5 Dy N11 O24.28P -111.1083; 11.4991; 13.2894
93.9235; 94.7713; 107.147
1608.74Pavlishchuk, Anna; Naumova, Dina; Zeller, Matthias; Calderon Cazorla, Sebastian; Addison, Anthony W.
The crystal structures of {<i>Ln</i>Cu~5~}^3+^ (<i>Ln</i> = Gd, Dy and Ho) 15-metallacrown-5 complexes and a reevaluation of the isotypic Eu^III^ analogue
Acta Crystallographica Section E, 2019, 75, 1215-1223
2243023 CIF
HKL
Paper
C11 H36.89 Cu5 Ho N11 O24.45P -111.2027; 11.4955; 13.2467
94.001; 94.784; 107.518
1613Pavlishchuk, Anna; Naumova, Dina; Zeller, Matthias; Calderon Cazorla, Sebastian; Addison, Anthony W.
The crystal structures of {<i>Ln</i>Cu~5~}^3+^ (<i>Ln</i> = Gd, Dy and Ho) 15-metallacrown-5 complexes and a reevaluation of the isotypic Eu^III^ analogue
Acta Crystallographica Section E, 2019, 75, 1215-1223
2243024 CIF
HKL
Paper
C14 H8 Br Cl2 N3 O2P n a 2113.9181; 13.4336; 8.408
90; 90; 90
1572.05Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Suleymanova, Gulnar T.; Babayeva, Gulnare V.; Mammadova, Gunay Z.; Niyazova, Ayten A.; Shikhaliyeva, Irada M.; Toze, Flavien A. A.
Crystal structures and Hirshfeld surface analyses of the two isotypic compounds (<i>E</i>)-1-(4-bromophenyl)-2-[2,2-dichloro-1-(4-nitrophenyl)ethenyl]diazene and (<i>E</i>)-1-(4-chlorophenyl)-2-[2,2-dichloro-1-(4-nitrophenyl)ethenyl]diazene
Acta Crystallographica Section E, 2019, 75, 1199-1204
2243025 CIF
HKL
Paper
C14 H8 Cl3 N3 O2P n a 2113.8689; 13.3674; 8.362
90; 90; 90
1550.24Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Suleymanova, Gulnar T.; Babayeva, Gulnare V.; Mammadova, Gunay Z.; Niyazova, Ayten A.; Shikhaliyeva, Irada M.; Toze, Flavien A. A.
Crystal structures and Hirshfeld surface analyses of the two isotypic compounds (<i>E</i>)-1-(4-bromophenyl)-2-[2,2-dichloro-1-(4-nitrophenyl)ethenyl]diazene and (<i>E</i>)-1-(4-chlorophenyl)-2-[2,2-dichloro-1-(4-nitrophenyl)ethenyl]diazene
Acta Crystallographica Section E, 2019, 75, 1199-1204
2243026 CIF
HKL
Paper
C26 H24 Cd I4 N6P 1 21/n 117.2718; 16.653; 22.4402
90; 108.922; 90
6105.62Vassilyeva, Olga Yu.; Buvaylo, Elena A.; Kokozay, Vladimir N.; Skelton, Brian W.; Sobolev, Alexandre N.
Crystal structures of an imidazo[1,5-<i>a</i>]pyridinium-based ligand and its (C~13~H~12~N~3~)~2~[CdI~4~] hybrid salt
Acta Crystallographica Section E, 2019, 75, 1209-1214
2243027 CIF
HKL
C26 H30 Cl1.5 N6.5 O4.5P -17.3959; 10.2889; 18.5155
88.208; 95.033; 108.916
1327.71Vassilyeva, Olga Yu.; Buvaylo, Elena A.; Kokozay, Vladimir N.; Skelton, Brian W.; Sobolev, Alexandre N.
Crystal structures of an imidazo[1,5-<i>a</i>]pyridinium-based ligand and its (C~13~H~12~N~3~)~2~[CdI~4~] hybrid salt
Acta Crystallographica Section E, 2019, 75, 1209-1214
2243028 CIF
HKL
Paper
C11 H11 N O3R -3 :H26.3146; 26.3146; 8.1205
90; 90; 120
4869.8Caracelli, Ignez; Zukerman-Schpector, Julio; Schwab, Ricardo S.; da Silva, Everton M.; Jotani, Mukesh M.; Tiekink, Edward R. T.
2-Methyl-4-(4-nitrophenyl)but-3-yn-2-ol: crystal structure, Hirshfeld surface analysis and computational chemistry study
Acta Crystallographica Section E, 2019, 75, 1232-1238
2243029 CIF
HKL
Paper
C10 H10 Br2 O6P -14.2823; 6.2607; 11.5497
96.701; 93.93; 90.575
306.76Khotchasanthong, Kenika; Jittirattanakun, Siripak; Jiajaroen, Suwadee; Theppitak, Chatphorn; Chainok, Kittipong
Crystal structure and Hirshfeld surface analysis of 2,5-dibromoterephthalic acid ethylene glycol monosolvate
Acta Crystallographica Section E, 2019, 75, 1228-1231
2243030 CIF
HKL
Paper
C26 H16 Cl6 N6 O2P 1 21/c 15.9406; 18.856; 12.2375
90; 96.863; 90
1361Ahmed, Muhib; Devereux, Michael; McKee, Vickie; McCann, Malachy; Rooney, A. Denise
(<i>E</i>)-6,6'-(Diazene-1,2-diyl)bis(1,10-phenanthrolin-5-ol) trichloromethane disolvate: a superconjugated ligand
Acta Crystallographica Section E, 2019, 75, 1224-1227
2243031 CIF
HKL
Paper
C19 H18 N2 O3 SP 1 21/n 116.993; 9.955; 21.243
90; 99.531; 90
3544Yennawar, Hemant P.; Peterson, Samuel D.; Silverberg, Lee J.
Crystal structures of two isomeric 2-aryl-3-phenyl-1,3-thiazepan-4-ones
Acta Crystallographica Section E, 2019, 75, 1270-1273
2243032 CIF
HKL
C19 H18 N2 O3 SP c a 2117.478; 10.4125; 9.7129
90; 90; 90
1767.6Yennawar, Hemant P.; Peterson, Samuel D.; Silverberg, Lee J.
Crystal structures of two isomeric 2-aryl-3-phenyl-1,3-thiazepan-4-ones
Acta Crystallographica Section E, 2019, 75, 1270-1273
2243033 CIF
HKL
Paper
C13 H25 N O3 SP -111.7761; 11.8731; 18.2788
92.501; 94.696; 116.609
2268.09Tuksar, Mihaela; Rubčić, Mirta; Meštrović, Ernest
(3,5-Dimethyladamantan-1-yl)ammonium methanesulfonate (memantinium mesylate): synthesis, structure and solid-state properties
Acta Crystallographica Section E, 2019, 75, 1274-1279
2243034 CIF
HKL
Paper
C69.68 H118.37 Cl3 N4 O6 Pd2P 1 21/c 115.8843; 29.78; 16.6629
90; 109.554; 90
7427.6Graziano, Brendan J.; Wile, Bradley M.; Zeller, Matthias
Palladium(II) complexes of a bridging amine bis(phenolate) ligand featuring κ^2^ and κ^3^ coordination modes
Acta Crystallographica Section E, 2019, 75, 1265-1269
2243035 CIF
HKL
Paper
C5 H15 Br3 K N2 O0.5A m m 213.411; 9.488; 9.79
90; 90; 90
1245.7Ferrandin, Sarah; Slawin, Alexandra M. Z.; Harrison, William T. A.
Syntheses and crystal structures of a new family of hybrid perovskites: C~5~H~14~N~2~·<i>A</i>Br~3~·0.5H~2~O (<i>A</i> = K, Rb, Cs)
Acta Crystallographica Section E, 2019, 75, 1243-1248
2243036 CIF
HKL
Paper
C5 H15 Br3 N2 O0.5 RbA m m 213.477; 9.5617; 9.85
90; 90; 90
1269.3Ferrandin, Sarah; Slawin, Alexandra M. Z.; Harrison, William T. A.
Syntheses and crystal structures of a new family of hybrid perovskites: C~5~H~14~N~2~·<i>A</i>Br~3~·0.5H~2~O (<i>A</i> = K, Rb, Cs)
Acta Crystallographica Section E, 2019, 75, 1243-1248
2243037 CIF
HKL
Paper
C5 H15 Br3 Cs N2 O0.5A m m 213.61; 9.7201; 9.977
90; 90; 90
1319.9Ferrandin, Sarah; Slawin, Alexandra M. Z.; Harrison, William T. A.
Syntheses and crystal structures of a new family of hybrid perovskites: C~5~H~14~N~2~·<i>A</i>Br~3~·0.5H~2~O (<i>A</i> = K, Rb, Cs)
Acta Crystallographica Section E, 2019, 75, 1243-1248
2243038 CIF
HKL
Paper
C24 H36 Br4 Mn2 N4 O8P -18.956; 9.7922; 10.2945
110.048; 90.336; 98.052
838.34Lynch, Sheridan; Lynch, Genevieve; Lynch, Will E.; Padgett, Clifford W.
Crystal structures of four dimeric manganese(II) bromide coordination complexes with various derivatives of pyridine <i>N</i>-oxide
Acta Crystallographica Section E, 2019, 75, 1284-1290
2243039 CIF
HKL
Paper
C24 H32 Br4 Mn2 N4 O6P -17.6354; 9.97; 11.898
111.98; 100.36; 97.737
805.71Lynch, Sheridan; Lynch, Genevieve; Lynch, Will E.; Padgett, Clifford W.
Crystal structures of four dimeric manganese(II) bromide coordination complexes with various derivatives of pyridine <i>N</i>-oxide
Acta Crystallographica Section E, 2019, 75, 1284-1290
2243040 CIF
HKL
Paper
C26 H36 Br4 Mn2 N4 O6P 1 21/n 113.5384; 9.5354; 13.7292
90; 103.112; 90
1726.15Lynch, Sheridan; Lynch, Genevieve; Lynch, Will E.; Padgett, Clifford W.
Crystal structures of four dimeric manganese(II) bromide coordination complexes with various derivatives of pyridine <i>N</i>-oxide
Acta Crystallographica Section E, 2019, 75, 1284-1290
2243041 CIF
HKL
C20 H24 Br4 Mn2 N4 O6P 1 21/n 17.736; 15.179; 12.528
90; 100.055; 90
1448.5Lynch, Sheridan; Lynch, Genevieve; Lynch, Will E.; Padgett, Clifford W.
Crystal structures of four dimeric manganese(II) bromide coordination complexes with various derivatives of pyridine <i>N</i>-oxide
Acta Crystallographica Section E, 2019, 75, 1284-1290
2243042 CIF
HKL
Paper
C18 H20 N2 O2C 1 c 129.403; 7.9811; 6.7898
90; 97.352; 90
1580.3Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Sagar, Belakavadi K.; Foro, Sabine; Glidewell, Christopher
Six 1-aroyl-4-(4-methoxyphenyl)piperazines: similar molecular structures but different patterns of supramolecular assembly
Acta Crystallographica Section E, 2019, 75, 1253-1260
2243043 CIF
HKL
Paper
C18 H19 F N2 O2P 1 21/c 16.998; 7.938; 28.415
90; 92.2; 90
1577.3Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Sagar, Belakavadi K.; Foro, Sabine; Glidewell, Christopher
Six 1-aroyl-4-(4-methoxyphenyl)piperazines: similar molecular structures but different patterns of supramolecular assembly
Acta Crystallographica Section E, 2019, 75, 1253-1260
2243044 CIF
HKL
Paper
C18 H19 Cl N2 O2P b c a13.032; 13.247; 19.258
90; 90; 90
3324.6Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Sagar, Belakavadi K.; Foro, Sabine; Glidewell, Christopher
Six 1-aroyl-4-(4-methoxyphenyl)piperazines: similar molecular structures but different patterns of supramolecular assembly
Acta Crystallographica Section E, 2019, 75, 1253-1260
2243045 CIF
HKL
Paper
C18 H19 Br N2 O2P b c a12.9119; 13.3664; 19.5019
90; 90; 90
3365.7Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Sagar, Belakavadi K.; Foro, Sabine; Glidewell, Christopher
Six 1-aroyl-4-(4-methoxyphenyl)piperazines: similar molecular structures but different patterns of supramolecular assembly
Acta Crystallographica Section E, 2019, 75, 1253-1260
2243046 CIF
HKL
Paper
C18 H19 I N2 O2P b c a12.7671; 13.5429; 20.2542
90; 90; 90
3502Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Sagar, Belakavadi K.; Foro, Sabine; Glidewell, Christopher
Six 1-aroyl-4-(4-methoxyphenyl)piperazines: similar molecular structures but different patterns of supramolecular assembly
Acta Crystallographica Section E, 2019, 75, 1253-1260
2243047 CIF
HKL
Paper
C18 H20 N2 O3P b c a9.7265; 12.9084; 24.861
90; 90; 90
3121.4Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Sagar, Belakavadi K.; Foro, Sabine; Glidewell, Christopher
Six 1-aroyl-4-(4-methoxyphenyl)piperazines: similar molecular structures but different patterns of supramolecular assembly
Acta Crystallographica Section E, 2019, 75, 1253-1260
2243048 CIF
HKL
Paper
C4 H11 Br2 Cs N2P b c m4.5787; 23.325; 9.1828
90; 90; 90
980.7Rickaby, Kirstie A.; Slawin, Alexandra M. Z.; Harrison, William T. A.
Syntheses and structures of piperazin-1-ium <i>A</i>Br~2~ (<i>A</i> = Cs or Rb): hybrid solids containing `curtain wall' layers of face- and edge-sharing <i>A</i>Br~6~ trigonal prisms
Acta Crystallographica Section E, 2019, 75, 1249-1252
2243049 CIF
HKL
Paper
C4 H11 Br2 N2 RbP b c m4.4675; 23.036; 9.021
90; 90; 90
928.4Rickaby, Kirstie A.; Slawin, Alexandra M. Z.; Harrison, William T. A.
Syntheses and structures of piperazin-1-ium <i>A</i>Br~2~ (<i>A</i> = Cs or Rb): hybrid solids containing `curtain wall' layers of face- and edge-sharing <i>A</i>Br~6~ trigonal prisms
Acta Crystallographica Section E, 2019, 75, 1249-1252
2243050 CIF
HKL
Paper
C20 H4 Co3 F12 Mo O6 S6C 1 2/c 122.7465; 12.8779; 23.6033
90; 115.384; 90
6246.5Nguyen, Neilson; Lough, Alan J.; Fekl, Ulrich
A molybdenum tris(dithiolene) complex coordinates to three bound cobalt centers in three different ways
Acta Crystallographica Section E, 2019, 75, 1261-1264
2243051 CIF
HKL
Paper
C14 H12 N2 O4P 1 21/c 111.5352; 7.1711; 15.0606
90; 108.548; 90
1181.1Chantrapromma, Suchada; Kwong, Huey Chong; Prachumrat, Patcharawadee; Kobkeatthawin, Thawanrat; Chia, Tze Shyang; Quah, Ching Kheng
Crystal structure of (<i>E</i>)-<i>N</i>'-(3,4-dihydroxybenzylidene)-4-hydroxybenzohydrazide
Acta Crystallographica Section E, 2019, 75, 1280-1283
2243052 CIF
HKL
Paper
C19 H20 N4 O2 S2P 1 21/c 113.1955; 10.0157; 14.5476
90; 98.329; 90
1902.36Asegbeloyin, Jonnie N.; Ifeanyieze, Kenechukwu J.; Okpareke, Obinna C.; Oyeka, Ebube E.; Groutso, Tatiana V.
Crystal structure and Hirshfeld surface analysis of a new dithioglycoluril: 1,4-bis(4-methoxyphenyl)-3<i>a</i>-methyltetrahydroimidazo[4,5-<i>d</i>]imidazole-2,5(1<i>H</i>,3<i>H</i>)-dithione
Acta Crystallographica Section E, 2019, 75, 1297-1300
2243053 CIF
HKL
Paper
C25 H29 N3 O3P 1 21/c 111.7624; 22.9546; 8.1934
90; 93.717; 90
2207.6Bogdanov, Georgii; Tillotson, John P.; Bustos, Jenna; Timofeeva, Tatiana V.
Synthesis and structure of push‒pull merocyanines based on barbituric and thiobarbituric acid
Acta Crystallographica Section E, 2019, 75, 1306-1310
2243054 CIF
HKL
C21 H25 N3 O2 SP 1 21/c 116.1504; 8.1264; 15.6487
90; 108.849; 90
1943.67Bogdanov, Georgii; Tillotson, John P.; Bustos, Jenna; Timofeeva, Tatiana V.
Synthesis and structure of push‒pull merocyanines based on barbituric and thiobarbituric acid
Acta Crystallographica Section E, 2019, 75, 1306-1310
2243055 CIF
HKL
C18 H24 N2 O4P 1 21/c 19.852; 12.789; 14.875
90; 106.932; 90
1793Chadeayne, Andrew R.; Pham, Duyen N. K.; Golen, James A.; Manke, David R.
The fumarate salts of the <i>N</i>-isopropyl-<i>N</i>-methyl derivatives of DMT and psilocin
Acta Crystallographica Section E, 2019, 75, 1316-1320
2243056 CIF
HKL
C18 H26 N2 O6C 1 2/c 129.507; 8.7445; 17.3659
90; 123.389; 90
3741.3Chadeayne, Andrew R.; Pham, Duyen N. K.; Golen, James A.; Manke, David R.
The fumarate salts of the <i>N</i>-isopropyl-<i>N</i>-methyl derivatives of DMT and psilocin
Acta Crystallographica Section E, 2019, 75, 1316-1320
2243057 CIF
HKL
Paper
C15 H13 Cl N2 O2P 1 21/n 18.1752; 13.2684; 12.7391
90; 100.105; 90
1360.4Mertens, R. Tyler; Parkin, Sean R.; Awuah, Samuel G.
Synthesis and crystal structure of 1,3-bis(4-hydroxyphenyl)-1<i>H</i>-imidazol-3-ium chloride
Acta Crystallographica Section E, 2019, 75, 1311-1315
2243058 CIF
HKL
C129 H105 O7 Yb2P 1 21/c 114.4612; 20.8473; 32.0864
90; 95.508; 90
9628.6Berg, David J.; Twamley, Brendan
Crystal structure of a binuclear mixed-valence ytterbium complex containing a 2-anthracene-substituted phenoxide ligand
Acta Crystallographica Section E, 2019, 75, 1367-1371
2243059 CIF
HKL
Paper
C18 H16 N4 OP 1 21/c 18.942; 15.113; 11.5829
90; 100.132; 90
1540.91Filali, Mouad; Sebbar, Nada Kheira; Hökelek, Tuncer; Mague, Joel T.; Chakroune, Said; Ben-Tama, Abdessalam; El Hadrami, El Mestafa
Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of 4-[(prop-2-en-1-yloxy)methyl]-3,6-bis(pyridin-2-yl)pyridazine
Acta Crystallographica Section E, 2019, 75, 1321-1326
2243060 CIF
HKL
Paper
C7 H4 F3 N O2P 1 21/c 18.2767; 8.5106; 10.55
90; 99.443; 90
733.07Zreigh, Mohamed M.; Adams, Harry; Jackson, Richard F. W.; Robertson, Craig C.
The first crystal structure of the pyrrolo[1,2-<i>c</i>]oxazole ring system
Acta Crystallographica Section E, 2019, 75, 1336-1338
2243061 CIF
HKL
Paper
C26 H36 B2 Fe N12P 1 21/c 116.0762; 10.1827; 18.341
90; 108.785; 90
2842.48Seredyuk, Maksym; Znovjyak, Kateryna; Fritsky, Igor O.; Sliva, Tatiana Y.; Slobodyanik, Mykola S.
Crystal structure and magnetic properties of bis[butyltris(1<i>H</i>-pyrazol-1-yl)borato]iron(II)
Acta Crystallographica Section E, 2019, 75, 1327-1330

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