Crystallography Open Database

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2021391 CIF
Paper
C116 H90.67 As2 Cu8 Eu2 K2 N16 O117.5 W22I 1 2/a 130.5449; 14.2507; 48.6187
90; 107.836; 90
20145.9Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat
Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021392 CIF
HKL
Paper
C116 H92 As2 Cu8 Gd2 K2 N16 O126 W22I 1 2/a 130.5038; 14.1439; 48.2029
90; 108.131; 90
19764.2Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat
Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021393 CIF
HKL
Paper
C116 H92 As2 Cu8 K2 N16 O126 Tb2 W22I 1 2/a 130.4415; 14.0792; 48.0609
90; 108.235; 90
19564.1Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat
Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021394 CIF
HKL
Paper
C116 H88 As2 Cu8 Dy2 K2 N16 O128 W22I 1 2/a 130.481; 14.104; 48.1783
90; 108.247; 90
19670.6Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat
Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021395 CIF
HKL
Paper
C116 H94 As2 Cu8 Ho2 K2 N16 O128 W22I 1 2/a 130.4802; 14.113; 48.116
90; 108.169; 90
19665.9Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat
Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021396 CIF
HKL
Paper
C116 H87 As2 Cu8 Er2 K2 N16 O128 W22I 1 2/a 130.581; 14.1638; 48.299
90; 108.273; 90
19865Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat
Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021397 CIF
HKL
Paper
C12 H10 N2 O4P -16.6714; 7.3296; 12.987
90.425; 96.907; 114.347
573.23Dutkiewicz, Grzegorz; Dutkiewicz, Edward; Kubicki, Maciej
Cocrystals of pyrazine and benzene polycarboxylic acids
Acta Crystallographica Section C, 2018, 74, 1420-1426
2021398 CIF
HKL
C13 H10 N2 O6P -17.7184; 9.9393; 10.03
115.029; 112.471; 92.672
624Dutkiewicz, Grzegorz; Dutkiewicz, Edward; Kubicki, Maciej
Cocrystals of pyrazine and benzene polycarboxylic acids
Acta Crystallographica Section C, 2018, 74, 1420-1426
2021399 CIF
HKL
C22 H20 N2 O14P -16.6537; 8.3316; 11.5433
73.1; 75.565; 73.001
576.01Dutkiewicz, Grzegorz; Dutkiewicz, Edward; Kubicki, Maciej
Cocrystals of pyrazine and benzene polycarboxylic acids
Acta Crystallographica Section C, 2018, 74, 1420-1426
2021400 CIF
HKL
C22 H18 N6 O8P 1 21/c 17.0481; 22.365; 7.212
90; 96.967; 90
1128.44Dutkiewicz, Grzegorz; Dutkiewicz, Edward; Kubicki, Maciej
Cocrystals of pyrazine and benzene polycarboxylic acids
Acta Crystallographica Section C, 2018, 74, 1420-1426
2021401 CIF
Paper
C3 As2 Na12 O113 W20 Y2P -113.3054; 18.0281; 22.4544
91.09; 92.169; 108.155
5111.7Kaushik, Reetam; Khan, Imran; Saini, Mukesh Kumar; Hussain, Firasat; Sadakane, Masahiro
Synthesis and characterization of carbonate-encapsulated ytterbium- and yttrium-containing polyoxotungstates
Acta Crystallographica Section C, 2018, 74, 1355-1361
2021402 CIF
Paper
C Ge2 K3 Na4 O95 W18 Y5C 1 2/c 123.3948; 24.5658; 18.6887
90; 110.869; 90
10036Kaushik, Reetam; Khan, Imran; Saini, Mukesh Kumar; Hussain, Firasat; Sadakane, Masahiro
Synthesis and characterization of carbonate-encapsulated ytterbium- and yttrium-containing polyoxotungstates
Acta Crystallographica Section C, 2018, 74, 1355-1361
2021403 CIF
Paper
C Ge2 K8 Na O93 W18 Yb4C 1 2/c 122.2367; 22.6726; 20.1786
90; 111.037; 90
9495.3Kaushik, Reetam; Khan, Imran; Saini, Mukesh Kumar; Hussain, Firasat; Sadakane, Masahiro
Synthesis and characterization of carbonate-encapsulated ytterbium- and yttrium-containing polyoxotungstates
Acta Crystallographica Section C, 2018, 74, 1355-1361
2021404 CIF
HKL
Paper
C68 H64 N14 O20 S4P -19.1561; 12.766; 15.1022
83.03; 75.313; 83.972
1689.87Liu, Xiaojiao; Michalchuk, Adam A. L.; Pulham, Colin R.; Boldyreva, Elena V.
An acetonitrile-solvated cocrystal of piroxicam and succinic acid with co-existing zwitterionic and non-ionized piroxicam molecules
Acta Crystallographica Section C, 2019, 75, 29-37
2021405 CIFC34 H32 N6 O12 S2P -17.6779; 8.4177; 14.3934
79.528; 74.65; 72.82
851.61Liu, Xiaojiao; Michalchuk, Adam A. L.; Pulham, Colin R.; Boldyreva, Elena V.
An acetonitrile-solvated cocrystal of piroxicam and succinic acid with co-existing zwitterionic and non-ionized piroxicam molecules
Acta Crystallographica Section C, 2019, 75, 29-37
2021406 CIF
HKL
Paper
C116 H192.8 O105C 2 2 2119.0698; 24.1017; 31.0577
90; 90; 90
14274.6Aree, Thammarat
Inclusion complex of β-cyclodextrin with coffee chlorogenic acid: new insights from a combined crystallographic and theoretical study
Acta Crystallographica Section C, 2019, 75, 15-21
2021407 CIF
HKL
Paper
C42 H39 N4 O10.5 ZnP c a a11.099; 12.917; 26.55
90; 90; 90
3806Chen, Zhen; Sun, Yanwen; Liu, Zi-an; Wang, Ning; Yang, Xue; You, Xiaomeng; Wang, Xiaozhong
A three-dimensional Zn^II^ coordination network based on 5,5'-methylenebis(2,4,6-trimethylisophthalic acid) and 2,7-bis(1<i>H</i>-imidazol-1-yl)fluorene: synthesis, structure and luminescence properties
Acta Crystallographica Section C, 2019, 75, 8-14
2021408 CIF
HKL
Paper
C5 H7 N5 O2C 1 2/c 116.357; 3.712; 22.723
90; 101.72; 90
1350.9Laos, Roberto; Lampropoulos, Christos; Benner, Steven A.
The surprising pairing of 2-aminoimidazo[1,2-<i>a</i>][1,3,5]triazin-4-one, a component of an expanded DNA alphabet
Acta Crystallographica Section C, 2019, 75, 22-28
2021409 CIF
HKL
Paper
C19 H16 N4 OP 1 21/c 15.6126; 10.0683; 27.2349
90; 90.095; 90
1539.02Araujo, Vinicius Oliveira; Tirloni, Bárbara; Streit, Lívia; Schwade, Vânia Denise
Neutral 4-phenyl-1-[phenyl(pyridin-2-yl)methylidene]semicarbazide and its salt forms with inorganic anions
Acta Crystallographica Section C, 2019, 75, 1-7
2021410 CIF
HKL
Paper
C19 H21 Cl N4 O3P 1 21/c 19.4452; 9.5489; 21.039
90; 95.26; 90
1889.5Araujo, Vinicius Oliveira; Tirloni, Bárbara; Streit, Lívia; Schwade, Vânia Denise
Neutral 4-phenyl-1-[phenyl(pyridin-2-yl)methylidene]semicarbazide and its salt forms with inorganic anions
Acta Crystallographica Section C, 2019, 75, 1-7
2021411 CIF
HKL
Paper
C19 H21 N5 O6P 1 21/c 19.5556; 9.305; 22.2715
90; 96.048; 90
1969.25Araujo, Vinicius Oliveira; Tirloni, Bárbara; Streit, Lívia; Schwade, Vânia Denise
Neutral 4-phenyl-1-[phenyl(pyridin-2-yl)methylidene]semicarbazide and its salt forms with inorganic anions
Acta Crystallographica Section C, 2019, 75, 1-7
2021412 CIF
HKL
Paper
C20 H22 N5 O3.5 SP 1 21/n 113.0053; 7.7965; 20.8703
90; 107.887; 90
2013.87Araujo, Vinicius Oliveira; Tirloni, Bárbara; Streit, Lívia; Schwade, Vânia Denise
Neutral 4-phenyl-1-[phenyl(pyridin-2-yl)methylidene]semicarbazide and its salt forms with inorganic anions
Acta Crystallographica Section C, 2019, 75, 1-7
2021413 CIFC4 H12 Br4 O2 S2 SnP 1 21/n 17.7728; 14.676; 13.632
90; 91.11; 90
1554.8Gregorkiewitz M; Tudela D
STRUCTURE AND PSEUDOSYMMETRY OF TETRABROMOBIS(DIMETHYL SULFOXIDE)TIN(IV)
Acta Crystallographica C, 1990, 46, 210-213
2021415 CIF
HKL
Paper
C5 H16 N6 O4P b c a12.3448; 9.9435; 16.9904
90; 90; 90
2085.6Roodt, Gerhard T.; Uprety, Bhawna; Levendis, Demetrius C.; Arderne, Charmaine
Energetic propane-1,3-diaminium and butane-1,4-diaminium salts of <i>N</i>,<i>N</i>'-dinitroethylenediazanide: syntheses, crystal structures and thermal properties
Acta Crystallographica Section C, 2019, 75, 54-60
2021416 CIF
HKL
Paper
C6 H18 N6 O4P 1 21/n 15.408; 7.203; 14.288
90; 98.03; 90
551.1Roodt, Gerhard T.; Uprety, Bhawna; Levendis, Demetrius C.; Arderne, Charmaine
Energetic propane-1,3-diaminium and butane-1,4-diaminium salts of <i>N</i>,<i>N</i>'-dinitroethylenediazanide: syntheses, crystal structures and thermal properties
Acta Crystallographica Section C, 2019, 75, 54-60
2021417 CIF
HKL
Paper
C40 H28 Eu N9 O19P -19.8247; 15.2829; 15.9914
109.498; 103.761; 106.11
2024.57Xiang, Zheng; Shan, Yue-Bin; Li, Tao; Huang, Chang-Cang; Huang, Xi-He; Lin, Mei-Jin
Four isostructural lanthanide(III) coordination compounds based on a new <i>N</i>-oxydic pyridyl naphthalenediimide ligand: synthesis and characterization
Acta Crystallographica Section C, 2019, 75, 38-45
2021418 CIF
HKL
Paper
C40 H28 Gd N9 O19P -19.8335; 15.3314; 16.0227
109.641; 103.642; 106.064
2036.8Xiang, Zheng; Shan, Yue-Bin; Li, Tao; Huang, Chang-Cang; Huang, Xi-He; Lin, Mei-Jin
Four isostructural lanthanide(III) coordination compounds based on a new <i>N</i>-oxydic pyridyl naphthalenediimide ligand: synthesis and characterization
Acta Crystallographica Section C, 2019, 75, 38-45
2021419 CIF
HKL
Paper
C40 H28 Dy N9 O19P -19.8244; 15.2522; 15.9247
109.461; 103.6; 106.05
2016.2Xiang, Zheng; Shan, Yue-Bin; Li, Tao; Huang, Chang-Cang; Huang, Xi-He; Lin, Mei-Jin
Four isostructural lanthanide(III) coordination compounds based on a new <i>N</i>-oxydic pyridyl naphthalenediimide ligand: synthesis and characterization
Acta Crystallographica Section C, 2019, 75, 38-45
2021420 CIF
HKL
Paper
C40 H28 Er N9 O19P -19.8242; 15.2333; 15.8956
109.532; 103.449; 106.019
2011.59Xiang, Zheng; Shan, Yue-Bin; Li, Tao; Huang, Chang-Cang; Huang, Xi-He; Lin, Mei-Jin
Four isostructural lanthanide(III) coordination compounds based on a new <i>N</i>-oxydic pyridyl naphthalenediimide ligand: synthesis and characterization
Acta Crystallographica Section C, 2019, 75, 38-45
2021421 CIF
HKL
Paper
C19 H20 Cl N4 O4.5C 1 2/c 114.9367; 15.791; 33.5896
90; 100.123; 90
7799.3Faroque, Muhammad Umer; Noureen, Sajida; Mirza, Shafaat Hussain; Tahir, Muhammad Nawaz; Ahmed, Maqsood
Structure and electrostatic properties of the pyrimethamine‒3,5-dihydroxybenzoic acid cocrystal in water solvent studied using transferred electron-density parameters
Acta Crystallographica Section C, 2019, 75, 46-53
2021422 CIF
HKL
C19 H20 Cl N4 O4.5C 1 2/c 114.9367; 15.791; 33.5896
90; 100.123; 90
7799.3Faroque, Muhammad Umer; Noureen, Sajida; Mirza, Shafaat Hussain; Tahir, Muhammad Nawaz; Ahmed, Maqsood
Structure and electrostatic properties of the pyrimethamine‒3,5-dihydroxybenzoic acid cocrystal in water solvent studied using transferred electron-density parameters
Acta Crystallographica Section C, 2019, 75, 46-53
2021423 CIF
HKL
C19 H20 Cl N4 O4.5C 1 2/c 114.9367; 15.791; 33.5896
90; 100.123; 90
7799.3Faroque, Muhammad Umer; Noureen, Sajida; Mirza, Shafaat Hussain; Tahir, Muhammad Nawaz; Ahmed, Maqsood
Structure and electrostatic properties of the pyrimethamine‒3,5-dihydroxybenzoic acid cocrystal in water solvent studied using transferred electron-density parameters
Acta Crystallographica Section C, 2019, 75, 46-53
2021427 CIF
HKL
Paper
C30 H36 N2 O3 S2P 43 21 29.0917; 9.0917; 68.392
90; 90; 90
5653.2Cole, Wyatt; Hemmingson, Stephanie L.; Eisenberg, Audrey C.; Ulman, Catherine A.; Tanski, Joseph M.; Getzler, Yutan D. Y. L.
Synthesis and crystal structures of some bis(3-methyl-1<i>H</i>-indol-2-yl)(salicyl)methanes
Acta Crystallographica Section C, 2019, 75, 65-69
2021428 CIF
HKL
Paper
C29 H32 Cl2 N2 O3 S2P -18.9836; 10.9082; 15.782
72.406; 83.232; 83.086
1458.1Cole, Wyatt; Hemmingson, Stephanie L.; Eisenberg, Audrey C.; Ulman, Catherine A.; Tanski, Joseph M.; Getzler, Yutan D. Y. L.
Synthesis and crystal structures of some bis(3-methyl-1<i>H</i>-indol-2-yl)(salicyl)methanes
Acta Crystallographica Section C, 2019, 75, 65-69
2021429 CIF
HKL
C14 H12 O2 SeP 1 21/c 18.8185; 17.4773; 7.9793
90; 108.328; 90
1167.41Venkateshwaran, Krishnan; Deka, Rajesh; Raju, Saravanan; Singh, Harkesh B.; Butcher, Ray J.
Hypervalent organoselenium compounds stabilized by intramolecular coordination: synthesis and crystal structures
Acta Crystallographica Section C, 2019, 75
2021430 CIF
HKL
C14 H12 O Se2P 1 21/c 17.1083; 13.8408; 12.5601
90; 92.663; 90
1234.39Venkateshwaran, Krishnan; Deka, Rajesh; Raju, Saravanan; Singh, Harkesh B.; Butcher, Ray J.
Hypervalent organoselenium compounds stabilized by intramolecular coordination: synthesis and crystal structures
Acta Crystallographica Section C, 2019, 75
2021431 CIF
HKL
Paper
C15 H25 N O3P 1 21/n 116.0344; 5.4375; 17.8512
90; 100.731; 90
1529.18Rossi, Patrizia; Paoli, Paola; Chelazzi, Laura; Conti, Luca; Bencini, Andrea
The solid-state structure of the β-blocker metoprolol: a combined experimental and in silico investigation
Acta Crystallographica Section C Structural Chemistry, 2019, 75
2021432 CIF
HKL
Paper
C26 H24 N4P 1 21/c 18.128; 8.2147; 32.9809
90; 90.252; 90
2202.08Tan, Xue-Jie; Zhang, Ling-Yao; Sun, Yuan-Kai; Zhou, Xue-Min
Synthesis, structure and antiproliferative and optical activities of two new biphenyl-derived Schiff bases
Acta Crystallographica Section C, 2019, 75
2021435 CIF
Paper
C38 H48 Cl2 N4 O4 S2P 1 21/c 18.8247; 26.4201; 8.7393
90; 103.07; 90
1984.78Borodi, Gheorghe; Turza, Alexandru; Onija, Oana; Bende, Attila
Succinic, fumaric, adipic and oxalic acid cocrystals of promethazine hydrochloride
Acta Crystallographica Section C, 2019, 75, 107-119
2021436 CIF
HKL
Paper
C38 H46 Cl2 N4 O4 S2P 1 21/c 18.7741; 25.8762; 8.6007
90; 102.92; 90
1903.27Borodi, Gheorghe; Turza, Alexandru; Onija, Oana; Bende, Attila
Succinic, fumaric, adipic and oxalic acid cocrystals of promethazine hydrochloride
Acta Crystallographica Section C, 2019, 75, 107-119
2021437 CIF
HKL
Paper
C40 H52 Cl2 N4 O4 S2P 1 21/c 18.8988; 27.7992; 8.7933
90; 103.484; 90
2115.32Borodi, Gheorghe; Turza, Alexandru; Onija, Oana; Bende, Attila
Succinic, fumaric, adipic and oxalic acid cocrystals of promethazine hydrochloride
Acta Crystallographica Section C, 2019, 75, 107-119
2021438 CIF
HKL
Paper
C36 H44 Cl2 N4 O4 S2P 1 21/n 110.5507; 12.4382; 14.2966
90; 100.445; 90
1845.08Borodi, Gheorghe; Turza, Alexandru; Onija, Oana; Bende, Attila
Succinic, fumaric, adipic and oxalic acid cocrystals of promethazine hydrochloride
Acta Crystallographica Section C, 2019, 75, 107-119
2021439 CIF
HKL
Paper
C19 H22 N2 O4 SP -18.684; 11.3871; 20.0923
104.106; 90.386; 108.34
1821.53Borodi, Gheorghe; Turza, Alexandru; Onija, Oana; Bende, Attila
Succinic, fumaric, adipic and oxalic acid cocrystals of promethazine hydrochloride
Acta Crystallographica Section C, 2019, 75, 107-119
2021440 CIF
HKL
Paper
C7 H12 As N O5P -15.5235; 9.4385; 10.4633
70.769; 75.984; 89.624
498.12Harchani, Ali; Trzybiński, Damian; Pawledzio, Sylwia; Woźniak, Krzysztof; Haddad, Amor
Crystallographic and computational studies of a new organoarsenate compound: <i>o</i>-anisidinium dihydroarsenate
Acta Crystallographica Section C, 2019, 75
2021441 CIF
HKL
Paper
C5 H7 Cd Cl2 N3 O3P -16.9452; 7.8334; 9.9918
98.677; 97.359; 111.725
489.093Bouchene, Rafika; Bouacida, Sofiane
Syntheses, supramolecular networks and Hirshfeld surface and thermal analyses of two new cadmium chloride coordination polymers with an <i>N</i>,<i>O</i>-chelating ligand
Acta Crystallographica Section C, 2019, 75
2021442 CIF
HKL
Paper
C10 H12 Cd Cl2 N6 O5P c a b7.2637; 17.7011; 24.3144
90; 90; 90
3126.24Bouchene, Rafika; Bouacida, Sofiane
Syntheses, supramolecular networks and Hirshfeld surface and thermal analyses of two new cadmium chloride coordination polymers with an <i>N</i>,<i>O</i>-chelating ligand
Acta Crystallographica Section C, 2019, 75
2021443 CIF
HKL
Paper
C2 H10 Co6 O15P -6 2 m10.3236; 10.3236; 3.12244
90; 90; 120
288.2Prateek Bhojane; Armel Le Bail; Parasharam M. Shirage
A quarter of a century after its synthesis and with >200 papers based on its use, `Co(CO~3~)~0.5~(OH)\χdot0.11H~2~O' proves to be Co~6~(CO~3~)~2~(OH)~8~\χdotH~2~O from synchrotron powder diffraction data
Acta Crystallographica, Section C, 2019, 75, 61-64
2021444 CIF
HKL
Paper
C27 H21 Cd N5 O9P 1 21/c 112.829; 15.854; 20.769
90; 122.215; 90
3574Qin, Tao; Zhang, Shunlin; Wang, Yixiong; Hou, Tianjiao; Zhu, Dunru; Jing, Su
Three novel topologically different metal‒organic frameworks built from 3-nitro-4-(pyridin-4-yl)benzoic acid
Acta Crystallographica Section C, 2019, 75
2021445 CIF
HKL
Paper
C38 H24 Cd2 N6 O14P -18.342; 13.903; 23.568
86.84; 89.264; 78.826
2677Qin, Tao; Zhang, Shunlin; Wang, Yixiong; Hou, Tianjiao; Zhu, Dunru; Jing, Su
Three novel topologically different metal‒organic frameworks built from 3-nitro-4-(pyridin-4-yl)benzoic acid
Acta Crystallographica Section C, 2019, 75
2021446 CIF
HKL
Paper
C32 H36 N6 Ni O12P -111.866; 12.259; 14.248
98.341; 93.604; 117.018
1807Qin, Tao; Zhang, Shunlin; Wang, Yixiong; Hou, Tianjiao; Zhu, Dunru; Jing, Su
Three novel topologically different metal‒organic frameworks built from 3-nitro-4-(pyridin-4-yl)benzoic acid
Acta Crystallographica Section C, 2019, 75
2021447 CIF
HKL
Paper
C26 H18 N2 O10 Zn2P -17.7926; 8.2969; 9.7964
73.953; 76.973; 71.184
569.67Su, Feng; Zhou, Cheng-Yong; Wu, Lin-Tao; Wu, Xi; Han, Chun; Wang, Zhi-Jun
Synthesis, structure and selective luminescence sensing for iron(III) ions of a three-dimensional zinc(II) (4,6)-connected coordination network
Acta Crystallographica Section C, 2019, 75
2021448 CIF
HKL
Paper
C28 H26 Cl2 N2 O4 ZnP -19.1926; 10.6101; 14.8057
94.188; 97.716; 114.409
1289.8Hajiashrafi, Taraneh; Zekriazadeh, Roghayeh; Flanagan, Keith J.; Kia, Farnoush; Bauzá, Antonio; Frontera, Antonio; Senge, Mathias O.
The role of π‒π stacking and hydrogen-bonding interactions in the assembly of a series of isostructural group IIB coordination compounds
Acta Crystallographica Section C, 2019, 75, 178-188
2021449 CIF
HKL
Paper
C28 H26 I2 N2 O4 ZnP -19.2709; 10.02; 16.248
98.56; 100.5; 110.09
1356.7Hajiashrafi, Taraneh; Zekriazadeh, Roghayeh; Flanagan, Keith J.; Kia, Farnoush; Bauzá, Antonio; Frontera, Antonio; Senge, Mathias O.
The role of π‒π stacking and hydrogen-bonding interactions in the assembly of a series of isostructural group IIB coordination compounds
Acta Crystallographica Section C, 2019, 75, 178-188
2021450 CIF
HKL
Paper
C28 H26 Br2 Cd N2 O4P -19.2772; 10.0935; 16.1021
97.699; 100.586; 111.149
1348.92Hajiashrafi, Taraneh; Zekriazadeh, Roghayeh; Flanagan, Keith J.; Kia, Farnoush; Bauzá, Antonio; Frontera, Antonio; Senge, Mathias O.
The role of π‒π stacking and hydrogen-bonding interactions in the assembly of a series of isostructural group IIB coordination compounds
Acta Crystallographica Section C, 2019, 75, 178-188
2021451 CIF
HKL
Paper
C28 H26 Cd I2 N2 O4P -19.32; 10.0498; 16.6239
99.14; 100.528; 109.332
1403.58Hajiashrafi, Taraneh; Zekriazadeh, Roghayeh; Flanagan, Keith J.; Kia, Farnoush; Bauzá, Antonio; Frontera, Antonio; Senge, Mathias O.
The role of π‒π stacking and hydrogen-bonding interactions in the assembly of a series of isostructural group IIB coordination compounds
Acta Crystallographica Section C, 2019, 75, 178-188
2021452 CIF
HKL
Paper
C28 H26 Cl2 Hg N2 O4P -19.2456; 10.151; 15.8499
96.5447; 99.7441; 112.674
1326.25Hajiashrafi, Taraneh; Zekriazadeh, Roghayeh; Flanagan, Keith J.; Kia, Farnoush; Bauzá, Antonio; Frontera, Antonio; Senge, Mathias O.
The role of π‒π stacking and hydrogen-bonding interactions in the assembly of a series of isostructural group IIB coordination compounds
Acta Crystallographica Section C, 2019, 75, 178-188
2021453 CIF
HKL
Paper
C28 H26 Hg I2 N2 O4P -19.2783; 10.006; 16.695
98.777; 100.296; 109.396
1400.4Hajiashrafi, Taraneh; Zekriazadeh, Roghayeh; Flanagan, Keith J.; Kia, Farnoush; Bauzá, Antonio; Frontera, Antonio; Senge, Mathias O.
The role of π‒π stacking and hydrogen-bonding interactions in the assembly of a series of isostructural group IIB coordination compounds
Acta Crystallographica Section C, 2019, 75, 178-188
2021454 CIF
HKL
Paper
C14 H15 Cl2 N O4P -18.858; 9.328; 10.526
96.039; 112.651; 108.99
732Guerrero, Sergio A.; Ramírez, Juan E.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
A concise and versatile route to tetrahydro-1-benzazepines carrying [<i>a</i>]-fused heterocyclic units: synthetic sequence and spectroscopic characterization, and the molecular and supramolecular structures of one intermediate and two products
Acta Crystallographica Section C, 2019, 75
2021455 CIF
HKL
Paper
C15 H17 Cl N2 O4P 1 2/c 19.198; 10.586; 15.223
90; 105.56; 90
1427.9Guerrero, Sergio A.; Ramírez, Juan E.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
A concise and versatile route to tetrahydro-1-benzazepines carrying [<i>a</i>]-fused heterocyclic units: synthetic sequence and spectroscopic characterization, and the molecular and supramolecular structures of one intermediate and two products
Acta Crystallographica Section C, 2019, 75
2021456 CIF
HKL
Paper
C12 H12 Cl N3 O2P -15.595; 8.377; 12.712
98.1; 100.1; 101.76
564.5Guerrero, Sergio A.; Ramírez, Juan E.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
A concise and versatile route to tetrahydro-1-benzazepines carrying [<i>a</i>]-fused heterocyclic units: synthetic sequence and spectroscopic characterization, and the molecular and supramolecular structures of one intermediate and two products
Acta Crystallographica Section C, 2019, 75
2021457 CIF
HKL
Paper
C22 H17 N5 O6 ZnP 1 21/c 112.568; 13.324; 14.207
90; 110.912; 90
2222.3Chen, Ning-Ning; Ni, Jian-Ning; Wang, Jun; Tao, Jian-Qing
A new two-dimensional Zn^II^ coordination polymer based on 1,3-bis(2-methyl-1<i>H</i>-imidazol-1-yl)benzene and 5-nitrobenzene-1,3-dicarboxylic acid: synthesis, crystal structure and physical properties
Acta Crystallographica Section C, 2019, 75, 196-199
2021458 CIF
HKL
Paper
C17 H21 N3 O3P -16.6076; 7.6668; 16.5297
94.565; 93.48; 94.758
829.94Madeley, Lee G.; Levendis, Demetrius C.; Lemmerer, Andreas
Covalent-assisted supramolecular synthesis: the effect of hydrogen bonding in cocrystals of 4-<i>tert</i>-butylbenzoic acid with isoniazid and its derivatized forms
Acta Crystallographica Section C, 2019, 75
2021459 CIF
HKL
Paper
C20 H25 N3 O3P 1 21/c 114.2337; 13.7116; 20.3233
90; 99.298; 90
3914.3Madeley, Lee G.; Levendis, Demetrius C.; Lemmerer, Andreas
Covalent-assisted supramolecular synthesis: the effect of hydrogen bonding in cocrystals of 4-<i>tert</i>-butylbenzoic acid with isoniazid and its derivatized forms
Acta Crystallographica Section C, 2019, 75
2021460 CIF
HKL
Paper
C21 H27 N3 O3P 1 21/c 114.7663; 13.7022; 20.4647
90; 99.279; 90
4086.5Madeley, Lee G.; Levendis, Demetrius C.; Lemmerer, Andreas
Covalent-assisted supramolecular synthesis: the effect of hydrogen bonding in cocrystals of 4-<i>tert</i>-butylbenzoic acid with isoniazid and its derivatized forms
Acta Crystallographica Section C, 2019, 75
2021461 CIF
HKL
Paper
C30 H29 N3 O3P 1 21 17.6967; 10.1984; 15.9931
90; 93.505; 90
1253.01Madeley, Lee G.; Levendis, Demetrius C.; Lemmerer, Andreas
Covalent-assisted supramolecular synthesis: the effect of hydrogen bonding in cocrystals of 4-<i>tert</i>-butylbenzoic acid with isoniazid and its derivatized forms
Acta Crystallographica Section C, 2019, 75
2021462 CIF
HKL
Paper
C23 H31 N3 O4P 1 21/c 120.3803; 6.9598; 17.2533
90; 107.838; 90
2329.61Madeley, Lee G.; Levendis, Demetrius C.; Lemmerer, Andreas
Covalent-assisted supramolecular synthesis: the effect of hydrogen bonding in cocrystals of 4-<i>tert</i>-butylbenzoic acid with isoniazid and its derivatized forms
Acta Crystallographica Section C, 2019, 75
2021463 CIF
HKL
Paper
C26 H25 N OP 21 21 219.6571; 13.0874; 16.4113
90; 90; 90
2074.16Capozzi, Maria Annunziata M.; Terraneo, Giancarlo; Cardellicchio, Cosimo
Structural insights into methyl- or methoxy-substituted 1-(α-aminobenzyl)-2-naphthol structures: the role of C—H···π interactions
Acta Crystallographica Section C, 2019, 75
2021464 CIF
HKL
Paper
C26 H25 N O2P 21 21 2111.74; 11.933; 14.662
90; 90; 90
2054Capozzi, Maria Annunziata M.; Terraneo, Giancarlo; Cardellicchio, Cosimo
Structural insights into methyl- or methoxy-substituted 1-(α-aminobenzyl)-2-naphthol structures: the role of C—H···π interactions
Acta Crystallographica Section C, 2019, 75
2021465 CIF
HKL
Paper
K2 O12 P3 Ta0.5 Tb1.5P 21 310.3262; 10.3262; 10.3262
90; 90; 90
1101.09Xue, Ya-Li; Zhao, Dan; Zhang, Shi-Rui; Li, Ya-Nan; Fan, Yan-Ping
A new disordered langbeinite-type compound, K~2~Tb~1.5~Ta~0.5~P~3~O~12~, and Eu^3+^-doped multicolour light-emitting properties
Acta Crystallographica Section C, 2019, 75, 213-220
2021466 CIF
HKL
Paper
C4 H9 N O4P 1 21/n 19.3716; 11.7529; 11.2357
90; 90.187; 90
1237.5Kats, Eynav; Bernstein, Joel; Lemmerer, Andreas
A new polymorph of ammonium succinate ‒ serendipity in action
Acta Crystallographica Section C, 2019, 75, 208-212
2021467 CIF
HKL
Paper
C32 H43 Gd2 N3 O17P 1 21/n 19.3992; 17.6714; 11.2971
90; 94.318; 90
1871.1Hao, Hongguo; Liu, Hongyan; Wang, Yuchen; Yuan, Suxian; Xu, Han; Zhang, Jingyue; Wang, Ying; Li, Dacheng; Sun, Junshan
A series of two-dimensional lanthanide coordination polymers: synthesis, structures, magnetism and selective luminescence detection for heavy metal ions and toxic solvents
Acta Crystallographica Section C, 2019, 75, 221-230
2021468 CIF
HKL
Paper
C32 H43 Dy2 N3 O17P 1 21/n 19.3529; 17.6217; 11.3758
90; 94.494; 90
1869.1Hao, Hongguo; Liu, Hongyan; Wang, Yuchen; Yuan, Suxian; Xu, Han; Zhang, Jingyue; Wang, Ying; Li, Dacheng; Sun, Junshan
A series of two-dimensional lanthanide coordination polymers: synthesis, structures, magnetism and selective luminescence detection for heavy metal ions and toxic solvents
Acta Crystallographica Section C, 2019, 75, 221-230
2021469 CIF
HKL
Paper
C28 H34 N2 Nd2 O16P 1 21/n 19.5383; 17.966; 11.3703
90; 94.402; 90
1942.7Hao, Hongguo; Liu, Hongyan; Wang, Yuchen; Yuan, Suxian; Xu, Han; Zhang, Jingyue; Wang, Ying; Li, Dacheng; Sun, Junshan
A series of two-dimensional lanthanide coordination polymers: synthesis, structures, magnetism and selective luminescence detection for heavy metal ions and toxic solvents
Acta Crystallographica Section C, 2019, 75, 221-230
2021470 CIF
HKL
Paper
C28 H34 N2 O16 Sm2P 1 21/n 19.4469; 17.8037; 11.3621
90; 94.319; 90
1905.6Hao, Hongguo; Liu, Hongyan; Wang, Yuchen; Yuan, Suxian; Xu, Han; Zhang, Jingyue; Wang, Ying; Li, Dacheng; Sun, Junshan
A series of two-dimensional lanthanide coordination polymers: synthesis, structures, magnetism and selective luminescence detection for heavy metal ions and toxic solvents
Acta Crystallographica Section C, 2019, 75, 221-230
2021471 CIF
HKL
C20 H20 N O3 PP 1 21 111.3449; 7.3527; 11.8641
90; 113.623; 90
906.72Sabbaghi, Fahimeh; Pourayoubi, Mehrdad; Nečas, Marek; Damodaran, Krishnan
Two single-enantiomer amidophosphoesters: a database study on the chirality of (O)~2~P(O)(N)-based structures
Acta Crystallographica Section C, 2019, 75, 77-84
2021472 CIF
HKL
C20 H20 N O3 PP 1 21 111.3482; 7.3589; 11.8714
90; 113.686; 90
907.87Sabbaghi, Fahimeh; Pourayoubi, Mehrdad; Nečas, Marek; Damodaran, Krishnan
Two single-enantiomer amidophosphoesters: a database study on the chirality of (O)~2~P(O)(N)-based structures
Acta Crystallographica Section C, 2019, 75, 77-84
2021473 CIF
HKL
Paper
C25 H28 Cl2 N O3 TaP -18.33; 11.557; 12.426
84.484; 86.07; 86.04
1185.6Trávníček, Zdeněk; Štarha, Pavel; Čajan, Michal; Dvořák, Zdeněk
A half-sandwich TaV dichlorido complex containing an O,N,O′-tridentate Schiff base ligand: synthesis, crystal structure and in vitro cytotoxicity
Acta Crystallographica Section C Structural Chemistry, 2019, 75
2021474 CIF
HKL
Paper
C4 H6 N4 O4P 21 21 216.6562; 8.3692; 12.5687
90; 90; 90
700.17Jaćimović, Željko K.; Novaković, Sladjana B.; Bogdanović, Goran A.; Giester, Gerald; Kosović, Milica; Libowitzky, Eugen
First crystal structures of metal complexes with a 4-nitropyrazole-3-carboxylic acid ligand and the third crystal form of the ligand
Acta Crystallographica Section C, 2019, 75
2021475 CIF
HKL
Paper
C14 H20 Cu2 N8 O12P -15.0863; 8.811; 12.7192
83.977; 88.281; 82.743
562.25Jaćimović, Željko K.; Novaković, Sladjana B.; Bogdanović, Goran A.; Giester, Gerald; Kosović, Milica; Libowitzky, Eugen
First crystal structures of metal complexes with a 4-nitropyrazole-3-carboxylic acid ligand and the third crystal form of the ligand
Acta Crystallographica Section C, 2019, 75
2021476 CIF
HKL
Paper
C8 H18 Co2 N6 O16P 1 21/c 18.9689; 6.4035; 16.4509
90; 102.93; 90
920.86Jaćimović, Željko K.; Novaković, Sladjana B.; Bogdanović, Goran A.; Giester, Gerald; Kosović, Milica; Libowitzky, Eugen
First crystal structures of metal complexes with a 4-nitropyrazole-3-carboxylic acid ligand and the third crystal form of the ligand
Acta Crystallographica Section C, 2019, 75
2021477 CIF
HKL
Paper
C22 H23 O4 PP b c a16.7332; 8.2012; 28.0902
90; 90; 90
3854.9Rádai, Zita; Kiss, Nóra Zsuzsa; Czugler, Mátyás; Karaghiosoff, Konstantin; Keglevich, György
The typical crystal structures of a few representative α-aryl-α-hydroxyphosphonates
Acta Crystallographica Section C, 2019, 75
2021478 CIF
HKL
Paper
C21 H20 Cl O4 PP 1 21 110.4239; 7.8757; 12.0461
90; 103.775; 90
960.49Rádai, Zita; Kiss, Nóra Zsuzsa; Czugler, Mátyás; Karaghiosoff, Konstantin; Keglevich, György
The typical crystal structures of a few representative α-aryl-α-hydroxyphosphonates
Acta Crystallographica Section C, 2019, 75
2021479 CIF
HKL
Paper
C21 H20 N O6 PP -110.0795; 13.853; 15.9354
111.11; 90.852; 106.326
1975.23Rádai, Zita; Kiss, Nóra Zsuzsa; Czugler, Mátyás; Karaghiosoff, Konstantin; Keglevich, György
The typical crystal structures of a few representative α-aryl-α-hydroxyphosphonates
Acta Crystallographica Section C, 2019, 75
2021480 CIF
HKL
Paper
C10 H14 N O6 PP -18.18; 8.4006; 9.9661
102.173; 94.897; 107.504
630.26Rádai, Zita; Kiss, Nóra Zsuzsa; Czugler, Mátyás; Karaghiosoff, Konstantin; Keglevich, György
The typical crystal structures of a few representative α-aryl-α-hydroxyphosphonates
Acta Crystallographica Section C, 2019, 75
2021481 CIF
HKL
Paper
C10 H15 O4 PP 1 21/c 18.478; 17.237; 8.1357
90; 106.484; 90
1140.05Rádai, Zita; Kiss, Nóra Zsuzsa; Czugler, Mátyás; Karaghiosoff, Konstantin; Keglevich, György
The typical crystal structures of a few representative α-aryl-α-hydroxyphosphonates
Acta Crystallographica Section C, 2019, 75
2021482 CIF
HKL
Paper
C11 H17 O6 PC 1 2/c 139.464; 8.5132; 8.0044
90; 100.62; 90
2643.1Rádai, Zita; Kiss, Nóra Zsuzsa; Czugler, Mátyás; Karaghiosoff, Konstantin; Keglevich, György
The typical crystal structures of a few representative α-aryl-α-hydroxyphosphonates
Acta Crystallographica Section C, 2019, 75
2021483 CIF
Paper
C9 H13 O4 PP 1 21/n 18.4039; 7.7007; 16.6012
90; 99.149; 90
1060.69Rádai, Zita; Kiss, Nóra Zsuzsa; Czugler, Mátyás; Karaghiosoff, Konstantin; Keglevich, György
The typical crystal structures of a few representative α-aryl-α-hydroxyphosphonates
Acta Crystallographica Section C, 2019, 75
2021484 CIF
HKL
Paper
C18 H17 F3 N2 O2P 1 21/c 115.0494; 14.2369; 7.9898
90; 99.025; 90
1690.68Clarkson, Guy J.; Farrán, M. Ángeles; Claramunt, Rosa M.; Alkorta, Ibon; Elguero, José
The structure of the anti-aging agent J147 used for treating Alzheimer's disease
Acta Crystallographica Section C, 2019, 75
2021485 CIF
HKL
Paper
C52 H38 Cl7 Mn N8P -111.3475; 14.2479; 16.4138
92.51; 99.529; 108.699
2465.63Lahanas, Nicole; Kucheryavy, Pavel; Lalancette, Roger A.; Lockard, Jenny V.
Crystallographic identification of a series of manganese porphyrin complexes with nitrogenous bases
Acta Crystallographica Section C, 2019, 75
2021486 CIF
HKL
Paper
C54 H50 Cl Mn N6P -110.5211; 11.9123; 12.6355
66.1342; 78.3107; 89.5778
1413.24Lahanas, Nicole; Kucheryavy, Pavel; Lalancette, Roger A.; Lockard, Jenny V.
Crystallographic identification of a series of manganese porphyrin complexes with nitrogenous bases
Acta Crystallographica Section C, 2019, 75
2021487 CIF
HKL
Paper
C59 H43 Cl Mn N7P -111.0499; 12.1051; 18.5362
90.177; 90.324; 110.537
2321.76Lahanas, Nicole; Kucheryavy, Pavel; Lalancette, Roger A.; Lockard, Jenny V.
Crystallographic identification of a series of manganese porphyrin complexes with nitrogenous bases
Acta Crystallographica Section C, 2019, 75
2021488 CIF
HKL
Paper
C63 H60 Cl Mn N8 O0.25P -111.4402; 13.4019; 18.6407
95.774; 92.199; 113.63
2595.35Lahanas, Nicole; Kucheryavy, Pavel; Lalancette, Roger A.; Lockard, Jenny V.
Crystallographic identification of a series of manganese porphyrin complexes with nitrogenous bases
Acta Crystallographica Section C, 2019, 75
2021489 CIF
HKL
Paper
C7 H13 N O8P -14.9272; 8.6072; 12.1525
108.617; 97.37; 92.763
482.19Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021490 CIF
HKL
Paper
C7 H13 N O8P -14.9195; 8.5997; 12.0667
108.576; 97.152; 92.576
478.19Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021491 CIF
HKL
Paper
C7 H13 N O8P -14.9101; 8.5883; 11.9978
108.535; 96.969; 92.427
474.39Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021492 CIF
HKL
Paper
C7 H13 N O8P -14.9001; 8.5768; 11.9523
108.503; 96.781; 92.316
471.4Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021493 CIF
HKL
Paper
C7 H13 N O8P -14.8948; 8.5707; 11.9179
108.459; 96.649; 92.235
469.54Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021494 CIF
HKL
Paper
C7 H13 N O8P -14.901; 8.5623; 11.9502
108.338; 96.669; 92.426
471.13Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021495 CIF
HKL
Paper
C7 H13 N O8P -14.9089; 8.5742; 11.9896
108.411; 96.813; 92.501
473.67Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021496 CIF
HKL
Paper
C7 H13 N O8P -14.9142; 8.5934; 12.0281
108.563; 97.059; 92.493
476.02Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021497 CIF
HKL
Paper
C7 H13 N O8P -14.9248; 8.6012; 12.1074
108.584; 97.257; 92.666
480.17Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021498 CIF
HKL
Paper
C7 H13 N O8P -14.9271; 8.6022; 12.1449
108.606; 97.351; 92.714
481.7Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021499 CIF
HKL
Paper
C7 H13 N O8P 1 21/c 14.8902; 9.443; 21.7426
90; 103.096; 90
977.92Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021500 CIF
HKL
Paper
C7 H13 N O8P 1 21/c 14.8745; 9.4321; 21.7086
90; 102.948; 90
972.71Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021501 CIF
HKL
Paper
C7 H13 N O8P 1 21/c 14.8594; 9.4225; 21.7038
90; 103.092; 90
967.94Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021502 CIF
HKL
Paper
C7 H13 N O8P 1 21/c 14.8426; 9.4084; 21.6903
90; 103.248; 90
961.93Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021503 CIF
HKL
Paper
C7 H13 N O8P 1 21/c 14.8333; 9.4082; 21.6923
90; 103.401; 90
959.55Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021504 CIF
HKL
Paper
C7 H13 N O8P 1 21/c 14.8491; 9.4313; 21.7481
90; 103.272; 90
968.05Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021505 CIF
HKL
Paper
C7 H13 N O8P 1 21/c 14.8531; 9.4182; 21.7022
90; 103.155; 90
965.92Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021506 CIF
HKL
Paper
C7 H13 N O8P 1 21/c 14.8784; 9.4546; 21.7693
90; 103.002; 90
978.33Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021507 CIF
HKL
Paper
C7 H13 N O8P 1 21/c 14.8828; 9.4372; 21.7258
90; 103.007; 90
975.44Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021508 CIF
HKL
Paper
C7 H13 N O8P 1 21/c 14.8873; 9.4416; 21.7392
90; 103.063; 90
977.17Losev, Evgeniy A.; Boldyreva, Elena
Concomitant cocrystal and salt: no interconversion in the solid state
Acta Crystallographica Section C, 2019, 75
2021509 CIF
Paper
C20 H15 Cl2 Li N2 O3P -17.056; 10.226; 13.451
87.21; 86.978; 76.42
941.4Shah, Syed Raza; Shah, Zarbad; Ullah, Najeeb; Hussain, Javid; Al-Harrasi, Rashid; Khan, Ajmal; Rawson, Jeremy M.; Al-Harrasi, Ahmed; Anwar, Muhammad U.
Crystal structure, shape analysis and bioactivity of new Li^I^, Na^I^ and Mg^II^ complexes with 1,10-phenanthroline and 2-(3,4-dichlorophenyl)acetic acid
Acta Crystallographica Section C, 2019, 75
2021510 CIF
Paper
C40 H30 Cl4 N4 Na2 O6P -16.9518; 10.8369; 13.5077
82.823; 83.7; 71.92
957.1Shah, Syed Raza; Shah, Zarbad; Ullah, Najeeb; Hussain, Javid; Al-Harrasi, Rashid; Khan, Ajmal; Rawson, Jeremy M.; Al-Harrasi, Ahmed; Anwar, Muhammad U.
Crystal structure, shape analysis and bioactivity of new Li^I^, Na^I^ and Mg^II^ complexes with 1,10-phenanthroline and 2-(3,4-dichlorophenyl)acetic acid
Acta Crystallographica Section C, 2019, 75
2021511 CIF
Paper
C28 H24 Cl4 Mg N2 O7P 21 21 218.3889; 11.9459; 29.163
90; 90; 90
2922.5Shah, Syed Raza; Shah, Zarbad; Ullah, Najeeb; Hussain, Javid; Al-Harrasi, Rashid; Khan, Ajmal; Rawson, Jeremy M.; Al-Harrasi, Ahmed; Anwar, Muhammad U.
Crystal structure, shape analysis and bioactivity of new Li^I^, Na^I^ and Mg^II^ complexes with 1,10-phenanthroline and 2-(3,4-dichlorophenyl)acetic acid
Acta Crystallographica Section C, 2019, 75
2021512 CIF
HKL
Paper
C18 H18 N4 O4C 1 2/c 121.467; 7.675; 12.837
90; 125.362; 90
1724.8Powers, Kyle A.; Geiger, David K.
Hydrogen bonding in two benzene-1,2-diaminium pyridine-2-carboxylate salts and a cocrystal of benzene-1,2-diamine and benzoic acid
Acta Crystallographica Section C, 2019, 75
2021513 CIF
HKL
Paper
C20 H22 N4 O4C 1 2/c 121.451; 9.01; 12.585
90; 123.447; 90
2029.5Powers, Kyle A.; Geiger, David K.
Hydrogen bonding in two benzene-1,2-diaminium pyridine-2-carboxylate salts and a cocrystal of benzene-1,2-diamine and benzoic acid
Acta Crystallographica Section C, 2019, 75
2021514 CIF
HKL
Paper
C20 H20 N2 O4P b c n20.061; 7.8464; 11.6895
90; 90; 90
1840Powers, Kyle A.; Geiger, David K.
Hydrogen bonding in two benzene-1,2-diaminium pyridine-2-carboxylate salts and a cocrystal of benzene-1,2-diamine and benzoic acid
Acta Crystallographica Section C, 2019, 75
2021515 CIF
HKL
Paper
C12 H12 N6 O3P 1 21/c 15.9284; 13.6918; 16.0601
90; 96.721; 90
1294.65Oliveira, Ana P. A.; Ferreira, Isabella P.; Despaigne, Angel A. Recio; da Silva, Jeferson G.; Vieira, Ana Carolina S.; Santos, Mariana S.; Alexandre-Moreira, Magna S.; Diniz, Renata; Beraldo, Heloisa
Structural studies and antileishmanial activity of 2-acetylpyridine and 2-benzoylpyridine nitroimidazole-derived hydrazones
Acta Crystallographica Section C, 2019, 75
2021516 CIF
HKL
Paper
C12 H12 N6 O3I 1 2/a 112.189; 18.7185; 12.4701
90; 106.612; 90
2726.4Oliveira, Ana P. A.; Ferreira, Isabella P.; Despaigne, Angel A. Recio; da Silva, Jeferson G.; Vieira, Ana Carolina S.; Santos, Mariana S.; Alexandre-Moreira, Magna S.; Diniz, Renata; Beraldo, Heloisa
Structural studies and antileishmanial activity of 2-acetylpyridine and 2-benzoylpyridine nitroimidazole-derived hydrazones
Acta Crystallographica Section C, 2019, 75
2021517 CIF
HKL
Paper
C17 H14 N6 O3P 1 21/c 113.1965; 14.0718; 8.9747
90; 92.596; 90
1664.88Oliveira, Ana P. A.; Ferreira, Isabella P.; Despaigne, Angel A. Recio; da Silva, Jeferson G.; Vieira, Ana Carolina S.; Santos, Mariana S.; Alexandre-Moreira, Magna S.; Diniz, Renata; Beraldo, Heloisa
Structural studies and antileishmanial activity of 2-acetylpyridine and 2-benzoylpyridine nitroimidazole-derived hydrazones
Acta Crystallographica Section C, 2019, 75
2021518 CIF
HKL
Paper
C17 H14 N6 O3P -15.8656; 10.3304; 13.7224
74.736; 88.725; 87.006
801.04Oliveira, Ana P. A.; Ferreira, Isabella P.; Despaigne, Angel A. Recio; da Silva, Jeferson G.; Vieira, Ana Carolina S.; Santos, Mariana S.; Alexandre-Moreira, Magna S.; Diniz, Renata; Beraldo, Heloisa
Structural studies and antileishmanial activity of 2-acetylpyridine and 2-benzoylpyridine nitroimidazole-derived hydrazones
Acta Crystallographica Section C, 2019, 75
2021519 CIF
HKL
Paper
C21 H24 Cl2 O3P 1 21/n 19.446; 19.783; 11.0766
90; 93.821; 90
2065.3Asgarova, Aytan R.; Khalilov, Ali N.; Brito, Ivan; Maharramov, Abel M.; Shikhaliyev, Namiq G.; Cisterna, Jonathan; Cárdenas, Alejandro; Gurbanov, Atash V.; Zubkov, Fedor I.; Mahmudov, Kamran T.
Hydrogen and halogen bonding in the haloetherification products in chalcone
Acta Crystallographica Section C, 2019, 75
2021520 CIF
HKL
Paper
C20 H22 Br2 O3P 1 21/n 19.6343; 19.5472; 10.9965
90; 91.584; 90
2070.11Asgarova, Aytan R.; Khalilov, Ali N.; Brito, Ivan; Maharramov, Abel M.; Shikhaliyev, Namiq G.; Cisterna, Jonathan; Cárdenas, Alejandro; Gurbanov, Atash V.; Zubkov, Fedor I.; Mahmudov, Kamran T.
Hydrogen and halogen bonding in the haloetherification products in chalcone
Acta Crystallographica Section C, 2019, 75
2021521 CIF
HKL
Paper
C21 H24 Br2 O3P 1 21/n 19.6342; 19.8082; 11.1545
90; 94.076; 90
2123.3Asgarova, Aytan R.; Khalilov, Ali N.; Brito, Ivan; Maharramov, Abel M.; Shikhaliyev, Namiq G.; Cisterna, Jonathan; Cárdenas, Alejandro; Gurbanov, Atash V.; Zubkov, Fedor I.; Mahmudov, Kamran T.
Hydrogen and halogen bonding in the haloetherification products in chalcone
Acta Crystallographica Section C, 2019, 75
2021522 CIF
HKL
Paper
C22 H28 N2 O4 Se2C 1 2/c 118.178; 9.3386; 28.9009
90; 99.44; 90
4839.7Raju, Saravanan; Butcher, Ray J.; Singh, Harkesh B.
Isolation and structure of an 18-membered macrocycle containing two diselenide linkages and its precursor
Acta Crystallographica Section C, 2019, 75
2021523 CIF
HKL
Paper
C36 H34 N4 O6 Se4P -19.4865; 9.741; 11.2789
101; 108.394; 105.264
910.42Raju, Saravanan; Butcher, Ray J.; Singh, Harkesh B.
Isolation and structure of an 18-membered macrocycle containing two diselenide linkages and its precursor
Acta Crystallographica Section C, 2019, 75
2021524 CIF
HKL
Paper
C5 H16 Br4 N P PbP 1 21 16.0127; 12.056; 9.962
90; 90.43; 90
722.1Cheng, Ling; Cao, Yingjie
A two-dimensional organic‒inorganic hybrid perovskite-type semiconductor: poly[(2-azaniumylethyl)trimethylphosphanium [tetra-μ-bromido-plumbate(II)]]
Acta Crystallographica Section C, 2019, 75
2021525 CIF
HKL
Paper
C10 H9 F N4 O SP -17.6599; 7.8079; 10.014
94.487; 108.668; 97.565
557.83Moreno-Fuquen, Rodolfo; Arango-Daraviña, Kevin; Becerra, Diana; Castillo, Juan-Carlos; Kennedy, Alan R.; Macías, Mario A.
Catalyst- and solvent-free synthesis of 2-fluoro-<i>N</i>-(3-methylsulfanyl-1<i>H</i>-1,2,4-triazol-5-yl)benzamide through a microwave-assisted Fries rearrangement: X-ray structural and theoretical studies
Acta Crystallographica Section C, 2019, 75
2021526 CIF
HKL
Paper
C10 H9 F N4 O SP 1 21/n 15.0509; 26.64; 8.0251
90; 94.12; 90
1077Moreno-Fuquen, Rodolfo; Arango-Daraviña, Kevin; Becerra, Diana; Castillo, Juan-Carlos; Kennedy, Alan R.; Macías, Mario A.
Catalyst- and solvent-free synthesis of 2-fluoro-<i>N</i>-(3-methylsulfanyl-1<i>H</i>-1,2,4-triazol-5-yl)benzamide through a microwave-assisted Fries rearrangement: X-ray structural and theoretical studies
Acta Crystallographica Section C, 2019, 75
2021527 CIF
HKL
Paper
C18 H12 Cd N8 O6P b c n27.1721; 9.7995; 16.3477
90; 90; 90
4353Liu, Jian-Jun; Li, Li-Zhi; Chen, Chun-Ping; Wei, Jin-Zhong; Cheng, Fei-Xiang
A fourfold interpenetrating cadmium(II) metal‒organic framework based on 2,4,6-tris(pyridin-4-yl)-1,3,5-triazine with reversible photochromic properties
Acta Crystallographica Section C, 2019, 75, 372-377
2021528 CIF
HKL
Paper
C142 H162 O22 P4 Rh2P 1 21/n 113.41; 15.5455; 31.157
90; 98.743; 90
6419.7Selent, Detlef; Spannenberg, Anke; Kubis, Christoph; Börner, Armin
A dinuclear phosphite rhodium(I) complex obtained by syngas treatment of a Rh/hydroxy phosphonite olefin hydroformylation precatalyst
Acta Crystallographica Section C, 2019, 75, 398-401
2021529 CIF
Paper
C18 H26 Br N2 O5 ReP -19.6321; 9.8793; 12.826
95.806; 108.52; 112.895
1030.2Schutte-Smith, Marietjie; Roodt, Andreas; Alberto, Roger; Twigge, Linette; Visser, Hendrik Gideon; Kirsten, Leo; Koen, Renier
Structures of rhenium(I) complexes with 3-hydroxyflavone and benzhydroxamic acid as <i>O</i>,<i>O</i>'-bidentate ligands and confirmation of π-stacking by solid-state NMR spectroscopy
Acta Crystallographica Section C, 2019, 75, 378-387
2021530 CIF
Paper
C33 H21 O10 ReP -110.5209; 11.9365; 12.4455
108.277; 102.745; 104.252
1361Schutte-Smith, Marietjie; Roodt, Andreas; Alberto, Roger; Twigge, Linette; Visser, Hendrik Gideon; Kirsten, Leo; Koen, Renier
Structures of rhenium(I) complexes with 3-hydroxyflavone and benzhydroxamic acid as <i>O</i>,<i>O</i>'-bidentate ligands and confirmation of π-stacking by solid-state NMR spectroscopy
Acta Crystallographica Section C, 2019, 75, 378-387
2021531 CIF
HKL
Paper
C15 H10 O3P 21 21 215.3502; 11.3531; 18.063
90; 90; 90
1097.2Schutte-Smith, Marietjie; Roodt, Andreas; Alberto, Roger; Twigge, Linette; Visser, Hendrik Gideon; Kirsten, Leo; Koen, Renier
Structures of rhenium(I) complexes with 3-hydroxyflavone and benzhydroxamic acid as <i>O</i>,<i>O</i>'-bidentate ligands and confirmation of π-stacking by solid-state NMR spectroscopy
Acta Crystallographica Section C, 2019, 75, 378-387
2021532 CIF
HKL
Paper
C26 H49 Cl N2 O2P b c a8.898; 13.0356; 46.455
90; 90; 90
5388.4Dolgushin, Fedor M.; Goloveshkin, Alexander S.; Ananyev, Ivan V.; Osintseva, Svetlana V.; Torubaev, Yury V.; Krylov, Sergey S.; Golub, Alexandre S.
Interplay of noncovalent interactions in antiseptic quaternary ammonium surfactant Miramistin
Acta Crystallographica Section C, 2019, 75, 402-411
2021533 CIF
HKL
Paper
C58 H48 Cl8 Cu2 N4 O10P -110.5258; 11.9908; 13.0098
113.097; 90.217; 99.529
1485.26Hamamci Alisir, Sevim; Dege, Necmi; Tapramaz, Recep
Synthesis, crystal structures and characterizations of three new copper(II) complexes including anti-inflammatory diclofenac
Acta Crystallographica Section C, 2019, 75, 388-397
2021534 CIF
HKL
Paper
C38 H32 Cl4 Cu N6 O4P 1 21/c 115.1741; 7.9241; 16.3037
90; 98.073; 90
1940.95Hamamci Alisir, Sevim; Dege, Necmi; Tapramaz, Recep
Synthesis, crystal structures and characterizations of three new copper(II) complexes including anti-inflammatory diclofenac
Acta Crystallographica Section C, 2019, 75, 388-397
2021535 CIF
HKL
Paper
C34 H28 Cl4 Cu N6 O4P 1 21/c 17.6526; 7.5494; 31.071
90; 96.277; 90
1784.29Hamamci Alisir, Sevim; Dege, Necmi; Tapramaz, Recep
Synthesis, crystal structures and characterizations of three new copper(II) complexes including anti-inflammatory diclofenac
Acta Crystallographica Section C, 2019, 75, 388-397
2021538 CIF
HKL
Paper
C12 H13 N5 O4P -17.2329; 12.4405; 14.7468
82.507; 79.385; 86.828
1292.42Sedghiniya, Sima; Soleimannejad, Janet; Janczak, Jan
The salt‒cocrystal spectrum in salicylic acid‒adenine: the influence of crystal structure on proton-transfer balance
Acta Crystallographica Section C, 2019, 75, 412-421
2021539 CIF
HKL
Paper
C29 H31 N15 O8P 1 21/n 122.335; 4.8497; 31.567
90; 109.936; 90
3214.4Sedghiniya, Sima; Soleimannejad, Janet; Janczak, Jan
The salt‒cocrystal spectrum in salicylic acid‒adenine: the influence of crystal structure on proton-transfer balance
Acta Crystallographica Section C, 2019, 75, 412-421
2021540 CIF
HKL
Paper
C30 H20 Dy N3 O7P -110.7276; 11.6173; 12.524
103.051; 110.504; 106.834
1302.7Bai, Chao; Liu, Bin; Hu, Huai-Ming; Li, Jin-Dian; Wang, Xiaofang; Xue, Ganglin
Structural investigation of one- and three-dimensional lanthanide(III) coordination polymers based on functionalized terpyridine carboxylate and aromatic dicarboxylate ligands
Acta Crystallographica Section C, 2019, 75, 422-432
2021541 CIF
HKL
Paper
C30 H20 Ho N3 O7P -110.7235; 11.6222; 12.515
102.97; 110.498; 106.944
1301.5Bai, Chao; Liu, Bin; Hu, Huai-Ming; Li, Jin-Dian; Wang, Xiaofang; Xue, Ganglin
Structural investigation of one- and three-dimensional lanthanide(III) coordination polymers based on functionalized terpyridine carboxylate and aromatic dicarboxylate ligands
Acta Crystallographica Section C, 2019, 75, 422-432
2021542 CIF
HKL
Paper
C30 H20 Er N3 O7P -110.7193; 11.6076; 12.511
102.958; 110.528; 106.984
1298.2Bai, Chao; Liu, Bin; Hu, Huai-Ming; Li, Jin-Dian; Wang, Xiaofang; Xue, Ganglin
Structural investigation of one- and three-dimensional lanthanide(III) coordination polymers based on functionalized terpyridine carboxylate and aromatic dicarboxylate ligands
Acta Crystallographica Section C, 2019, 75, 422-432
2021543 CIF
HKL
Paper
C60 H36 Gd2 N6 O12P 1 21/n 110.6397; 21.2984; 11.1255
90; 97.14; 90
2501.6Bai, Chao; Liu, Bin; Hu, Huai-Ming; Li, Jin-Dian; Wang, Xiaofang; Xue, Ganglin
Structural investigation of one- and three-dimensional lanthanide(III) coordination polymers based on functionalized terpyridine carboxylate and aromatic dicarboxylate ligands
Acta Crystallographica Section C, 2019, 75, 422-432
2021544 CIF
HKL
Paper
C60 H36 Ho2 N6 O12P 1 21/n 110.5699; 21.2378; 11.0639
90; 96.664; 90
2466.9Bai, Chao; Liu, Bin; Hu, Huai-Ming; Li, Jin-Dian; Wang, Xiaofang; Xue, Ganglin
Structural investigation of one- and three-dimensional lanthanide(III) coordination polymers based on functionalized terpyridine carboxylate and aromatic dicarboxylate ligands
Acta Crystallographica Section C, 2019, 75, 422-432
2021545 CIF
HKL
Paper
C60 H36 Er2 N6 O12P 1 21/n 110.5716; 21.2401; 11.0692
90; 96.583; 90
2469.1Bai, Chao; Liu, Bin; Hu, Huai-Ming; Li, Jin-Dian; Wang, Xiaofang; Xue, Ganglin
Structural investigation of one- and three-dimensional lanthanide(III) coordination polymers based on functionalized terpyridine carboxylate and aromatic dicarboxylate ligands
Acta Crystallographica Section C, 2019, 75, 422-432
2021546 CIF
HKL
Paper
C30 H18 Dy N3 O6C 1 2/c 124.95; 10.1942; 20.145
90; 96.748; 90
5088.3Bai, Chao; Liu, Bin; Hu, Huai-Ming; Li, Jin-Dian; Wang, Xiaofang; Xue, Ganglin
Structural investigation of one- and three-dimensional lanthanide(III) coordination polymers based on functionalized terpyridine carboxylate and aromatic dicarboxylate ligands
Acta Crystallographica Section C, 2019, 75, 422-432
2021547 CIF
HKL
Paper
C30 H18 Ho N3 O6C 1 2/c 124.914; 10.208; 20.132
90; 96.64; 90
5085.7Bai, Chao; Liu, Bin; Hu, Huai-Ming; Li, Jin-Dian; Wang, Xiaofang; Xue, Ganglin
Structural investigation of one- and three-dimensional lanthanide(III) coordination polymers based on functionalized terpyridine carboxylate and aromatic dicarboxylate ligands
Acta Crystallographica Section C, 2019, 75, 422-432
2021548 CIF
HKL
Paper
C30 H18 Er N3 O6C 1 2/c 124.8569; 10.2084; 20.1195
90; 96.467; 90
5072.8Bai, Chao; Liu, Bin; Hu, Huai-Ming; Li, Jin-Dian; Wang, Xiaofang; Xue, Ganglin
Structural investigation of one- and three-dimensional lanthanide(III) coordination polymers based on functionalized terpyridine carboxylate and aromatic dicarboxylate ligands
Acta Crystallographica Section C, 2019, 75, 422-432
2021549 CIF
HKL
Paper
C30 H18 N3 O6 YbC 1 2/c 124.689; 10.2783; 20.0241
90; 96.362; 90
5050Bai, Chao; Liu, Bin; Hu, Huai-Ming; Li, Jin-Dian; Wang, Xiaofang; Xue, Ganglin
Structural investigation of one- and three-dimensional lanthanide(III) coordination polymers based on functionalized terpyridine carboxylate and aromatic dicarboxylate ligands
Acta Crystallographica Section C, 2019, 75, 422-432
2021550 CIF
HKL
Paper
C62 H66 Co2 N10 O12P 1 21/c 112.4355; 21.6501; 11.9462
90; 115.364; 90
2906.24Vráblová, Anna; Černák, Juraj; Falvello, Larry R.; Tomás, Milagros
Polymorphism of the dinuclear Co^III^‒Schiff base complex [Co~2~(<i>o</i>-van-en)~3~]·4CH~3~CN (<i>o</i>-van-en is a salen-type ligand)
Acta Crystallographica Section C, 2019, 75, 433-442
2021551 CIF
HKL
Paper
C62 H66 Co2 N10 O12P -110.4971; 11.6195; 13.7158
70.471; 71.667; 72.466
1460.26Vráblová, Anna; Černák, Juraj; Falvello, Larry R.; Tomás, Milagros
Polymorphism of the dinuclear Co^III^‒Schiff base complex [Co~2~(<i>o</i>-van-en)~3~]·4CH~3~CN (<i>o</i>-van-en is a salen-type ligand)
Acta Crystallographica Section C, 2019, 75, 433-442
2021552 CIF
HKL
Paper
C28 H38 Cu N12 O10 S4P 1 21/c 19.1819; 18.0782; 11.7932
90; 102.977; 90
1907.58Zhu, Guiying; Lu, Yang; Jin, Guoxia; Ji, Xuan; Ma, Jianping
The effect of the coordination orientation of N atoms on polymeric structures: synthesis and characterization of one- and two-dimensional Cu^II^ coordination polymers based on 4-amino-3-(pyridin-2-yl)-5-[(pyridin-3-ylmethyl)sulfanyl]-1,2,4-triazole
Acta Crystallographica Section C, 2019, 75, 443-450
2021553 CIF
HKL
Paper
C26 H26 Cl2 Cu N12 O9 S2P 1 21/n 19.6589; 23.1463; 15.5643
90; 104.305; 90
3371.79Zhu, Guiying; Lu, Yang; Jin, Guoxia; Ji, Xuan; Ma, Jianping
The effect of the coordination orientation of N atoms on polymeric structures: synthesis and characterization of one- and two-dimensional Cu^II^ coordination polymers based on 4-amino-3-(pyridin-2-yl)-5-[(pyridin-3-ylmethyl)sulfanyl]-1,2,4-triazole
Acta Crystallographica Section C, 2019, 75, 443-450
2021554 CIF
HKL
Paper
C28 H32 Cu N14 O8 S2P -19.5651; 12.6688; 15.2716
85.727; 80.36; 76.734
1774.51Zhu, Guiying; Lu, Yang; Jin, Guoxia; Ji, Xuan; Ma, Jianping
The effect of the coordination orientation of N atoms on polymeric structures: synthesis and characterization of one- and two-dimensional Cu^II^ coordination polymers based on 4-amino-3-(pyridin-2-yl)-5-[(pyridin-3-ylmethyl)sulfanyl]-1,2,4-triazole
Acta Crystallographica Section C, 2019, 75, 443-450
2021555 CIF
HKL
Paper
C18 H14 F2 N O3 PP 1 21/c 110.2037; 9.1372; 17.9981
90; 92.26; 90
1676.72Hasija, Avantika; Chopra, Deepak
Exploring concomitant/conformational dimorphism in a difluoro-substituted phosphoramidate derivative
Acta Crystallographica Section C, 2019, 75, 451-461
2021556 CIF
HKL
Paper
C18 H14 F2 N O3 PP c a 2135.0582; 7.2554; 13.3647
90; 90; 90
3399.46Hasija, Avantika; Chopra, Deepak
Exploring concomitant/conformational dimorphism in a difluoro-substituted phosphoramidate derivative
Acta Crystallographica Section C, 2019, 75, 451-461
2021557 CIF
HKL
Paper
C64 H58 Au Cl N4 O4C 1 2/c 124.368; 14.7921; 33.349
90; 103.63; 90
11682Selvakumar, Jayaraman; Miles, Meredith H.; Grossie, David A.; Arumugam, Kuppuswamy
Synthesis and molecular structure of biologically significant bis(1,3-dimesityl-4,5-naphthoquinoimidazol-2-ylidene)gold(I) complexes with chloride and dichloridoaurate counter-ions
Acta Crystallographica Section C, 2019, 75, 462-468
2021558 CIF
HKL
Paper
C60 H56 Au2 Cl6 N4 O4P -111.9236; 15.1244; 18.4014
100.46; 105.164; 103.994
2999.8Selvakumar, Jayaraman; Miles, Meredith H.; Grossie, David A.; Arumugam, Kuppuswamy
Synthesis and molecular structure of biologically significant bis(1,3-dimesityl-4,5-naphthoquinoimidazol-2-ylidene)gold(I) complexes with chloride and dichloridoaurate counter-ions
Acta Crystallographica Section C, 2019, 75, 462-468
2021559 CIF
HKL
Paper
C8 H40 Co2 Mo8 N2 O48P 1 21/c 111.507; 12.853; 15.795
90; 110.602; 90
2186.7Tahmasebi, Morteza; Mirzaei, Masoud; Eshtiagh-Hosseini, Hossein; Mague, Joel T.; Bauzá, Antonio; Frontera, Antonio
An inorganic‒organic hybrid supramolecular framework based on the γ-[Mo~8~O~26~]^4{-^} cluster and cobalt complex of aspartic acid: X-ray structure and DFT study
Acta Crystallographica Section C, 2019, 75, 469-477
2021561 CIF
HKL
Paper
Al Na O8 P2 ZnP 1 21/c 19.5199; 8.67; 9.5471
90; 119.158; 90
688.14Yakubovich, Olga; Kiriukhina, Galina; Volkov, Anatoliy; Dimitrova, Olga
The rich crystal chemistry of the <i>AMM</i>'(PO~4~)~2~ morphotropic series: NaZnAl(PO~4~)~2~, the first Na representative with a new structure type
Acta Crystallographica Section C, 2019, 75, 514-522
2021562 CIF
HKL
Paper
C23 H24 Cu N6 O7P 1 21/n 115.7821; 16.2877; 19.1051
90; 104.457; 90
4755.5Bhat, Satish Shantaram; Shivalingegowda, Naveen; Revankar, Vidyanand Krishna; Kawade, Vitthal Ajinath; Butcher, Ray J.; Lokanath, Neratur Krishnappagowda
One-dimensional copper(II) coordination polymers based on 1,3-bis(pyridin-4-yl)propane and diimine ligands
Acta Crystallographica Section C, 2019, 75, 496-503
2021563 CIF
HKL
Paper
C25 H24 Cu N6 O7P 1 21/n 116.0181; 15.8775; 20.0316
90; 106.14; 90
4893.8Bhat, Satish Shantaram; Shivalingegowda, Naveen; Revankar, Vidyanand Krishna; Kawade, Vitthal Ajinath; Butcher, Ray J.; Lokanath, Neratur Krishnappagowda
One-dimensional copper(II) coordination polymers based on 1,3-bis(pyridin-4-yl)propane and diimine ligands
Acta Crystallographica Section C, 2019, 75, 496-503
2021564 CIF
HKL
Paper
C26 H23.52 N4 O7.76 ZnP 1 21/c 111.622; 12.346; 18.669
90; 92.13; 90
2677Chen, Hui-Ru
A fourfold interpenetrating diamond-like three-dimensional zinc(II) coordination polymer: synthesis, crystal structure and physical properties
Acta Crystallographica Section C, 2019, 75, 504-507
2021565 CIF
HKL
Paper
C80 H75 F36 N25 P6 Pd3P -117.8173; 18.0361; 18.0674
105.211; 93.579; 100.586
5469.7Daran, Jean-Claude; Gimeno, Nicolas; Gouygou, Maryse; Volkman, Jérôme
A triangular palladium(II) supramolecular coordination complex based on 1,4-bis(1<i>H</i>-imidazol-1-yl)benzene and (2,2'-bipyridyl)palladium(II) nitrate: synthesis and crystal structure
Acta Crystallographica Section C, 2019, 75
2021566 CIF
HKL
Paper
C20 H19 N3 O6P 1 21/n 113.5997; 9.0354; 16.5974
90; 108.646; 90
1932.42Santiago de Oliveira, Yara; Saraiva Costa, Wendell; Ferreira Borges, Poliana; Silmara Alves de Santana, Maria; Ayala, Alejandro Pedro
The design of novel metronidazole benzoate structures: exploring stoichiometric diversity
Acta Crystallographica Section C, 2019, 75
2021567 CIF
HKL
Paper
C23 H21 N3 O5P 1 21/c 18.5105; 22.387; 11.7752
90; 108.664; 90
2125.5Santiago de Oliveira, Yara; Saraiva Costa, Wendell; Ferreira Borges, Poliana; Silmara Alves de Santana, Maria; Ayala, Alejandro Pedro
The design of novel metronidazole benzoate structures: exploring stoichiometric diversity
Acta Crystallographica Section C, 2019, 75
2021568 CIF
HKL
Paper
C21 H21 N3 O7P -19.1309; 11.1274; 11.8538
107.365; 103.27; 110.091
1002.73Santiago de Oliveira, Yara; Saraiva Costa, Wendell; Ferreira Borges, Poliana; Silmara Alves de Santana, Maria; Ayala, Alejandro Pedro
The design of novel metronidazole benzoate structures: exploring stoichiometric diversity
Acta Crystallographica Section C, 2019, 75
2021569 CIF
HKL
Paper
C20 H17 N5 O10P 1 21/c 121.0988; 8.4322; 12.0341
90; 99.505; 90
2111.6Santiago de Oliveira, Yara; Saraiva Costa, Wendell; Ferreira Borges, Poliana; Silmara Alves de Santana, Maria; Ayala, Alejandro Pedro
The design of novel metronidazole benzoate structures: exploring stoichiometric diversity
Acta Crystallographica Section C, 2019, 75
2021570 CIF
HKL
Paper
C20 H20 N4 O6P -17.9316; 11.9585; 12.1978
76.362; 78.927; 79.583
1092.21Santiago de Oliveira, Yara; Saraiva Costa, Wendell; Ferreira Borges, Poliana; Silmara Alves de Santana, Maria; Ayala, Alejandro Pedro
The design of novel metronidazole benzoate structures: exploring stoichiometric diversity
Acta Crystallographica Section C, 2019, 75
2021571 CIF
HKL
Paper
C20 H19 N3 O7P 1 21/c 19.5055; 31.2239; 6.8578
90; 102.628; 90
1986.2Santiago de Oliveira, Yara; Saraiva Costa, Wendell; Ferreira Borges, Poliana; Silmara Alves de Santana, Maria; Ayala, Alejandro Pedro
The design of novel metronidazole benzoate structures: exploring stoichiometric diversity
Acta Crystallographica Section C, 2019, 75
2021572 CIF
HKL
Paper
C17 H17 N3 O8C 1 2/c 143.13; 5.7944; 15.2645
90; 109.6; 90
3593.8Santiago de Oliveira, Yara; Saraiva Costa, Wendell; Ferreira Borges, Poliana; Silmara Alves de Santana, Maria; Ayala, Alejandro Pedro
The design of novel metronidazole benzoate structures: exploring stoichiometric diversity
Acta Crystallographica Section C, 2019, 75
2021573 CIF
HKL
Paper
C21 H19 N3 O8P 1 21/c 18.83; 33.7182; 7.3199
90; 107.878; 90
2074.13Santiago de Oliveira, Yara; Saraiva Costa, Wendell; Ferreira Borges, Poliana; Silmara Alves de Santana, Maria; Ayala, Alejandro Pedro
The design of novel metronidazole benzoate structures: exploring stoichiometric diversity
Acta Crystallographica Section C, 2019, 75
2021574 CIF
HKL
Paper
C32 H32 N6 O10P b c a26.3241; 7.1612; 33.8433
90; 90; 90
6379.87Santiago de Oliveira, Yara; Saraiva Costa, Wendell; Ferreira Borges, Poliana; Silmara Alves de Santana, Maria; Ayala, Alejandro Pedro
The design of novel metronidazole benzoate structures: exploring stoichiometric diversity
Acta Crystallographica Section C, 2019, 75
2021575 CIF
HKL
Paper
C30 H30 N6 O12P 1 21/c 19.0358; 26.6419; 6.8796
90; 102.419; 90
1617.38Santiago de Oliveira, Yara; Saraiva Costa, Wendell; Ferreira Borges, Poliana; Silmara Alves de Santana, Maria; Ayala, Alejandro Pedro
The design of novel metronidazole benzoate structures: exploring stoichiometric diversity
Acta Crystallographica Section C, 2019, 75
2021576 CIF
HKL
Paper
C29 H28 N6 O12P b c n26.1542; 7.2708; 16.6719
90; 90; 90
3170.36Santiago de Oliveira, Yara; Saraiva Costa, Wendell; Ferreira Borges, Poliana; Silmara Alves de Santana, Maria; Ayala, Alejandro Pedro
The design of novel metronidazole benzoate structures: exploring stoichiometric diversity
Acta Crystallographica Section C, 2019, 75
2021577 CIF
HKL
Paper
C20 H19 N3 O8P 1 21/n 18.2443; 15.9009; 15.4526
90; 102.454; 90
1978.04Santiago de Oliveira, Yara; Saraiva Costa, Wendell; Ferreira Borges, Poliana; Silmara Alves de Santana, Maria; Ayala, Alejandro Pedro
The design of novel metronidazole benzoate structures: exploring stoichiometric diversity
Acta Crystallographica Section C, 2019, 75
2021578 CIF
HKL
Paper
C46 H45 N9 O16P 1 21/n 17.1481; 36.7892; 18.0584
90; 100.451; 90
4670.1Santiago de Oliveira, Yara; Saraiva Costa, Wendell; Ferreira Borges, Poliana; Silmara Alves de Santana, Maria; Ayala, Alejandro Pedro
The design of novel metronidazole benzoate structures: exploring stoichiometric diversity
Acta Crystallographica Section C, 2019, 75
2021579 CIF
HKL
Paper
C44 H28 Cd N6 O4P -15.01; 9.593; 17.3488
91.192; 96.049; 92.858
827.84Xu, Bin; Luo, Fuming; Tang, Guodong; Zhang, Jinfang
A 4'-(4-carboxyphenyl)-3,2':6',3''-terpyridine-based luminescent cadmium(II) coordination polymer for the detection of 2,4,6-trinitrophenol
Acta Crystallographica Section C, 2019, 75
2021580 CIF
Paper
C52 H52 Cl2 O8 Os2 P2P 1 21/c 118.5007; 18.5396; 14.809
90; 91.9976; 90
5076.33Wilson, Kylie M.; Swartout, John W.; Touchton, Henry A.; Lambert, Erica N.; Johnstone, James E.; Archambeau, Ashley K.; Marolf, David M.; Mikeska, Emily R.; Lynch, Vincent M.; Nesterov, Vladimir N.; Reinheimer, Eric W.; Powell, Gregory L.; Powell, Cynthia B.
Asymmetric diosmium sawhorse complexes
Acta Crystallographica Section C, 2019, 75, 529-537
2021581 CIF
HKL
Paper
C10 H6 O10 Os2P 1 21/n 17.6949; 14.3612; 13.8623
90; 105.202; 90
1478.29Wilson, Kylie M.; Swartout, John W.; Touchton, Henry A.; Lambert, Erica N.; Johnstone, James E.; Archambeau, Ashley K.; Marolf, David M.; Mikeska, Emily R.; Lynch, Vincent M.; Nesterov, Vladimir N.; Reinheimer, Eric W.; Powell, Gregory L.; Powell, Cynthia B.
Asymmetric diosmium sawhorse complexes
Acta Crystallographica Section C, 2019, 75, 529-537
2021582 CIF
HKL
Paper
C30 H27 O9 Os2 PP -110.452; 11.229; 13.045
82.813; 89.157; 89.457
1518.8Wilson, Kylie M.; Swartout, John W.; Touchton, Henry A.; Lambert, Erica N.; Johnstone, James E.; Archambeau, Ashley K.; Marolf, David M.; Mikeska, Emily R.; Lynch, Vincent M.; Nesterov, Vladimir N.; Reinheimer, Eric W.; Powell, Gregory L.; Powell, Cynthia B.
Asymmetric diosmium sawhorse complexes
Acta Crystallographica Section C, 2019, 75, 529-537
2021583 CIF
Paper
C62 H63 O8 Os2 P2P -112.81225; 14.8455; 16.6818
98.1785; 101.79; 113.385
2761.39Wilson, Kylie M.; Swartout, John W.; Touchton, Henry A.; Lambert, Erica N.; Johnstone, James E.; Archambeau, Ashley K.; Marolf, David M.; Mikeska, Emily R.; Lynch, Vincent M.; Nesterov, Vladimir N.; Reinheimer, Eric W.; Powell, Gregory L.; Powell, Cynthia B.
Asymmetric diosmium sawhorse complexes
Acta Crystallographica Section C, 2019, 75, 529-537
2021584 CIF
HKL
Paper
C12 H10 O10 Os2P b c a9.79942; 15.51827; 21.7339
90; 90; 90
3305.08Wilson, Kylie M.; Swartout, John W.; Touchton, Henry A.; Lambert, Erica N.; Johnstone, James E.; Archambeau, Ashley K.; Marolf, David M.; Mikeska, Emily R.; Lynch, Vincent M.; Nesterov, Vladimir N.; Reinheimer, Eric W.; Powell, Gregory L.; Powell, Cynthia B.
Asymmetric diosmium sawhorse complexes
Acta Crystallographica Section C, 2019, 75, 529-537
2021585 CIF
HKL
Paper
C32 H31 O9 Os2 PP -110.0952; 11.663; 13.7536
88.6185; 86.7627; 86.9563
1614.13Wilson, Kylie M.; Swartout, John W.; Touchton, Henry A.; Lambert, Erica N.; Johnstone, James E.; Archambeau, Ashley K.; Marolf, David M.; Mikeska, Emily R.; Lynch, Vincent M.; Nesterov, Vladimir N.; Reinheimer, Eric W.; Powell, Gregory L.; Powell, Cynthia B.
Asymmetric diosmium sawhorse complexes
Acta Crystallographica Section C, 2019, 75, 529-537
2021586 CIF
Paper
C53 H54 Cl2 O8 Os2 P2P 1 21/c 118.4968; 18.7369; 14.9214
90; 91.806; 90
5168.8Wilson, Kylie M.; Swartout, John W.; Touchton, Henry A.; Lambert, Erica N.; Johnstone, James E.; Archambeau, Ashley K.; Marolf, David M.; Mikeska, Emily R.; Lynch, Vincent M.; Nesterov, Vladimir N.; Reinheimer, Eric W.; Powell, Gregory L.; Powell, Cynthia B.
Asymmetric diosmium sawhorse complexes
Acta Crystallographica Section C, 2019, 75, 529-537
2021587 CIF
HKL
Paper
C48 H44 O8 Os2 P2P -110.7707; 10.8014; 20.379
104.393; 91.009; 98.993
2264.27Wilson, Kylie M.; Swartout, John W.; Touchton, Henry A.; Lambert, Erica N.; Johnstone, James E.; Archambeau, Ashley K.; Marolf, David M.; Mikeska, Emily R.; Lynch, Vincent M.; Nesterov, Vladimir N.; Reinheimer, Eric W.; Powell, Gregory L.; Powell, Cynthia B.
Asymmetric diosmium sawhorse complexes
Acta Crystallographica Section C, 2019, 75, 529-537
2021588 CIF
HKL
Paper
C27 H38 Cl N2 O5.5P 1 21 15.4874; 43.4767; 11.4892
90; 98.144; 90
2713.38Zhou, Xin-Bo; Zhu, Jian-Rong; Liu, Ji-Yong; Jin, Zhi-Ping; Tang, Fei-Yu; Hu, Xiu-Rong
Crystal structures and properties of two hydrated conglomerate forms of the heart-rate-lowering agent ivabradine hydrochloride
Acta Crystallographica Section C, 2019, 75, 545-553
2021589 CIF
HKL
Paper
C27 H45 Cl N2 O9P 21 21 218.6747; 18.2437; 38.6507
90; 90; 90
6116.8Zhou, Xin-Bo; Zhu, Jian-Rong; Liu, Ji-Yong; Jin, Zhi-Ping; Tang, Fei-Yu; Hu, Xiu-Rong
Crystal structures and properties of two hydrated conglomerate forms of the heart-rate-lowering agent ivabradine hydrochloride
Acta Crystallographica Section C, 2019, 75, 545-553
2021590 CIF
HKL
Paper
C20 H28 Cu N2 O5P 1 21/c 111.2427; 10.1287; 17.7683
90; 92.501; 90
2021.42Dimeska, Roza; Wikaira, Jan; Mockler, Garry M.; Butcher, Ray J.
The crystal and molecular structures of three copper-containing complexes and their activities in mimicking galactose oxidase
Acta Crystallographica Section C, 2019, 75, 538-544
2021591 CIF
HKL
Paper
C21 H26 Cu N2 O3P c a 2123.1862; 6.4178; 13.1598
90; 90; 90
1958.24Dimeska, Roza; Wikaira, Jan; Mockler, Garry M.; Butcher, Ray J.
The crystal and molecular structures of three copper-containing complexes and their activities in mimicking galactose oxidase
Acta Crystallographica Section C, 2019, 75, 538-544
2021592 CIF
HKL
Paper
C32 H41 Cl Cu2 N4 O8P b c a10.51085; 22.2419; 28.8403
90; 90; 90
6742.3Dimeska, Roza; Wikaira, Jan; Mockler, Garry M.; Butcher, Ray J.
The crystal and molecular structures of three copper-containing complexes and their activities in mimicking galactose oxidase
Acta Crystallographica Section C, 2019, 75, 538-544
2021593 CIF
HKL
Paper
Bi2 Fe Gd6P -6 2 m8.337; 8.337; 4.229
90; 90; 120
254.6Zhang, Jiliang; Kang, Yong-Mook; Shan, Guangcun; Bobev, Svilen
Structural analysis of Gd~6~FeBi~2~ from single-crystal X-ray diffraction methods and electronic structure calculations
Acta Crystallographica Section C, 2019, 75
2021594 CIF
HKL
Paper
C54 H42 Cd3 O24P -17.9134; 9.06; 18.63
95.21; 100.79; 107.14
1238.5Bai, Yuting; Han, Meirong; Wu, Enxi; Feng, Sisi; Zhu, Miaoli
Cadmium(II) three-dimensional coordination polymers constructed from 1,3,5-tris(4-carboxyphenoxy)benzene: synthesis, crystal structure, fluorescence and I~2~ sorption characterization
Acta Crystallographica Section C, 2019, 75, 575-583
2021595 CIF
HKL
Paper
C40 H32 Cd2 N4 O14C 1 2/c 125.853; 18.594; 17.168
90; 107.14; 90
7886Bai, Yuting; Han, Meirong; Wu, Enxi; Feng, Sisi; Zhu, Miaoli
Cadmium(II) three-dimensional coordination polymers constructed from 1,3,5-tris(4-carboxyphenoxy)benzene: synthesis, crystal structure, fluorescence and I~2~ sorption characterization
Acta Crystallographica Section C, 2019, 75, 575-583
2021596 CIF
HKL
Paper
C14 H21 N3 O3 SP -16.3506; 9.2241; 13.4984
79.091; 87.215; 85.815
773.87Fedorov, Alexey Yu.; Rychkov, Denis A.; Losev, Evgeniy A.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
Completing the picture of tolazamide polymorphism under extreme conditions: a low-temperature study
Acta Crystallographica Section C, 2019, 75, 598-608
2021597 CIF
HKL
Paper
C14 H21 N3 O3 SP -16.3453; 9.1929; 13.4917
79.103; 87.266; 85.857
770.32Fedorov, Alexey Yu.; Rychkov, Denis A.; Losev, Evgeniy A.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
Completing the picture of tolazamide polymorphism under extreme conditions: a low-temperature study
Acta Crystallographica Section C, 2019, 75, 598-608
2021598 CIF
HKL
Paper
C14 H21 N3 O3 SP -16.3346; 9.1641; 13.4642
79.222; 87.305; 85.936
765.44Fedorov, Alexey Yu.; Rychkov, Denis A.; Losev, Evgeniy A.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
Completing the picture of tolazamide polymorphism under extreme conditions: a low-temperature study
Acta Crystallographica Section C, 2019, 75, 598-608
2021599 CIF
HKL
Paper
C14 H21 N3 O3 SP -16.3186; 9.1502; 13.4244
79.314; 87.303; 85.948
760.33Fedorov, Alexey Yu.; Rychkov, Denis A.; Losev, Evgeniy A.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
Completing the picture of tolazamide polymorphism under extreme conditions: a low-temperature study
Acta Crystallographica Section C, 2019, 75, 598-608
2021600 CIF
HKL
Paper
C14 H21 N3 O3 SP -16.3064; 9.1298; 13.3984
79.397; 87.344; 85.986
755.96Fedorov, Alexey Yu.; Rychkov, Denis A.; Losev, Evgeniy A.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
Completing the picture of tolazamide polymorphism under extreme conditions: a low-temperature study
Acta Crystallographica Section C, 2019, 75, 598-608
2021601 CIF
HKL
Paper
C14 H21 N3 O3 SP -16.2891; 9.096; 13.3659
79.436; 87.381; 86.026
749.41Fedorov, Alexey Yu.; Rychkov, Denis A.; Losev, Evgeniy A.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
Completing the picture of tolazamide polymorphism under extreme conditions: a low-temperature study
Acta Crystallographica Section C, 2019, 75, 598-608
2021602 CIF
HKL
Paper
C14 H21 N3 O3 SP -16.2738; 9.0824; 13.3414
79.449; 87.415; 86.013
745.14Fedorov, Alexey Yu.; Rychkov, Denis A.; Losev, Evgeniy A.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
Completing the picture of tolazamide polymorphism under extreme conditions: a low-temperature study
Acta Crystallographica Section C, 2019, 75, 598-608
2021603 CIF
HKL
Paper
C14 H21 N3 O3 SP -16.2586; 9.0748; 13.3249
79.432; 87.442; 85.975
741.73Fedorov, Alexey Yu.; Rychkov, Denis A.; Losev, Evgeniy A.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
Completing the picture of tolazamide polymorphism under extreme conditions: a low-temperature study
Acta Crystallographica Section C, 2019, 75, 598-608
2021604 CIF
HKL
Paper
C14 H21 N3 O3 SP -16.2433; 9.0724; 13.3119
79.359; 87.461; 85.933
738.8Fedorov, Alexey Yu.; Rychkov, Denis A.; Losev, Evgeniy A.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
Completing the picture of tolazamide polymorphism under extreme conditions: a low-temperature study
Acta Crystallographica Section C, 2019, 75, 598-608
2021605 CIF
HKL
Paper
C14 H21 N3 O3 SP -16.4948; 9.052; 13.4605
82.467; 85.251; 85.836
780.3Fedorov, Alexey Yu.; Rychkov, Denis A.; Losev, Evgeniy A.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
Completing the picture of tolazamide polymorphism under extreme conditions: a low-temperature study
Acta Crystallographica Section C, 2019, 75, 598-608
2021606 CIF
HKL
Paper
C14 H21 N3 O3 SP -16.4468; 9.0141; 13.485
82.36; 85.368; 85.553
772.38Fedorov, Alexey Yu.; Rychkov, Denis A.; Losev, Evgeniy A.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
Completing the picture of tolazamide polymorphism under extreme conditions: a low-temperature study
Acta Crystallographica Section C, 2019, 75, 598-608
2021607 CIF
HKL
Paper
C14 H21 N3 O3 SP -16.3939; 8.9809; 13.5213
82.129; 85.602; 85.341
764.89Fedorov, Alexey Yu.; Rychkov, Denis A.; Losev, Evgeniy A.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
Completing the picture of tolazamide polymorphism under extreme conditions: a low-temperature study
Acta Crystallographica Section C, 2019, 75, 598-608
2021608 CIF
HKL
Paper
C14 H21 N3 O3 SP -16.3358; 8.9455; 13.5482
81.976; 85.919; 85.273
756.38Fedorov, Alexey Yu.; Rychkov, Denis A.; Losev, Evgeniy A.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
Completing the picture of tolazamide polymorphism under extreme conditions: a low-temperature study
Acta Crystallographica Section C, 2019, 75, 598-608
2021609 CIF
HKL
Paper
C14 H21 N3 O3 SP -16.3091; 8.927; 13.576
81.882; 86.073; 85.167
753Fedorov, Alexey Yu.; Rychkov, Denis A.; Losev, Evgeniy A.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
Completing the picture of tolazamide polymorphism under extreme conditions: a low-temperature study
Acta Crystallographica Section C, 2019, 75, 598-608
2021610 CIF
HKL
Paper
Cu Er S3 SrC m c m3.92672; 12.9632; 10.0974
90; 90; 90
513.987Ruseikina, Anna V.; Solovyov, Leonid A.; Grigoriev, Maksim V.; Andreev, Oleg V.
Crystal structure variations in the series SrLnCuS~3~ (Ln = La, Pr, Sm, Gd, Er and Lu)
Acta Crystallographica Section C, 2019, 75, 584-588
2021611 CIF
HKL
Paper
Cu Gd S3 SrP n m a10.3288; 3.96271; 12.9397
90; 90; 90
529.622Ruseikina, Anna V.; Solovyov, Leonid A.; Grigoriev, Maksim V.; Andreev, Oleg V.
Crystal structure variations in the series SrLnCuS~3~ (Ln = La, Pr, Sm, Gd, Er and Lu)
Acta Crystallographica Section C, 2019, 75, 584-588
2021612 CIF
HKL
Paper
Cu Lu S3 SrC m c m3.91105; 12.9504; 10.0206
90; 90; 90
507.54Ruseikina, Anna V.; Solovyov, Leonid A.; Grigoriev, Maksim V.; Andreev, Oleg V.
Crystal structure variations in the series SrLnCuS~3~ (Ln = La, Pr, Sm, Gd, Er and Lu)
Acta Crystallographica Section C, 2019, 75, 584-588
2021613 CIF
HKL
Paper
Cu S3 Sm SrP n m a10.4285; 3.9864; 12.9325
90; 90; 90
537.632Ruseikina, Anna V.; Solovyov, Leonid A.; Grigoriev, Maksim V.; Andreev, Oleg V.
Crystal structure variations in the series SrLnCuS~3~ (Ln = La, Pr, Sm, Gd, Er and Lu)
Acta Crystallographica Section C, 2019, 75, 584-588
2021614 CIF
HKL
Paper
C3 H6 Eu O11.34P 1 21/c 111.0764; 9.6272; 10.1113
90; 114.281; 90
982.84Alexander, Dinu; Thomas, Kukku; Joy, Monu; Biju, P. R.; Unnikrishnan, N. V.; Joseph, Cyriac
Structural and spectroscopic investigations on the quenching free luminescence of europium oxalate nanocrystals
Acta Crystallographica Section C, 2019, 75
2021617 CIF
Paper
C22 H44.62 Cl2 Cu0.69 N4 O8P 1 21/n 19.2244; 11.554; 12.8659
90; 97.722; 90
1358.8Moncol, Jan; Mazúr, Milan; Valko, Marian; Choi, Jong-Ha
Synthesis, structural characterization, EPR spectroscopy and Hirshfeld surface analysis of a novel Cu^2+^-doped 3,14-diethyl-2,13-diaza-6,17-diazoniatricyclo[16.4.0.0^7,12^]docosane bis(perchlorate)
Acta Crystallographica Section C, 2019, 75
2021618 CIF
HKL
Paper
C15 H28 O13P 657.8682; 7.8682; 52.555
90; 90; 120
2817.7Zhang, Wenhui; Wu, Qingquan; Oliver, Allen G.; Serianni, Anthony S.
Conformational analysis of the disaccharide methyl α-D-mannopyranosyl-(1→3)-2-O-acetyl-β-D-mannopyranoside monohydrate
Acta Crystallographica Section C Structural Chemistry, 2019, 75
2021619 CIF
Paper
C23 H31 Cl2 N3 O3 SP 21 21 2110.2769; 12.2445; 20.0804
90; 90; 90
2526.8Bimoussa, Abdoullah; Koumya, Yassine; Abouelfida, Abdesselam; Ait Itto, Moulay Youssef; Benyaich, Abdelaziz; Mentre, Olivier; Ketatni, El Mostafa; Auhmani, Aziz; Auhmani, Abdelwahed
Hemisynthesis, crystal structure and inhibitory effect of sesquiterpenic thiosemicarbazones and thiazolidin-4-ones on the corrosion behaviour of stainless steel in 1<i>M</i> H~2~SO~4~ solution
Acta Crystallographica Section C, 2019, 75
2021620 CIF
HKL
Paper
C22 H20 F N O3P 1 21/c 19.592; 13.4325; 14.2186
90; 103.29; 90
1782.93Acosta Quintero, Lina M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
A concise and efficient concurrent synthesis of 6,11-dihydrodibenzo[<i>b</i>,<i>e</i>]azepines and 5,6,11,12-tetrahydrodibenzo[<i>b</i>,<i>f</i>]azocines and their conversion to 4-oxo-8,13-dihydro-4<i>H</i>-benzo[5,6]azepino[3,2,1-<i>ij</i>]quinoline-5-carboxylates and <i>N</i>-acetyl-5,6,11,12-tetrahydrodibenzo[<i>b</i>,<i>f</i>]azocines: synthetic sequence, spectroscopic characterization and the structures of two products
Acta Crystallographica Section C, 2019, 75
2021621 CIF
HKL
Paper
C18 H18 Cl N OP 1 21/c 18.333; 20.8; 9.186
90; 107.857; 90
1515.5Acosta Quintero, Lina M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
A concise and efficient concurrent synthesis of 6,11-dihydrodibenzo[<i>b</i>,<i>e</i>]azepines and 5,6,11,12-tetrahydrodibenzo[<i>b</i>,<i>f</i>]azocines and their conversion to 4-oxo-8,13-dihydro-4<i>H</i>-benzo[5,6]azepino[3,2,1-<i>ij</i>]quinoline-5-carboxylates and <i>N</i>-acetyl-5,6,11,12-tetrahydrodibenzo[<i>b</i>,<i>f</i>]azocines: synthetic sequence, spectroscopic characterization and the structures of two products
Acta Crystallographica Section C, 2019, 75
2021622 CIF
HKL
Paper
C19 H17 Cd Cl N4 O5P -18.5888; 11.372; 11.66
64.87; 73.1; 80.71
985.6Li, Xiao-Fei; Cheng, Di; Meng, Xiang-Ru; Yang, Huai-Xia
Effects of two benzenedicarboxylic acids on the construction of Cd^II^ coordination polymers incorporating a flexible N-donor ligand
Acta Crystallographica Section C, 2019, 75
2021623 CIF
HKL
Paper
C19 H20 Cd N4 O7P -18.9624; 10.256; 13.07
96.13; 106.88; 113.57
1019.1Li, Xiao-Fei; Cheng, Di; Meng, Xiang-Ru; Yang, Huai-Xia
Effects of two benzenedicarboxylic acids on the construction of Cd^II^ coordination polymers incorporating a flexible N-donor ligand
Acta Crystallographica Section C, 2019, 75
2021624 CIF
HKL
Paper
C5 H14 Br2 N2 OP 21 21 217.7005; 9.2774; 12.6853
90; 90; 90
906.25Piontek, Mateusz; Morgenstern, Bernd; Steinbrück, Nils; Oberhausen, Bastian; Kickelbick, Guido; Hegetschweiler, Kaspar
HBr or not HBr? That is the question: crystal structure of 6-hydroxy-1,4-diazepane-1,4-diium dibromide redetermined
Acta Crystallographica Section C, 2019, 75
2021625 CIF
HKL
Paper
C29.5 H27.5 N2.5 Ni O9.5P -110.27; 11.9701; 12.5459
90.821; 91.089; 92.278
1540.6Mi, Xiuna; Sheng, Dafei; Wang, Suna; Lu, Jing; Yang, Lu; Zhou, Zhen
Killing two birds with one stone: 2D+2D→3D parallel stacking and 3D self-penetrating structures in one reaction and their crystal-to-crystal transformation
Acta Crystallographica Section C, 2019, 75
2021626 CIF
HKL
Paper
C74 H80 N8 Ni2 O24P 1 21/c 111.503; 16.4391; 20.5549
90; 101.816; 90
3804.5Mi, Xiuna; Sheng, Dafei; Wang, Suna; Lu, Jing; Yang, Lu; Zhou, Zhen
Killing two birds with one stone: 2D+2D→3D parallel stacking and 3D self-penetrating structures in one reaction and their crystal-to-crystal transformation
Acta Crystallographica Section C, 2019, 75
2021627 CIF
HKL
Paper
C11 H7 N S2P -113.1146; 14.8676; 22.4297
87.244; 80.719; 68.535
4016.5Alvarenga, Meiry E.; Valdo, Ana Karoline S. M.; Ribeiro, Leandro; Do Nascimento Neto, José Antonio; De Araujo, Debora P.; Da Silva, Cleiton Moreira; De Fátima, Ângelo; Martins, Felipe T.
Exploring the structural landscape of 2-(thiophen-2-yl)-1,3-benzothiazole: high-<i>Z</i>' packing polymorphism and cocrystallization with calix[4]tube
Acta Crystallographica Section C, 2019, 75
2021628 CIF
HKL
Paper
C11 H7 N S2P 1 21/n 113.0549; 15.6867; 20.0965
90; 100.315; 90
4049Alvarenga, Meiry E.; Valdo, Ana Karoline S. M.; Ribeiro, Leandro; Do Nascimento Neto, José Antonio; De Araujo, Debora P.; Da Silva, Cleiton Moreira; De Fátima, Ângelo; Martins, Felipe T.
Exploring the structural landscape of 2-(thiophen-2-yl)-1,3-benzothiazole: high-<i>Z</i>' packing polymorphism and cocrystallization with calix[4]tube
Acta Crystallographica Section C, 2019, 75
2021629 CIF
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C11 H7 N S2P -112.5339; 13.5178; 14.4107
117.741; 92.687; 106.548
2024.6Alvarenga, Meiry E.; Valdo, Ana Karoline S. M.; Ribeiro, Leandro; Do Nascimento Neto, José Antonio; De Araujo, Debora P.; Da Silva, Cleiton Moreira; De Fátima, Ângelo; Martins, Felipe T.
Exploring the structural landscape of 2-(thiophen-2-yl)-1,3-benzothiazole: high-<i>Z</i>' packing polymorphism and cocrystallization with calix[4]tube
Acta Crystallographica Section C, 2019, 75
2021630 CIF
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C87 H84 N Na3 O28 S4P 1 21/n 115.4853; 32.7646; 16.8635
90; 101.633; 90
8380.3Alvarenga, Meiry E.; Valdo, Ana Karoline S. M.; Ribeiro, Leandro; Do Nascimento Neto, José Antonio; De Araujo, Debora P.; Da Silva, Cleiton Moreira; De Fátima, Ângelo; Martins, Felipe T.
Exploring the structural landscape of 2-(thiophen-2-yl)-1,3-benzothiazole: high-<i>Z</i>' packing polymorphism and cocrystallization with calix[4]tube
Acta Crystallographica Section C, 2019, 75
2021631 CIF
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Paper
C21 H20 Cl N5C 1 c 112.901; 20.055; 8.7001
90; 123.161; 90
1884.4Acosta Quintero, Lina M.; Palma, Alirio; Choquesillo-Lazarte, Duane; Cobo, Justo; Glidewell, Christopher
Monoclinic and orthorhombic forms of (<i>RS</i>)-(<i>E</i>)-4-[2-(4-chlorobenzylidene)hydrazinyl]-6,11-dimethyl-6,11-dihydro-5<i>H</i>-benzo[<i>b</i>]pyrimido[5,4-<i>f</i>]azepine: synthesis, concomitant polymorphism and supramolecular assembly mediated by C—H···N, C—H···π(arene) and C—Cl···π(arene) interactions
Acta Crystallographica Section C, 2019, 75
2021632 CIF
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Paper
C21 H20 Cl N5P n a 218.8623; 14.4656; 14.2723
90; 90; 90
1829.69Acosta Quintero, Lina M.; Palma, Alirio; Choquesillo-Lazarte, Duane; Cobo, Justo; Glidewell, Christopher
Monoclinic and orthorhombic forms of (<i>RS</i>)-(<i>E</i>)-4-[2-(4-chlorobenzylidene)hydrazinyl]-6,11-dimethyl-6,11-dihydro-5<i>H</i>-benzo[<i>b</i>]pyrimido[5,4-<i>f</i>]azepine: synthesis, concomitant polymorphism and supramolecular assembly mediated by C—H···N, C—H···π(arene) and C—Cl···π(arene) interactions
Acta Crystallographica Section C, 2019, 75
2021633 CIF
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Paper
C17 H12 F2 OC 1 2/c 130.184; 5.8907; 7.7144
90; 98.04; 90
1358.2Ferreira, Lívia O. A.; Valdo, Ana Karoline S. M.; Nascimento Neto, José Antônio; Ribeiro, Leandro; da Silva, Jefferson R. D.; Queiroz Jr., Luiz H. K.; Perez, Caridad N.; Martins, Felipe T.
ss-NMR and single-crystal X-ray diffraction in the elucidation of a new polymorph of bischalcone (1<i>E</i>,4<i>E</i>)-1,5-bis(4-fluorophenyl)penta-1,4-dien-3-one
Acta Crystallographica Section C, 2019, 75
2021634 CIF
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Paper
C51 H37 Cl4 F6 Fe N5 O SbP -115.3886; 15.9246; 20.2111
97.8276; 105.173; 90.3499
4731.2Short, Melanie A.; Sommer, Roger D.; Falzone, Alec J.; Huang, Tao; Weare, Walter W.; Roizen, Jennifer L.
A five-coordinate iron(III) porphyrin complex including a neutral axial pyridine <i>N</i>-oxide ligand
Acta Crystallographica Section C, 2019, 75
2021635 CIF
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Paper
C20 H17 Cu N3 O9P 1 21/c 116.6652; 6.6975; 18.6763
90; 105.963; 90
2004.2Pinto, Camila B.; Dos Santos, Leonardo H. R.; Rodrigues, Bernardo L.
Understanding metal‒ligand interactions in coordination polymers using Hirshfeld surface analysis
Acta Crystallographica Section C, 2019, 75
2021636 CIF
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Paper
C72 H82 Co Eu2 N12 O42P -111.9021; 12.68; 14.867
98.597; 99.6; 102.882
2115.5Han, Lizhi; Jin, Longyi; Wang, Enbo; Su, Zhongmin
Synthesis and characterization of two isostructural 3<i>d</i>‒4<i>f</i> coordination compounds based on pyridine-2,6-dicarboxylic acid and 4,4'-bipyridine
Acta Crystallographica Section C, 2019, 75
2021637 CIF
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Paper
C72 H82 Co N12 O42 Tb2P -111.8977; 12.649; 14.8487
98.518; 99.901; 102.715
2106.78Han, Lizhi; Jin, Longyi; Wang, Enbo; Su, Zhongmin
Synthesis and characterization of two isostructural 3<i>d</i>‒4<i>f</i> coordination compounds based on pyridine-2,6-dicarboxylic acid and 4,4'-bipyridine
Acta Crystallographica Section C, 2019, 75
2021638 CIF
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Paper
La18 O57 W10P -6 2 c9.0318; 9.0318; 32.6499
90; 90; 120
2306.5Novikova, Nataliya E.; Sorokin, Timofei A.; Antipin, Alexander M.; Bolotina, Nadezhda B.; Alekseeva, Olga A.; Sorokina, Nataliya I.; Voronkova, Valentina I.
Characteristic features of polytypism in compounds with the La~18~W~10~O~57~-type structure
Acta Crystallographica Section C, 2019, 75
2021639 CIF
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Paper
La15 O48 W8.5P 3 2 19.0363; 9.0363; 27.3412
90; 90; 120
1933.43Novikova, Nataliya E.; Sorokin, Timofei A.; Antipin, Alexander M.; Bolotina, Nadezhda B.; Alekseeva, Olga A.; Sorokina, Nataliya I.; Voronkova, Valentina I.
Characteristic features of polytypism in compounds with the La~18~W~10~O~57~-type structure
Acta Crystallographica Section C, 2019, 75
2021640 CIF
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Paper
C7 H15 N3 OP 1 21/c 111.2687; 8.369; 8.9974
90; 95.724; 90
844.29Qiao, Liang; Chen, Xiao-Gang; Gao, Ji-Xing; Ai, Yong
Three new quinuclidine-based structures: second harmonic generation response for 1,2-bis(1-azoniabicyclo[2.2.2]octan-3-ylidene)hydrazine dichloride
Acta Crystallographica Section C, 2019, 75
2021641 CIF
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Paper
C14 H22 N4P c c n19.7143; 6.6047; 9.9924
90; 90; 90
1301.08Qiao, Liang; Chen, Xiao-Gang; Gao, Ji-Xing; Ai, Yong
Three new quinuclidine-based structures: second harmonic generation response for 1,2-bis(1-azoniabicyclo[2.2.2]octan-3-ylidene)hydrazine dichloride
Acta Crystallographica Section C, 2019, 75
2021642 CIF
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Paper
C14 H24 Cl2 N4P 1 c 16.1699; 12.5258; 10.657
90; 103.023; 90
802.42Qiao, Liang; Chen, Xiao-Gang; Gao, Ji-Xing; Ai, Yong
Three new quinuclidine-based structures: second harmonic generation response for 1,2-bis(1-azoniabicyclo[2.2.2]octan-3-ylidene)hydrazine dichloride
Acta Crystallographica Section C, 2019, 75
2021643 CIF
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Paper
C39 H40.41 Cl F6 N3 Ni O0.7 P3P -19.7632; 10.8846; 18.5771
99.687; 91.504; 93.472
1941.11Subramaniyan, Vasudevan; Kumar, Ashok; Govindaraj, Anbarasu; Mani, Ganesan
Crystal structure and DFT analyses of a pentacoordinated PCP pincer nickel(II) complex
Acta Crystallographica Section C, 2019, 75
2021644 CIF
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Paper
C39 H27 Cd N2 O5.5C 1 2/c 127.4361; 9.0861; 40.473
90; 108.581; 90
9563.5Ren, Xiu-Hui; Li, Gang-Yuan; Du, Hua; Ma, Jian-Ping; Geng, Yan; Dong, Yu-bin
Thermally activated delayed fluorescent (TADF) coordination polymer with the generation of singlet oxygen
Acta Crystallographica Section C, 2019, 75
2021645 CIF
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Paper
C39 H26 N2 O4P -112.6717; 13.0727; 13.9254
65.029; 75.294; 68.42
1931.2Ren, Xiu-Hui; Li, Gang-Yuan; Du, Hua; Ma, Jian-Ping; Geng, Yan; Dong, Yu-bin
Thermally activated delayed fluorescent (TADF) coordination polymer with the generation of singlet oxygen
Acta Crystallographica Section C, 2019, 75
2021646 CIF
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Paper
C17 H13 Cl N2 O2P -110.3034; 11.4856; 14.4725
81.013; 69.861; 69.99
1509.47Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Manju, Nagaraj; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher
Conversion of substituted 5-aryloxypyrazolecarbaldehydes into reduced 3,4'-bipyrazoles: synthesis and characterization, and the structures of four precursors and two products, and their supramolecular assembly in zero, one and two dimensions
Acta Crystallographica Section C, 2019, 75
2021647 CIF
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Paper
C17 H13 N3 O4P 1 21/c 114.1163; 11.7268; 9.3982
90; 94.259; 90
1551.47Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Manju, Nagaraj; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher
Conversion of substituted 5-aryloxypyrazolecarbaldehydes into reduced 3,4'-bipyrazoles: synthesis and characterization, and the structures of four precursors and two products, and their supramolecular assembly in zero, one and two dimensions
Acta Crystallographica Section C, 2019, 75
2021648 CIF
HKL
Paper
C21 H16 N2 O2P 1 21/n 17.7302; 17.255; 13.1989
90; 106.079; 90
1691.7Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Manju, Nagaraj; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher
Conversion of substituted 5-aryloxypyrazolecarbaldehydes into reduced 3,4'-bipyrazoles: synthesis and characterization, and the structures of four precursors and two products, and their supramolecular assembly in zero, one and two dimensions
Acta Crystallographica Section C, 2019, 75
2021649 CIF
HKL
Paper
C16 H19 N3 OP 1 21/n 18.9432; 16.0546; 10.1155
90; 97.777; 90
1439Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Manju, Nagaraj; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher
Conversion of substituted 5-aryloxypyrazolecarbaldehydes into reduced 3,4'-bipyrazoles: synthesis and characterization, and the structures of four precursors and two products, and their supramolecular assembly in zero, one and two dimensions
Acta Crystallographica Section C, 2019, 75
2021650 CIF
HKL
Paper
C27 H22 Cl N7 O2P -110.8804; 11.3363; 11.5737
97.294; 90.05; 117.84
1249.15Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Manju, Nagaraj; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher
Conversion of substituted 5-aryloxypyrazolecarbaldehydes into reduced 3,4'-bipyrazoles: synthesis and characterization, and the structures of four precursors and two products, and their supramolecular assembly in zero, one and two dimensions
Acta Crystallographica Section C, 2019, 75
2021651 CIF
HKL
Paper
C31 H25 N7 O2P -110.4911; 11.2048; 13.5943
105.323; 93.505; 117.46
1335.9Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Manju, Nagaraj; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher
Conversion of substituted 5-aryloxypyrazolecarbaldehydes into reduced 3,4'-bipyrazoles: synthesis and characterization, and the structures of four precursors and two products, and their supramolecular assembly in zero, one and two dimensions
Acta Crystallographica Section C, 2019, 75
2021652 CIF
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Paper
C16 H14 O3P 1 21 17.6172; 6.0317; 27.401
90; 90.533; 90
1258.9Rossi, Patrizia; Paoli, Paola; Ienco, Andrea; Biagi, Diletta; Valleri, Maurizio; Conti, Luca
A new crystal form of the NSAID dexketoprofen
Acta Crystallographica Section C, 2019, 75
2021653 CIF
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Paper
C17 H11 N3 O2P -16.8415; 10.8931; 20.163
74.965; 83.815; 72.183
1381Shishkina, Svitlana V.; Konovalova, Irina S.; Trostianko, Pavlo V.; Geleverya, Anna O.; Kovalenko, Sergiy M.; Bunyatyan, Natalya D.
Three polymorphs of 3-(3-phenyl-1<i>H</i>-1,2,4-triazol-5-yl)-2<i>H</i>-1-benzopyran-2-one formed from different solvents
Acta Crystallographica Section C, 2019, 75, 822-832
2021654 CIF
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Paper
C17 H11 N3 O2P 1 21 16.8355; 19.512; 10.881
90; 107.811; 90
1381.7Shishkina, Svitlana V.; Konovalova, Irina S.; Trostianko, Pavlo V.; Geleverya, Anna O.; Kovalenko, Sergiy M.; Bunyatyan, Natalya D.
Three polymorphs of 3-(3-phenyl-1<i>H</i>-1,2,4-triazol-5-yl)-2<i>H</i>-1-benzopyran-2-one formed from different solvents
Acta Crystallographica Section C, 2019, 75, 822-832
2021655 CIF
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Paper
C17 H11 N3 O2P b c a13.0369; 13.0804; 16.2223
90; 90; 90
2766.4Shishkina, Svitlana V.; Konovalova, Irina S.; Trostianko, Pavlo V.; Geleverya, Anna O.; Kovalenko, Sergiy M.; Bunyatyan, Natalya D.
Three polymorphs of 3-(3-phenyl-1<i>H</i>-1,2,4-triazol-5-yl)-2<i>H</i>-1-benzopyran-2-one formed from different solvents
Acta Crystallographica Section C, 2019, 75, 822-832
2021656 CIF
HKL
Paper
C54 H48 Cd Cl2 N12 O9.5P 43 21 215.9167; 15.9167; 21.5498
90; 90; 90
5459.5Wang, Jia; You, Tianchao; Wang, Teng; Liu, Qikui; Ma, Jianping; Jin, Guoxia
Adsorption behaviour of a CdII‒triazole MOF for butan-2-one in a single-crystal-to-single-crystal (SCSC) fashion: the role of hydrogen bonding and C—H...π interactions
Acta Crystallographica Section C Structural Chemistry, 2019, 75, 806
2021658 CIF
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Paper
C24 H23 Br3 N4 O5 ZnP 1 21/n 18.6877; 15.179; 20.9944
90; 93.6833; 90
2762.83Xu, Jie; Zhang, Kou-Lin
Preparation, characterization and luminescence-sensing properties of two ZnII MOFs with mixed 5-amino-2,4,6-tribromoisophthalic acid and bipyridyl-type ligands
Acta Crystallographica Section C Structural Chemistry, 2019, 75
2021659 CIF
HKL
Paper
C22 H22 Br3 N5 O9 ZnP 21 21 218.5083; 13.8444; 22.496
90; 90; 90
2649.9Xu, Jie; Zhang, Kou-Lin
Preparation, characterization and luminescence-sensing properties of two ZnII MOFs with mixed 5-amino-2,4,6-tribromoisophthalic acid and bipyridyl-type ligands
Acta Crystallographica Section C Structural Chemistry, 2019, 75
2021660 CIF
HKL
Paper
C42 H27 Cl2 Na Ni8 O15 S6P 63/m13.2027; 13.2027; 18.3116
90; 90; 120
2764.3Zhu, Jingyan; Yan, Shan; Xiao, Hongping; Jiang, Jun; Li, Xinhua
Nickel(II) cluster-based mixed-cation coordination polymer synthesized from 2-mercaptobenzoic acid and its application
Acta Crystallographica Section C, 2019, 75
2021661 CIF
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Paper
Eu5 K3 O24 P6C 1 2/c 117.495; 6.9483; 18.1452
90; 114.447; 90
2008Xue, Ya-Li; Zhang, Ai-Yun; Han, Xiao-Yang; Cui, Xiao-Qi; Deng, Ling; Zhou, Yi-Xiang; Yu, Ya-Ping; Zhao, Dan
K~3~Eu~5~(PO~4~)~6~: hydrothermal synthesis, crystal structure and photoluminescence properties
Acta Crystallographica Section C, 2019, 75
2021662 CIF
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Paper
C13 H10 N4 SP 1 21/c 128.6467; 5.6358; 15.1374
90; 103.896; 90
2372.36Castiñeiras, Alfonso; García-Santos, Isabel; Saa, Manuel
Design and synthesis of methyl 2-{[4-phenyl-5-(pyridin-2-yl)-4<i>H</i>-1,2,4-triazol-3-yl]sulfanyl}acetate (phpy2NS) as a ligand for complexes of Group 12 elements: structural assessment and hydrogen-bonded supramolecular assembly analysis
Acta Crystallographica Section C, 2019, 75
2021663 CIF
HKL
Paper
C16 H14 N4 O2 SP 1 21/c 15.5945; 18.9451; 14.2664
90; 90.247; 90
1512.06Castiñeiras, Alfonso; García-Santos, Isabel; Saa, Manuel
Design and synthesis of methyl 2-{[4-phenyl-5-(pyridin-2-yl)-4<i>H</i>-1,2,4-triazol-3-yl]sulfanyl}acetate (phpy2NS) as a ligand for complexes of Group 12 elements: structural assessment and hydrogen-bonded supramolecular assembly analysis
Acta Crystallographica Section C, 2019, 75
2021664 CIF
HKL
Paper
C34 H36 Br6 Cd2.24 N8 O6 S2 Zn0.76P 1 21/n 111.498; 13.7848; 15.0417
90; 93.466; 90
2379.71Castiñeiras, Alfonso; García-Santos, Isabel; Saa, Manuel
Design and synthesis of methyl 2-{[4-phenyl-5-(pyridin-2-yl)-4<i>H</i>-1,2,4-triazol-3-yl]sulfanyl}acetate (phpy2NS) as a ligand for complexes of Group 12 elements: structural assessment and hydrogen-bonded supramolecular assembly analysis
Acta Crystallographica Section C, 2019, 75
2021665 CIF
HKL
Paper
C16 H14 Cl2 Hg N4 O2 SP -18.5198; 9.4709; 13.9682
105.05; 95.083; 115.081
960.04Castiñeiras, Alfonso; García-Santos, Isabel; Saa, Manuel
Design and synthesis of methyl 2-{[4-phenyl-5-(pyridin-2-yl)-4<i>H</i>-1,2,4-triazol-3-yl]sulfanyl}acetate (phpy2NS) as a ligand for complexes of Group 12 elements: structural assessment and hydrogen-bonded supramolecular assembly analysis
Acta Crystallographica Section C, 2019, 75
2021666 CIF
HKL
Paper
C5 H6 O8 PbP -16.436; 7.9058; 8.3495
104.055; 90.956; 96.2
409.3Silverman, Joshua A.; Mathivathanan, Logesh; Govor, Evgen V.; Raptis, Raphael G.; Kavallieratos, Konstantinos
Coordination polymers of Cd^II^ and Pb^II^ with croconate show remarkable differences in coordination patterns: a structural and spectroscopic study
Acta Crystallographica Section C, 2019, 75
2021667 CIF
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Paper
C5 H6 Cd O8P 1 21/n 16.5123; 8.8174; 13.8763
90; 96.053; 90
792.36Silverman, Joshua A.; Mathivathanan, Logesh; Govor, Evgen V.; Raptis, Raphael G.; Kavallieratos, Konstantinos
Coordination polymers of Cd^II^ and Pb^II^ with croconate show remarkable differences in coordination patterns: a structural and spectroscopic study
Acta Crystallographica Section C, 2019, 75
2021668 CIF
HKL
Paper
C26 H24 Cu2 N16 O2P -17.8491; 7.8762; 12.3391
100.236; 94.225; 101.865
729.81Xie, Long-Yan; Zhang, Yu; Xu, Hao; Gong, Chang-Da; Du, Xiu-Li; Li, Yang; Wang, Meng; Qin, Jie
Synthesis, structure and bioactivity of Ni^2+^ and Cu^2+^ acylhydrazone complexes
Acta Crystallographica Section C, 2019, 75
2021669 CIF
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Paper
C26 H24 N10 Ni O2P b c n11.9385; 9.7023; 22.5975
90; 90; 90
2617.5Xie, Long-Yan; Zhang, Yu; Xu, Hao; Gong, Chang-Da; Du, Xiu-Li; Li, Yang; Wang, Meng; Qin, Jie
Synthesis, structure and bioactivity of Ni^2+^ and Cu^2+^ acylhydrazone complexes
Acta Crystallographica Section C, 2019, 75
2021670 CIF
HKL
Paper
C46 H46 N2 O4P -113.1586; 13.1881; 23.6681
84.996; 88.444; 67.5
3780.1Lee, Sunhee; Kwak, Soyoung; Lee, Keumhee; Kim, Byung Gi; Kim, Minseong; Wang, Dong Hwan; Han, Won-Sik
Tuning the energy level of TAPC: crystal structure and photophysical and electrochemical properties of 4,4'-(cyclohexane-1,1-diyl)bis[<i>N</i>,<i>N</i>-bis(4-methoxyphenyl)aniline]
Acta Crystallographica Section C, 2019, 75
2021671 CIF
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Paper
C12 H22 O11P 1 21 15.0044; 38.6364; 7.6007
90; 106.2; 90
1411.26Nicholls, Daniel; Elleman, Carole; Shankland, Norman; Shankland, Kenneth
A new crystalline form of αβ-<small>D</small>-lactose prepared by oven drying a concentrated aqueous solution of <small>D</small>-lactose
Acta Crystallographica Section C, 2019, 75
2021672 CIF
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Paper
C28 H45 Cl2 N5 PdP 1 21/c 110.1029; 15.9363; 19.3855
90; 100.64; 90
3067.5Karabıyık, Hande; Yiğit, Beyhan; Yiğit, Murat; Özdemir, İsmail; Karabıyık, Hasan
Enhanced π-back-donation resulting in the <i>trans</i> labilization of a pyridine ligand in an N-heterocyclic carbene (NHC) Pd^II^ precatalyst: a case study
Acta Crystallographica Section C, 2019, 75
2021673 CIF
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Paper
C23 H16 OP 1 21/c 15.723; 27.11; 10.984
90; 89.55; 90
1704Eugenia D. Voronova; Alexander A. Golovanov; Ivan S. Odin; Maksim A. Anisimov; Pavel V. Dorovatovskii; Yan V. Zubavichus; Anna V. Vologzhanina
Peculiarities of supramolecular organization of cyclic ketones with vinylacetylene fragments
Acta Crystallographica, Section C, 2018, 74, 1674-1683
2021674 CIF
HKL
Paper
C23 H14 Br2 OA e m 27.098; 42.72; 6.135
90; 90; 90
1860.3Eugenia D. Voronova; Alexander A. Golovanov; Ivan S. Odin; Maksim A. Anisimov; Pavel V. Dorovatovskii; Yan V. Zubavichus; Anna V. Vologzhanina
Peculiarities of supramolecular organization of cyclic ketones with vinylacetylene fragments
Acta Crystallographica, Section C, 2018, 74, 1674-1683
2021675 CIF
HKL
Paper
C24 H18 OP 1 21/c 15.498; 27.52; 13.885
90; 124.09; 90
1740Eugenia D. Voronova; Alexander A. Golovanov; Ivan S. Odin; Maksim A. Anisimov; Pavel V. Dorovatovskii; Yan V. Zubavichus; Anna V. Vologzhanina
Peculiarities of supramolecular organization of cyclic ketones with vinylacetylene fragments
Acta Crystallographica, Section C, 2018, 74, 1674-1683
2021676 CIF
HKL
Paper
C24 H16 Br2 OP c a 2112.006; 5.2243; 31.998
90; 90; 90
2007Eugenia D. Voronova; Alexander A. Golovanov; Ivan S. Odin; Maksim A. Anisimov; Pavel V. Dorovatovskii; Yan V. Zubavichus; Anna V. Vologzhanina
Peculiarities of supramolecular organization of cyclic ketones with vinylacetylene fragments
Acta Crystallographica, Section C, 2018, 74, 1674-1683
2021677 CIF
HKL
Paper
C28 H25 OP 1 21/n 112.9422; 6.9614; 24.721
90; 97.732; 90
2207Eugenia D. Voronova; Alexander A. Golovanov; Ivan S. Odin; Maksim A. Anisimov; Pavel V. Dorovatovskii; Yan V. Zubavichus; Anna V. Vologzhanina
Peculiarities of supramolecular organization of cyclic ketones with vinylacetylene fragments
Acta Crystallographica, Section C, 2018, 74, 1674-1683
2021678 CIF
HKL
Paper
C30 H30 OC 1 c 16.401; 21.35; 18.19
90; 94.83; 90
2477Eugenia D. Voronova; Alexander A. Golovanov; Ivan S. Odin; Maksim A. Anisimov; Pavel V. Dorovatovskii; Yan V. Zubavichus; Anna V. Vologzhanina
Peculiarities of supramolecular organization of cyclic ketones with vinylacetylene fragments
Acta Crystallographica, Section C, 2018, 74, 1674-1683
2021679 CIF
HKL
Paper
C20 H16 O2P c a 219.5892; 10.145; 30.08
90; 90; 90
2926.3Eugenia D. Voronova; Alexander A. Golovanov; Ivan S. Odin; Maksim A. Anisimov; Pavel V. Dorovatovskii; Yan V. Zubavichus; Anna V. Vologzhanina
Peculiarities of supramolecular organization of cyclic ketones with vinylacetylene fragments
Acta Crystallographica, Section C, 2018, 74, 1674-1683
2021680 CIF
HKL
Paper
C18 H20 O2P -19.2801; 9.5498; 9.6407
84.218; 70.882; 66.632
740.63Eugenia D. Voronova; Alexander A. Golovanov; Ivan S. Odin; Maksim A. Anisimov; Pavel V. Dorovatovskii; Yan V. Zubavichus; Anna V. Vologzhanina
Peculiarities of supramolecular organization of cyclic ketones with vinylacetylene fragments
Acta Crystallographica, Section C, 2018, 74, 1674-1683
2021681 CIF
HKL
Paper
C10 H18 Cl3 Cu N3 O2P 1 21/n 17.1296; 6.9197; 30.0061
90; 91.066; 90
1480.09Mardani, Zahra; Hakimi, Mohammad; Moeini, Keyvan; Mohr, Fabian
Reaction of 2-[(2-aminoethyl)amino]ethanol with pyridine-2-carbaldehyde and complexation of the products with Cu^II^ and Cd^II^ along with docking studies
Acta Crystallographica Section C, 2019, 75
2021682 CIF
HKL
Paper
C16 H18 Cd Cl2 N4 OP 1 21/c 114.0924; 7.7111; 15.5819
90; 90.317; 90
1693.23Mardani, Zahra; Hakimi, Mohammad; Moeini, Keyvan; Mohr, Fabian
Reaction of 2-[(2-aminoethyl)amino]ethanol with pyridine-2-carbaldehyde and complexation of the products with Cu^II^ and Cd^II^ along with docking studies
Acta Crystallographica Section C, 2019, 75
2021683 CIF
HKL
Paper
C22 H18 Ag Au N8P -4 n 216.535; 16.535; 18.1127
90; 90; 90
4952.1Hsu, Wayne
Luminescence properties and optimized structural conformations of the S~0~, S~1~ and T~1~ states of a tetranuclear formamidinate complex based on Au^I^ and Ag^I^ metal ions
Acta Crystallographica Section C, 2019, 75
2021684 CIF
Paper
C34 H26 N4 O7 S ZnP 1 21/n 111.502; 20.059; 13.735
90; 101.716; 90
3103Pan, Chen-Dong; Wang, Jun; Xu, Ju-Qin; Zhang, Kang-Feng; Wang, Xiao-Wan
A threefold interpenetrating two-dimensional zinc(II) coordination polymer: synthesis, crystal structure and selective luminescence sensing properties
Acta Crystallographica Section C, 2019, 75
2021685 CIF
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Paper
C24 H16 Co N2 O5P 1 21/c 19.506; 22.483; 10.684
90; 111.37; 90
2126.4Lan, Wenlong; Zhou, Zhen; Jia, Fu-Chao; Hao, Xiaoyun; Dou, Yong; Yang, Lu; Liu, Hui; Liu, Qingyun; Zhang, Daopeng
A new three-dimensional cobalt(II) coordination polymer based on V-shaped 3,4'-oxydibenzoate: synthesis, crystal structure and magnetic properties
Acta Crystallographica Section C, 2019, 75
2021686 CIF
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Paper
C24 H26 N4 OP b c n19.0555; 12.384; 17.8388
90; 90; 90
4209.7Böhme, Uwe; Schwarzer, Anke; Günther, Betty
The heteroscorpionate ligand 2,2-bis(3,5-dimethylpyrazol-1-yl)-1,1-diphenylethanol and an easy preparation of its tungsten complex
Acta Crystallographica Section C, 2019, 75
2021687 CIF
Paper
C28 H33 Cl N4 O4 WP 1 c 19.3157; 8.4063; 17.4678
90; 93.222; 90
1365.75Böhme, Uwe; Schwarzer, Anke; Günther, Betty
The heteroscorpionate ligand 2,2-bis(3,5-dimethylpyrazol-1-yl)-1,1-diphenylethanol and an easy preparation of its tungsten complex
Acta Crystallographica Section C, 2019, 75
2021688 CIF
Paper
C21 H16 Co2 N6 O7P 1 21/n 111.06; 17.1537; 11.7342
90; 95.499; 90
2215.97Zhang, Ya-Qian; Blatov, Vladislav A.; Lv, Xiu-Xiu; Tang, Ding-Yi; Qian, Lin-Lu; Li, Ke; Li, Bao-Long
Construction of (3,8)-connected three-dimensional cobalt(II) and copper(II) coordination polymers with 1,3-bis[(1,2,4-triazol-4-yl)methyl]benzene and benzene-1,3,5-tricarboxylate ligands
Acta Crystallographica Section C, 2019, 75
2021689 CIF
Paper
C42 H38 Cu4 N12 O17P -110.9425; 11.458; 11.6193
89.524; 69.945; 64.669
1220.4Zhang, Ya-Qian; Blatov, Vladislav A.; Lv, Xiu-Xiu; Tang, Ding-Yi; Qian, Lin-Lu; Li, Ke; Li, Bao-Long
Construction of (3,8)-connected three-dimensional cobalt(II) and copper(II) coordination polymers with 1,3-bis[(1,2,4-triazol-4-yl)methyl]benzene and benzene-1,3,5-tricarboxylate ligands
Acta Crystallographica Section C, 2019, 75
2021690 CIF
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Paper
C78 H91 Cd3 N42 O3.5 S6C 1 2/c 124.1578; 16.1342; 24.0155
90; 90.4848; 90
9360.1Wang, Xia; Ling, Ning; Li, Hanbing; Xiao, Xiaohe; Zhang, Yawen
Synthesis, crystal structure and biological properties of Cd and Zn coordination polymers based on a flexible tripodal ligand
Acta Crystallographica Section C, 2019, 75
2021691 CIF
HKL
Paper
C156 H182 N84 O7 S12 Zn6C 1 2/c 123.8845; 16.222; 23.6679
90; 90.502; 90
9169.9Wang, Xia; Ling, Ning; Li, Hanbing; Xiao, Xiaohe; Zhang, Yawen
Synthesis, crystal structure and biological properties of Cd and Zn coordination polymers based on a flexible tripodal ligand
Acta Crystallographica Section C, 2019, 75
2021692 CIF
HKL
Paper
C13 H10 N2 O6 SP -16.914; 10.0641; 10.1532
102.153; 100.951; 99.745
661.77Bomfim Filho, Lucius Flavius Ourives; Rocha, Cleidivania; Rodrigues, Bernardo Lages; Beraldo, Heloisa; Teixeira, Leticia Regina
Synthesis, crystal structure and studies on the interaction with albumin of a new silver(I) complex based on 2-(4-nitrobenzenesulfonamido)benzoic acid
Acta Crystallographica Section C, 2019, 75, 1011-1020
2021693 CIF
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Paper
C13 H9 Ag N2 O6 SP 1 21/c 119.9216; 5.2391; 13.086
90; 91.864; 90
1365.08Bomfim Filho, Lucius Flavius Ourives; Rocha, Cleidivania; Rodrigues, Bernardo Lages; Beraldo, Heloisa; Teixeira, Leticia Regina
Synthesis, crystal structure and studies on the interaction with albumin of a new silver(I) complex based on 2-(4-nitrobenzenesulfonamido)benzoic acid
Acta Crystallographica Section C, 2019, 75, 1011-1020
2021696 CIF
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Paper
C10 H9 N O4P c c n13.9295; 17.8065; 7.1429
90; 90; 90
1771.69Pogoda, Dorota; Janczak, Jan; Pawlak, Sylwia; Zaworotko, Michael; Videnova-Adrabinska, Veneta
Tautomeric polymorphism of the neuroactive inhibitor kynurenic acid
Acta Crystallographica Section C, 2019, 75, 793-805
2021697 CIF
HKL
Paper
C12 H13 N O4 SP 21 21 214.9552; 10.8444; 22.7982
90; 90; 90
1225.09Pogoda, Dorota; Janczak, Jan; Pawlak, Sylwia; Zaworotko, Michael; Videnova-Adrabinska, Veneta
Tautomeric polymorphism of the neuroactive inhibitor kynurenic acid
Acta Crystallographica Section C, 2019, 75, 793-805
2021698 CIF
HKL
Paper
C16 H10 N4 O2P 1 21/n 19.0313; 10.2649; 14.3901
90; 92.35; 90
1332.92Marandi, Farzin; Moeini, Keyvan; Mardani, Zahra; Krautscheid, Harald
Spectral, structural and theoretical study of the effects of thiocyanato and dicyanamido ligands on the geometry of PbII complexes containing a triazinic ligand
Acta Crystallographica Section C Structural Chemistry, 2019, 75
2021699 CIF
HKL
Paper
C34 H20 N10 O4 Pb S2P 1 21/c 119.7746; 6.7721; 25.0692
90; 99.286; 90
3313.2Marandi, Farzin; Moeini, Keyvan; Mardani, Zahra; Krautscheid, Harald
Spectral, structural and theoretical study of the effects of thiocyanato and dicyanamido ligands on the geometry of PbII complexes containing a triazinic ligand
Acta Crystallographica Section C Structural Chemistry, 2019, 75
2021700 CIF
HKL
Paper
C68 H40 N24 O14 Pb2P -110.5123; 12.2682; 15.6379
66.834; 80.26; 67.514
1712.8Marandi, Farzin; Moeini, Keyvan; Mardani, Zahra; Krautscheid, Harald
Spectral, structural and theoretical study of the effects of thiocyanato and dicyanamido ligands on the geometry of PbII complexes containing a triazinic ligand
Acta Crystallographica Section C Structural Chemistry, 2019, 75
2021701 CIF
HKL
Paper
C5 H7 N5 O5P 1 21/n 16.1381; 13.7467; 10.0349
90; 95.813; 90
842.38Cabaj, Małgorzata Katarzyna; Gajda, Roman; Hoser, Anna; Makal, Anna; Dominiak, Paulina Maria
Differences and similarities among hypoxanthinium nitrate hydrate structures
Acta Crystallographica Section C, 2019, 75
2021702 CIF
HKL
Paper
C5 H7 N5 O5P m n b6.241; 13.726; 10.095
90; 90; 90
864.8Cabaj, Małgorzata Katarzyna; Gajda, Roman; Hoser, Anna; Makal, Anna; Dominiak, Paulina Maria
Differences and similarities among hypoxanthinium nitrate hydrate structures
Acta Crystallographica Section C, 2019, 75
2021703 CIF
HKL
Paper
C5 H12 N6 O10P 1 21/n 110.8485; 10.1717; 11.2851
90; 104.812; 90
1203.9Cabaj, Małgorzata Katarzyna; Gajda, Roman; Hoser, Anna; Makal, Anna; Dominiak, Paulina Maria
Differences and similarities among hypoxanthinium nitrate hydrate structures
Acta Crystallographica Section C, 2019, 75
2021704 CIF
HKL
Paper
C5 H12 N6 O10P 1 21/n 110.9025; 10.1712; 11.3174
90; 105.264; 90
1210.73Cabaj, Małgorzata Katarzyna; Gajda, Roman; Hoser, Anna; Makal, Anna; Dominiak, Paulina Maria
Differences and similarities among hypoxanthinium nitrate hydrate structures
Acta Crystallographica Section C, 2019, 75
2021705 CIF
HKL
Paper
C5 H7 N5 O5P 1 21/n 16.1156; 13.754; 10.0367
90; 96.52; 90
838.8Cabaj, Małgorzata Katarzyna; Gajda, Roman; Hoser, Anna; Makal, Anna; Dominiak, Paulina Maria
Differences and similarities among hypoxanthinium nitrate hydrate structures
Acta Crystallographica Section C, 2019, 75
2021706 CIF
HKL
Paper
C28 H26 Cu N10 O6P 1 21/n 19.2402; 25.5312; 12.5727
90; 103.173; 90
2888Qian, Lin-Lu; Wang, Zhi-Xiang; Tian, Hai-Xin; Li, Min; Li, Bao-Long; Li, Hai-Yan
Synthesis, structure and photocatalytic degradation of organic dyes of a copper(II) metal‒organic framework (Cu‒MOF) with a 4-coordinated three-dimensional CdSO~4~ topology
Acta Crystallographica Section C, 2019, 75
2021707 CIF
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Paper
C9 H9 Cd N O8P 1 21/n 17.0872; 8.4024; 17.4973
90; 93.608; 90
1039.89Shao, Zhi-Chao; Meng, Xiang-Ru; Hou, Hong-Wei
Two new Cd^II^ and Zn^II^ coordination polymers incorporating 1-aminobenzene-3,4,5-tricarboxylic acid: synthesis, crystal structure and characterization
Acta Crystallographica Section C, 2019, 75
2021708 CIF
HKL
Paper
C18 H18 N2 O17 Zn3P -17.248; 9.3135; 17.2244
102.62; 95.86; 99.15
1108.83Shao, Zhi-Chao; Meng, Xiang-Ru; Hou, Hong-Wei
Two new Cd^II^ and Zn^II^ coordination polymers incorporating 1-aminobenzene-3,4,5-tricarboxylic acid: synthesis, crystal structure and characterization
Acta Crystallographica Section C, 2019, 75
2021709 CIF
HKL
Paper
C33 H27 N O2 SP 1 21/c 116.4855; 9.2994; 19.0422
90; 113.403; 90
2679.11Jia, Lei; Zhang, Jun; Du, Lin
A novel tetraphenylethylene derivative: 4-methyl-<i>N</i>-[3-(1,2,2-triphenylethenyl)phenyl]benzenesulfonamide with aggregation-induced emission
Acta Crystallographica Section C, 2019, 75
2021710 CIF
HKL
Paper
C24 H28 Al N3 O10P -112.413; 13.394; 16.368
87.899; 79.578; 66.635
2455.1Truscott, James Charles; Conradie, Jeanet; Swart, Hendrik C.; Duvenhage, Mart-Marie; Visser, Hendrik Gideon
Synthesis, crystal structures, photoluminescence, electrochemistry and DFT study of aluminium(III) and gallium(III) complexes containing a novel tetradentate Schiff base ligand
Acta Crystallographica Section C, 2019, 75
2021711 CIF
HKL
Paper
C24 H28 Ga N3 O10P -112.399; 13.58; 16.419
86.818; 78.871; 66.124
2479.7Truscott, James Charles; Conradie, Jeanet; Swart, Hendrik C.; Duvenhage, Mart-Marie; Visser, Hendrik Gideon
Synthesis, crystal structures, photoluminescence, electrochemistry and DFT study of aluminium(III) and gallium(III) complexes containing a novel tetradentate Schiff base ligand
Acta Crystallographica Section C, 2019, 75
2021712 CIF
HKL
Paper
C20 H23 F3 N4 O3 SP 1 21/c 115.051; 5.295; 26.548
90; 97.372; 90
2098.3Zhang, Gang; Aldrich, Courtney C.
Macozinone: revised synthesis and crystal structure of a promising new drug for treating drug-sensitive and drug-resistant tuberculosis
Acta Crystallographica Section C, 2019, 75
2021713 CIF
HKL
Paper
C4 H8 Ba O8P -16.8216; 8.1815; 8.8083
95.146; 106.652; 108.317
438.3Priya Vadhana, K. T.; Parveen, S.; Ushadevi, B.; Selvakumar, R.; Sangeetha, S.; Vairam, S.
New barium, strontium and strontium-doped barium squarates: synthesis, crystal structures and DNA/BSA binding, antioxidant and <i>in vitro</i> cytotoxicity studies
Acta Crystallographica Section C, 2019, 75
2021714 CIF
HKL
Paper
C4 H6 O7 SrP -16.0313; 7.7677; 8.6375
101.27; 94.952; 111.578
363.45Priya Vadhana, K. T.; Parveen, S.; Ushadevi, B.; Selvakumar, R.; Sangeetha, S.; Vairam, S.
New barium, strontium and strontium-doped barium squarates: synthesis, crystal structures and DNA/BSA binding, antioxidant and <i>in vitro</i> cytotoxicity studies
Acta Crystallographica Section C, 2019, 75
2021715 CIF
HKL
Paper
C4 H8 Ba0.85 O8 Sr0.15P -16.8271; 8.1878; 8.8227
95.18; 106.64; 108.33
439.6Priya Vadhana, K. T.; Parveen, S.; Ushadevi, B.; Selvakumar, R.; Sangeetha, S.; Vairam, S.
New barium, strontium and strontium-doped barium squarates: synthesis, crystal structures and DNA/BSA binding, antioxidant and <i>in vitro</i> cytotoxicity studies
Acta Crystallographica Section C, 2019, 75
2021716 CIF
HKL
Paper
C28 H26 Cd Cl2 N12 O15I 1 2/a 115.146; 12.2411; 17.6555
90; 99.104; 90
3232.2Tayade, Sakharam B.; Markad, Datta; Kumbhar, Avinash S.; Erxleben, Andrea; Chakravarty, Debamitra
Coordination polymers of Cd^II^ and Pb^II^ derived from bipyridine‒glycoluril: influence of metal-ion size and counter-ions
Acta Crystallographica Section C, 2019, 75
2021717 CIF
HKL
Paper
C28 H24 Cl2 N12 O14 PbI 1 2/a 115.2909; 14.2702; 15.4064
90; 92.174; 90
3359.32Tayade, Sakharam B.; Markad, Datta; Kumbhar, Avinash S.; Erxleben, Andrea; Chakravarty, Debamitra
Coordination polymers of Cd^II^ and Pb^II^ derived from bipyridine‒glycoluril: influence of metal-ion size and counter-ions
Acta Crystallographica Section C, 2019, 75
2021718 CIF
Paper
C17 H14 Br N3 O2 SP b c a22.1247; 8.7081; 18.2738
90; 90; 90
3520.7Palanisamy, Vasanthi; Sanphui, Palash; Prakash, Muthuramalingam; Chernyshev, Vladimir
Multicomponent solid forms of the uric acid reabsorption inhibitor lesinurad and cocrystal polymorphs with urea: DFT simulation and solubility study
Acta Crystallographica Section C, 2019, 75
2021719 CIF
HKL
Paper
C18 H18 Br N3 O3 SP -19.0092; 9.2165; 11.6947
80.899; 79.931; 88.024
944.03Palanisamy, Vasanthi; Sanphui, Palash; Prakash, Muthuramalingam; Chernyshev, Vladimir
Multicomponent solid forms of the uric acid reabsorption inhibitor lesinurad and cocrystal polymorphs with urea: DFT simulation and solubility study
Acta Crystallographica Section C, 2019, 75
2021720 CIF
HKL
Paper
C19 H20 Br N3 O3 SP 1 21/n 113.292; 7.366; 20.193
90; 92.857; 90
1974.6Palanisamy, Vasanthi; Sanphui, Palash; Prakash, Muthuramalingam; Chernyshev, Vladimir
Multicomponent solid forms of the uric acid reabsorption inhibitor lesinurad and cocrystal polymorphs with urea: DFT simulation and solubility study
Acta Crystallographica Section C, 2019, 75
2021721 CIF
HKL
Paper
C25 H24 Br N7 O4 SP 1 21/c 115.1245; 6.6975; 25.826
90; 101.045; 90
2567.6Palanisamy, Vasanthi; Sanphui, Palash; Prakash, Muthuramalingam; Chernyshev, Vladimir
Multicomponent solid forms of the uric acid reabsorption inhibitor lesinurad and cocrystal polymorphs with urea: DFT simulation and solubility study
Acta Crystallographica Section C, 2019, 75
2021722 CIF
Paper
C23 H20 Br N5 O3 SP 1 21/c 114.0851; 6.9721; 23.1952
90; 95.476; 90
2267.4Palanisamy, Vasanthi; Sanphui, Palash; Prakash, Muthuramalingam; Chernyshev, Vladimir
Multicomponent solid forms of the uric acid reabsorption inhibitor lesinurad and cocrystal polymorphs with urea: DFT simulation and solubility study
Acta Crystallographica Section C, 2019, 75
2021723 CIF
Paper
C18 H18 Br N5 O3 SP -110.8067; 12.1242; 7.5869
97.387; 92.495; 95.23
980.16Palanisamy, Vasanthi; Sanphui, Palash; Prakash, Muthuramalingam; Chernyshev, Vladimir
Multicomponent solid forms of the uric acid reabsorption inhibitor lesinurad and cocrystal polymorphs with urea: DFT simulation and solubility study
Acta Crystallographica Section C, 2019, 75
2021724 CIF
HKL
Paper
C18 H18 Br N5 O3 SP 1 21/c 110.9993; 15.229; 24.0797
90; 103.193; 90
3927.1Palanisamy, Vasanthi; Sanphui, Palash; Prakash, Muthuramalingam; Chernyshev, Vladimir
Multicomponent solid forms of the uric acid reabsorption inhibitor lesinurad and cocrystal polymorphs with urea: DFT simulation and solubility study
Acta Crystallographica Section C, 2019, 75
2021725 CIF
HKL
Paper
C44 H34 Co2 N8 O8P 1 n 110.4597; 12.798; 15.0545
90; 98.709; 90
1992Su, Feng; Zhou, Cheng-Yong; Wu, Lin-Tao; Wu, Xi; Su, Jing; Han, Chun; Wang, Zhi-Jun
Two Co^II^ coordination polymers of biphenyl-2,2',5,5'-tetracarboxylic acid with flexible N-donor ligands: syntheses, structures and magnetic properties
Acta Crystallographica Section C, 2019, 75
2021726 CIF
HKL
Paper
C44 H46 Co2 N2 O14C 1 2/c 121.263; 12.366; 19.608
90; 120.91; 90
4423Su, Feng; Zhou, Cheng-Yong; Wu, Lin-Tao; Wu, Xi; Su, Jing; Han, Chun; Wang, Zhi-Jun
Two Co^II^ coordination polymers of biphenyl-2,2',5,5'-tetracarboxylic acid with flexible N-donor ligands: syntheses, structures and magnetic properties
Acta Crystallographica Section C, 2019, 75
2021727 CIF
HKL
Paper
C36 H50 Al2 N4 O34 S4P -18.1442; 9.2736; 17.1777
76.525; 80.08; 76.808
1218.6Ke, Hua; Liao, Jian-Zhen; Lu, Can-Zhong
Structural characterization and photochromic behaviour of a novel compound based on a π-acidic naphthalene diimide derivative and a double hydroxide-bridged dinuclear Al^III^ aqua ion cluster
Acta Crystallographica Section C, 2019, 75
2021728 CIF
HKL
Paper
C22 H25.32 Cd N2 O13.66P -110.4471; 10.9855; 11.6347
83.241; 70.219; 79.242
1232.25Shao, Zhi-Chao; Meng, Xiang-Ru; Hou, Hong-Wei
Effect of pH on the construction of Cd^II^ coordination polymers involving the 1,1'-[1,4-phenylenebis(methylene)]bis(3,5-dicarboxylatopyridinium) ligand
Acta Crystallographica Section C, 2019, 75
2021729 CIF
HKL
Paper
C22 H14 Cd N2 O8P 1 21/c 14.6802; 15.507; 12.8345
90; 93.757; 90
929.5Shao, Zhi-Chao; Meng, Xiang-Ru; Hou, Hong-Wei
Effect of pH on the construction of Cd^II^ coordination polymers involving the 1,1'-[1,4-phenylenebis(methylene)]bis(3,5-dicarboxylatopyridinium) ligand
Acta Crystallographica Section C, 2019, 75
2021730 CIF
HKL
Paper
C22 H16 N4 O7P 1 21/c 110.7545; 6.47168; 30.0313
90; 96.456; 90
2076.91Pawledzio, Sylwia; Trzybiński, Damian; Woźniak, Krzysztof
Crystal structure and energetic features of the cocrystal of carbamazepine with 3,5-dinitrobenzoic acid
Acta Crystallographica Section C, 2019, 75
2021731 CIF
HKL
Paper
C18 H15 F O2P -17.3336; 7.9301; 12.578
107.14; 104.982; 94.285
666.16Sun, Yue; Gao, Zhongfei; Wang, Chunhua; Hou, Guige
Synthesis, crystal structures and anti-inflammatory activity of fluorine-substituted 1,4,5,6-tetrahydrobenzo[<i>h</i>]quinazolin-2-amine derivatives
Acta Crystallographica Section C, 2019, 75
2021732 CIF
HKL
Paper
C19 H19 Cl F N3 OP 1 21/c 117.1415; 11.7917; 17.3364
90; 101.165; 90
3437.8Sun, Yue; Gao, Zhongfei; Wang, Chunhua; Hou, Guige
Synthesis, crystal structures and anti-inflammatory activity of fluorine-substituted 1,4,5,6-tetrahydrobenzo[<i>h</i>]quinazolin-2-amine derivatives
Acta Crystallographica Section C, 2019, 75
2021733 CIF
HKL
Paper
C19 H19 Cl F N3 OP 1 21/c 18.7725; 11.9161; 17.1473
90; 102.626; 90
1749.1Sun, Yue; Gao, Zhongfei; Wang, Chunhua; Hou, Guige
Synthesis, crystal structures and anti-inflammatory activity of fluorine-substituted 1,4,5,6-tetrahydrobenzo[<i>h</i>]quinazolin-2-amine derivatives
Acta Crystallographica Section C, 2019, 75
2021734 CIF
HKL
Paper
C39 H58 Cu2 N8 O11 S2P 1 21 112.6321; 13.9512; 14.792
90; 113.077; 90
2398.2Asano, Akiko; Doi, Mitsinobu
A bis-copper(II)‒[<small>D</small>-βVal^3,7^]ascidiacyclamide complex enveloping two square pyramids and sharing an apex atom from a carbonate anion
Acta Crystallographica Section C, 2019, 75, 1182-1187
2021735 CIF
HKL
Paper
C16 H15 N3P 1 21/c 116.9417; 7.45114; 23.0287
90; 104.983; 90
2808.2Bogdanov, Georgii; Tillotson, John P.; Khrustalev, Victor N.; Rigin, Sergei; Timofeeva, Tatiana V.
Synthesis, crystal structure studies and solvatochromic behaviour of two 2-{5-[4-(dimethylamino)phenyl]penta-2,4-dien-1-ylidene}malononitrile derivatives
Acta Crystallographica Section C, 2019, 75, 1175-1181
2021736 CIF
HKL
Paper
C18 H17 N3P 1 21/c 113.6175; 11.6514; 19.723
90; 104.121; 90
3034.7Bogdanov, Georgii; Tillotson, John P.; Khrustalev, Victor N.; Rigin, Sergei; Timofeeva, Tatiana V.
Synthesis, crystal structure studies and solvatochromic behaviour of two 2-{5-[4-(dimethylamino)phenyl]penta-2,4-dien-1-ylidene}malononitrile derivatives
Acta Crystallographica Section C, 2019, 75, 1175-1181
2021737 CIF
HKL
Paper
C16 H22 O11P 21 21 218.8434; 15.1918; 43.0639
90; 90; 90
5785.5Turney, Toby; Zhang, Wenhui; Oliver, Allen G.; Serianni, Anthony S.
Structural properties of <small>D</small>-mannopyranosyl rings containing <i>O</i>-acetyl side-chains
Acta Crystallographica Section C, 2019, 75, 1166-1174
2021738 CIF
HKL
Paper
C40 H54 O27P 1 21 19.1043; 21.477; 13.8106
90; 91.8362; 90
2699.04Turney, Toby; Zhang, Wenhui; Oliver, Allen G.; Serianni, Anthony S.
Structural properties of <small>D</small>-mannopyranosyl rings containing <i>O</i>-acetyl side-chains
Acta Crystallographica Section C, 2019, 75, 1166-1174
2021739 CIF
HKL
Paper
C25 H30 N4 O4P 1 21/c 19.2613; 10.882; 23.583
90; 95.54; 90
2365.6Breton, Gary W.; Hahn, Lauren A.; Martin, Kenneth L.
Structural verification of a tetrahydrotetrazole compound
Acta Crystallographica Section C, 2019, 75
2021740 CIF
HKL
Paper
C16 H15.72 N2 Na O3.36P 1 21/c 115.9687; 18.7065; 15.8249
90; 106.077; 90
4542.31Shah, Harsh S.; Chaturvedi, Kaushalendra; Zeller, Matthias; Bates, Simon; Morris, Kenneth
A threefold superstructure of the anti-epileptic drug phenytoin sodium as a mixed methanol solvate hydrate
Acta Crystallographica Section C, 2019, 75
2021741 CIF
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Paper
Ba Li O14 P3 Sb2C 1 2/c 115.5757; 13.7204; 9.5959
90; 92.513; 90
2048.7Zhang, Shi-Rui; Zhao, Dan; Zhang, Rui-Juan; Shi, Lin-Ying; Dai, Shao-Jie; Fan, Yun-Chang
A novel stibium phosphate, LiBa(SbO)~2~(PO~4~)~3~: synthesis, crystal structure and RE^3+^-activated (RE = Tb^3+^ and Eu^3+^) fluorescence performance
Acta Crystallographica Section C, 2019, 75
2021742 CIF
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Paper
C6 H6 N4 S6 ZnI -418.1367; 18.1367; 8.7103
90; 90; 90
2865.2Zhang, Jun; Ma, Xiaofan; Kong, Weili; Xie, Fazhi; Yuan, Shizhen; Song, Xiaojie; Lu, Zhansheng; Xuan, Xiaopeng
A sulfur coordination polymer with wide bandgap semiconductivity formed from zinc(II) and 5-methylsulfanyl-1,3,4-thiadiazole-2-thione
Acta Crystallographica Section C, 2019, 75
2021743 CIF
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Paper
C16 H29 N7 O3 SP 1 21/n 17.9854; 28.569; 8.8257
90; 91.61; 90
2012.7Jia, Lina; Wu, Songgu; Gong, Junbo
A tolbutamide‒metformin salt based on antidiabetic drug combinations: synthesis, crystal structure analysis and pharmaceutical properties
Acta Crystallographica Section C, 2019, 75
2021744 CIF
HKL
Paper
C19 H16 OR -3 :H19.1399; 19.1399; 26.7399
90; 90; 120
8483.4Rodríguez Tzompantzi, Tomasa; Amaro Hernández, Aldo Guillermo; Meza-León, Rosa Luisa; Bernès, Sylvain
Deciphering the hydrogen-bonding scheme in the crystal structure of triphenylmethanol: a tribute to George Ferguson and co-workers
Acta Crystallographica Section C, 2019, 75
2021745 CIF
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C19 H16 OR -3 :H19.3309; 19.3309; 26.8542
90; 90; 120
8690.5Rodríguez Tzompantzi, Tomasa; Amaro Hernández, Aldo Guillermo; Meza-León, Rosa Luisa; Bernès, Sylvain
Deciphering the hydrogen-bonding scheme in the crystal structure of triphenylmethanol: a tribute to George Ferguson and co-workers
Acta Crystallographica Section C, 2019, 75
2021746 CIF
HKL
Paper
C39 H41 B N2 OP 1 n 110.673; 10.0539; 15.0271
90; 96.095; 90
1603.37Wang, Shengpei; Yu, Shasha; Feng, Jianxiang; Liu, Shenggao
A highly efficient antioxidant based on boron and a Schiff base bridged phenolic diphenylamine: synthesis, crystal structure and thermal and antioxidant properties
Acta Crystallographica Section C, 2019, 75
2021747 CIF
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C51 H69.5 La N6 O15.25P -112.947; 13.889; 16.289
77.482; 73.859; 85.101
2745.8Zhou, Lian; Shi, Pei-Dong; Guo, Xiao-Kun; Feng, Xiu-Cun; Wang, Lin-Lin; Zhang, Jun
A new lanthanum coordination polymer built from a semi-rigid tripodal carboxylic acid ligand: synthesis, crystal structure and properties
Acta Crystallographica Section C, 2019, 75
2021748 CIF
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Paper
C64 H56 O38 Zn6P -111.1726; 17.3565; 18.1282
106.232; 94.712; 100.804
3281.5An, Yanyan; Lu, Liping; Zhu, Miaoli
Three new Zn^II^ coordination polymers constructed from a semi-rigid tricarboxylic acid: structural changes caused by flexibility and luminescence sensing for hexavalent chromate anions
Acta Crystallographica Section C, 2019, 75
2021749 CIF
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Paper
C28 H24 N2 O10 ZnP -110.1554; 11.4754; 12.0367
78.223; 73.5756; 82.7987
1313.74An, Yanyan; Lu, Liping; Zhu, Miaoli
Three new Zn^II^ coordination polymers constructed from a semi-rigid tricarboxylic acid: structural changes caused by flexibility and luminescence sensing for hexavalent chromate anions
Acta Crystallographica Section C, 2019, 75
2021750 CIF
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Paper
C74 H58 N8 O22 Zn5P -110.7681; 11.4698; 14.7034
99.5851; 99.7806; 100.146
1725.11An, Yanyan; Lu, Liping; Zhu, Miaoli
Three new Zn^II^ coordination polymers constructed from a semi-rigid tricarboxylic acid: structural changes caused by flexibility and luminescence sensing for hexavalent chromate anions
Acta Crystallographica Section C, 2019, 75
2021751 CIFC12 H12 F4 I2 N2P -16.77971; 10.82624; 11.36217
107.326; 92.9637; 104.772
762.42Wang, Ruimin; George, Janine; Potts, Shannon Kimberly; Kremer, Marius; Dronskowski, Richard; Englert, Ulli
The many flavours of halogen bonds ‒ message from experimental electron density and Raman spectroscopy
Acta Crystallographica Section C Structural Chemistry, 2019, 75
2021752 CIF
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C25 H17 N5P -18.6303; 10.4227; 11.3529
74.989; 82.851; 75.116
951.43Granifo, Juan; Gaviño, Rubén; Suárez, Sebastián; Baggio, Ricardo
Structural characterization of a hybrid terpyridine‒pyrazine ligand and its one-dimensional Zn^II^ coordination polymer: a computational approach to <i>conventional</i> and <i>nonconventional</i> intermolecular interactions
Acta Crystallographica Section C, 2019, 75
2021753 CIF
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Paper
C35 H31 N5 O4 ZnP -110.8329; 11.2168; 14.259
65.938; 88.829; 76.828
1535.3Granifo, Juan; Gaviño, Rubén; Suárez, Sebastián; Baggio, Ricardo
Structural characterization of a hybrid terpyridine‒pyrazine ligand and its one-dimensional Zn^II^ coordination polymer: a computational approach to <i>conventional</i> and <i>nonconventional</i> intermolecular interactions
Acta Crystallographica Section C, 2019, 75
2021754 CIF
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Paper
C8 H8 Co N2 O6 S2P 1 21/n 15.0481; 18.633; 6.7533
90; 109.517; 90
598.73Meundaeng, Natthaya; Prior, Timothy John; Rujiwatra, Apinpus
Crystal structures and Hirshfeld surface analysis of transition-metal complexes of 1,3-azolecarboxylic acids
Acta Crystallographica Section C, 2019, 75
2021755 CIF
HKL
Paper
C8 H8 N2 Ni O6 S2P 1 21/n 15.071; 18.239; 6.8383
90; 109.78; 90
595.2Meundaeng, Natthaya; Prior, Timothy John; Rujiwatra, Apinpus
Crystal structures and Hirshfeld surface analysis of transition-metal complexes of 1,3-azolecarboxylic acids
Acta Crystallographica Section C, 2019, 75
2021756 CIF
HKL
Paper
C8 H8 Cd N2 O6 S2P 1 21/n 15.0198; 19.052; 6.8982
90; 109.281; 90
622.72Meundaeng, Natthaya; Prior, Timothy John; Rujiwatra, Apinpus
Crystal structures and Hirshfeld surface analysis of transition-metal complexes of 1,3-azolecarboxylic acids
Acta Crystallographica Section C, 2019, 75
2021757 CIF
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Paper
C8 H10 Co N4 O6P 1 21/c 15.1145; 10.6123; 10.4179
90; 97.858; 90
560.14Meundaeng, Natthaya; Prior, Timothy John; Rujiwatra, Apinpus
Crystal structures and Hirshfeld surface analysis of transition-metal complexes of 1,3-azolecarboxylic acids
Acta Crystallographica Section C, 2019, 75
2021758 CIF
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Paper
C8 H8 Co N2 O8P 1 21/c 15.1664; 10.9879; 9.755
90; 99.378; 90
546.37Meundaeng, Natthaya; Prior, Timothy John; Rujiwatra, Apinpus
Crystal structures and Hirshfeld surface analysis of transition-metal complexes of 1,3-azolecarboxylic acids
Acta Crystallographica Section C, 2019, 75
2021759 CIF
Paper
C16 H14 O6P b a 212.28767; 13.972; 3.93043
90; 90; 90
674.789Marcos R. Imer; Virginia Aldabalde; Silvina Pagola; Jacco van de Streek; Leopoldo Suescun
Four interpenetrating hydrogen-bonded three-dimensional networks in divanillin
Acta Crystallographica, Section C, 2018, 74, 1768-1773
2021761 CIF
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Paper
C22 H15 N5 O2P 1 21/c 17.7222; 11.5401; 20.416
90; 95.965; 90
1809.52Jin, Guoxia; Ji, Yuqi; Wang, Teng; Sun, Yanyan; Li, Yulong; Zhu, Guiying; Ma, Jianping
Syntheses and characterization of dinuclear and tetranuclear AgI supramolecular complexes generated from symmetric and asymmetric molecular clips containing oxadiazole rings
Acta Crystallographica Section C Structural Chemistry, 2019, 75
2021762 CIF
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Paper
C53 H32 Ag4 Cl2 F12 N10 O12C 1 2/c 120.37; 15.0076; 19.5451
90; 90.133; 90
5975Jin, Guoxia; Ji, Yuqi; Wang, Teng; Sun, Yanyan; Li, Yulong; Zhu, Guiying; Ma, Jianping
Syntheses and characterization of dinuclear and tetranuclear AgI supramolecular complexes generated from symmetric and asymmetric molecular clips containing oxadiazole rings
Acta Crystallographica Section C Structural Chemistry, 2019, 75
2021763 CIF
HKL
Paper
C28 H16 Ag2 F6 N8 O6P -17.4159; 9.5352; 11.158
78.97; 82.579; 72.591
736.8Jin, Guoxia; Ji, Yuqi; Wang, Teng; Sun, Yanyan; Li, Yulong; Zhu, Guiying; Ma, Jianping
Syntheses and characterization of dinuclear and tetranuclear AgI supramolecular complexes generated from symmetric and asymmetric molecular clips containing oxadiazole rings
Acta Crystallographica Section C Structural Chemistry, 2019, 75
2021764 CIF
HKL
Paper
C65.89 H107.18 N10 O12.7P 114.4354; 14.4617; 28.6558
93.284; 101.441; 113.33
5322.26Asano, Akiko; Matsuoka, Shiori; Minami, Chisato; Kato, Takuma; Doi, Mitsinobu
[Leu^2^]Gramicidin S preserves the structural properties of its parent peptide and forms helically aligned β-sheets
Acta Crystallographica Section C, 2019, 75
2021765 CIF
HKL
Paper
C44.5 H38 Br Cl N2 Ni P2C 1 2/c 128.319; 11.655; 23.593
90; 97.421; 90
7722Guillet, Gary L.; Pitts, Skyler L.; Sheriff, Kirkland W.; Rucker, Donna N.; Rogers, Aaryn L.
Synthesis, characterization, and crystal structures of organonickel(II) complexes coordinated to novel 1-bromo-2,6-bis{[(λ^5^-phosphanylidene)imino]methyl}benzene NCN-pincer ligands
Acta Crystallographica Section C, 2019, 75, 1381-1388
2021766 CIF
HKL
Paper
C46 H54 Br N2 Ni O0.5 P2P -110.1057; 13.8342; 15.3868
74.892; 85.365; 89.151
2070Guillet, Gary L.; Pitts, Skyler L.; Sheriff, Kirkland W.; Rucker, Donna N.; Rogers, Aaryn L.
Synthesis, characterization, and crystal structures of organonickel(II) complexes coordinated to novel 1-bromo-2,6-bis{[(λ^5^-phosphanylidene)imino]methyl}benzene NCN-pincer ligands
Acta Crystallographica Section C, 2019, 75, 1381-1388
2021767 CIF
HKL
Paper
C44 H61 Br N2 Ni P2P 1 21/c 121.9686; 10.4728; 17.5599
90; 93.74; 90
4031.5Guillet, Gary L.; Pitts, Skyler L.; Sheriff, Kirkland W.; Rucker, Donna N.; Rogers, Aaryn L.
Synthesis, characterization, and crystal structures of organonickel(II) complexes coordinated to novel 1-bromo-2,6-bis{[(λ^5^-phosphanylidene)imino]methyl}benzene NCN-pincer ligands
Acta Crystallographica Section C, 2019, 75, 1381-1388
2021768 CIF
HKL
Paper
C44 H73 Br N2 Ni P2P 1 21/c 117.569; 11.612; 20.608
90; 91.521; 90
4203Guillet, Gary L.; Pitts, Skyler L.; Sheriff, Kirkland W.; Rucker, Donna N.; Rogers, Aaryn L.
Synthesis, characterization, and crystal structures of organonickel(II) complexes coordinated to novel 1-bromo-2,6-bis{[(λ^5^-phosphanylidene)imino]methyl}benzene NCN-pincer ligands
Acta Crystallographica Section C, 2019, 75, 1381-1388
2021769 CIF
HKL
Paper
C16 H16 Cu N6 O7P 1 21/n 118.8929; 12.8744; 8.4047
90; 110.904; 90
1909.76Marandi, Farzin; Moeini, Keyvan; Krautscheid, Harald
Coordination of a triazine ligand with Cu^II^ and Ag^I^ investigated by spectral, structural, theoretical and docking studies
Acta Crystallographica Section C, 2019, 75
2021770 CIF
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Paper
C14 H10 Ag N5 O3P 1 21/c 16.1435; 16.2987; 13.9126
90; 102.414; 90
1360.51Marandi, Farzin; Moeini, Keyvan; Krautscheid, Harald
Coordination of a triazine ligand with Cu^II^ and Ag^I^ investigated by spectral, structural, theoretical and docking studies
Acta Crystallographica Section C, 2019, 75
2021772 CIF
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Paper
C10 H9 N5 OP b c a12.251; 7.457; 20.863
90; 90; 90
1906Fusco, Sandra; Capasso, Domenica; Centore, Roberto; Di Gaetano, Sonia; Parisi, Emmanuele
A new biologically active molecular scaffold: crystal structure of 7-(3-hydroxyphenyl)-4-methyl-2<i>H</i>-[1,2,4]triazolo[3,2-<i>c</i>][1,2,4]triazole and selective antiproliferative activity of three isomeric triazolo‒triazoles
Acta Crystallographica Section C, 2019, 75, 1398-1404
2021773 CIF
HKL
Paper
C8 H8 F5 N2 O3 PP 1 21/n 110.5273; 10.3266; 21.1193
90; 92.647; 90
2293.46Vahdani Alviri, Banafsheh; Pourayoubi, Mehrdad; Farhadipour, Abolghasem; Kaur, Manpreet; Jasinski, Jerry P.
The synergistic co-operation of N—H···O=P hydrogen bonds and C—H···O<i>X</i> weak intermolecular interactions (<i>X</i> is =P or —C) in the (CH~3~O)~2~P(O)(NH‒NHC~6~F~5~) amidophosphoester: a combined X-ray crystallographic and theoretical study
Acta Crystallographica Section C, 2019, 75
2021774 CIF
HKL
Paper
C25 H22 N6 OP 1 21/n 19.7167; 16.1179; 13.9936
90; 91.395; 90
2190.9Vicentes, Daniel E.; Rodríguez, Ricaurte; Ochoa, Patricia; Cobo, Justo; Glidewell, Christopher
A concise and efficient synthesis of amino-substituted (1<i>H</i>-benzo[<i>d</i>]imidazol-1-yl)pyrimidine hybrids: synthetic sequence and the molecular and supramolecular structures of six examples
Acta Crystallographica Section C, 2019, 75
2021775 CIF
HKL
Paper
C27 H26 N6 O3P 1 21/c 115.8911; 9.6209; 15.9244
90; 91.581; 90
2433.7Vicentes, Daniel E.; Rodríguez, Ricaurte; Ochoa, Patricia; Cobo, Justo; Glidewell, Christopher
A concise and efficient synthesis of amino-substituted (1<i>H</i>-benzo[<i>d</i>]imidazol-1-yl)pyrimidine hybrids: synthetic sequence and the molecular and supramolecular structures of six examples
Acta Crystallographica Section C, 2019, 75
2021776 CIF
HKL
Paper
C25 H20 N8 O5P 1 21/n 17.6614; 16.6048; 18.1311
90; 97.101; 90
2288.9Vicentes, Daniel E.; Rodríguez, Ricaurte; Ochoa, Patricia; Cobo, Justo; Glidewell, Christopher
A concise and efficient synthesis of amino-substituted (1<i>H</i>-benzo[<i>d</i>]imidazol-1-yl)pyrimidine hybrids: synthetic sequence and the molecular and supramolecular structures of six examples
Acta Crystallographica Section C, 2019, 75
2021777 CIF
HKL
Paper
C19 H20 N6 O2P -18.1992; 11.016; 11.424
109.105; 109.171; 97.138
889.35Vicentes, Daniel E.; Rodríguez, Ricaurte; Ochoa, Patricia; Cobo, Justo; Glidewell, Christopher
A concise and efficient synthesis of amino-substituted (1<i>H</i>-benzo[<i>d</i>]imidazol-1-yl)pyrimidine hybrids: synthetic sequence and the molecular and supramolecular structures of six examples
Acta Crystallographica Section C, 2019, 75
2021778 CIF
HKL
Paper
C25 H25 F3 N6 O4P 1 21/c 19.1818; 21.0771; 13.361
90; 91.777; 90
2584.5Vicentes, Daniel E.; Rodríguez, Ricaurte; Ochoa, Patricia; Cobo, Justo; Glidewell, Christopher
A concise and efficient synthesis of amino-substituted (1<i>H</i>-benzo[<i>d</i>]imidazol-1-yl)pyrimidine hybrids: synthetic sequence and the molecular and supramolecular structures of six examples
Acta Crystallographica Section C, 2019, 75
2021779 CIF
HKL
Paper
C22 H21 F3 N6 O3P 1 21/n 112.6296; 11.2206; 15.648
90; 104.18; 90
2149.9Vicentes, Daniel E.; Rodríguez, Ricaurte; Ochoa, Patricia; Cobo, Justo; Glidewell, Christopher
A concise and efficient synthesis of amino-substituted (1<i>H</i>-benzo[<i>d</i>]imidazol-1-yl)pyrimidine hybrids: synthetic sequence and the molecular and supramolecular structures of six examples
Acta Crystallographica Section C, 2019, 75
2021780 CIF
HKL
Paper
C43 H36 B F4 O P2 RhP 1 21/c 121.8106; 18.0754; 18.1455
90; 100.742; 90
7028.24Möller, Saskia; Drexler, Hans-Joachim; Heller, Detlef
Two precatalysts for application in propargylic CH activation
Acta Crystallographica Section C, 2019, 75
2021781 CIF
HKL
Paper
C45 H42 B Cl2 F4 O P2 RhP -111.3056; 12.8231; 14.6101
83.286; 74.695; 72.262
1944.29Möller, Saskia; Drexler, Hans-Joachim; Heller, Detlef
Two precatalysts for application in propargylic CH activation
Acta Crystallographica Section C, 2019, 75
2021782 CIF
HKL
Paper
C43 H36 Cl O P2 RhP -110.3662; 12.0008; 15.4693
83.69; 89.763; 64.953
1730.97Möller, Saskia; Drexler, Hans-Joachim; Heller, Detlef
Two precatalysts for application in propargylic CH activation
Acta Crystallographica Section C, 2019, 75
2021783 CIF
HKL
Paper
C16 H26 N2 O5P 1 21 16.4074; 8.1772; 16.3291
90; 99.241; 90
844.45Khalilov, Leonard M.; Mescheryakova, Ekaterina S.; Bikmukhametov, Kamil Sh.; Makhmudiyarova, Nataliya N.; Shangaraev, Kamil R.; Tulyabaev, Arthur R.
How the oxazole fragment influences the conformation of the tetraoxazocane ring in a cyclohexanespiro-3'-(1,2,4,5,7-tetraoxazocane): single-crystal X-ray and theoretical study
Acta Crystallographica Section C, 2019, 75
2021784 CIF
HKL
Paper
C16 H20 N2 O5P 1 21/n 112.7626; 6.92827; 19.7011
90; 104.619; 90
1685.63Zemtsova, Viktoria M.; Fedorov, Alexey Yu.; Fedorova, Elizaveta A.; Boa, Callum; Arkhipov, Sergey G.; Rychkov, Denis A.; Minkov, Vasily S.; Pulham, Colin R.; Boldyreva, Elena V.
A novel crystal form of metacetamol: the first example of a hydrated form
Acta Crystallographica Section C, 2019, 75
2021785 CIF
HKL
Paper
C37 H42P n a 2124.372; 31.382; 7.543
90; 90; 90
5769Gupta, Sakuntala; Choudhury, Tanmay; Dmochowska, Ewelina; Kula, Przemyslaw; Borbone, Fabio; Centore, Roberto
Crystal structure and mesogenic behaviour of a new fluorene derivative: 9,9-dimethyl-2,7-bis(4-pentylphenyl)-9<i>H</i>-fluorene
Acta Crystallographica Section C, 2019, 75
2021786 CIF
HKL
Paper
C32 H30 O3P -15.954; 7.88; 26.3
89.56; 86.85; 87.68
1231Vashchenko, Alexander; Smirnov, Vladimir; Semenova, Nadezhda; Schmidt, Elena
Unusual structure of a biphenyl fragment: the important role of weak interactions
Acta Crystallographica Section C, 2019, 75
2021787 CIF
HKL
Paper
Ba4 F23 Y Zr3P n 21 a19.564; 5.397; 17.161
90; 90; 90
1812Laval, Jean-Paul; Taoudi, Abdelkrim
Ba~4~YZr~3~F~23~ and Ba~4~LnZr~3~F~23~: a new noncentrosymmetric potential host structure type for optical devices
Acta Crystallographica Section C, 2019, 75
2021788 CIF
Paper
C6 H5 Cl3 SeP -18.6245; 9.5342; 11.7229
78.332; 77.789; 66.341
855.5Bloomfield, Hannah R.; Ritch, Jamie S.
A new polymorph of phenylselenium trichloride
Acta Crystallographica Section C, 2019, 75
2021789 CIF
Paper
C42 H36 Cl Fe Mn N10 O8P -110.404; 13.969; 16.226
113.317; 104.231; 90.973
2081.8Lan, Wenlong; Zhou, Zhen; Li, Jie; Dou, Yong; Hao, Xiaoyun; Yang, Lu; Liu, Hui; Li, Dacheng; Liu, Qingyun; Zhang, Daopeng
A cyanide-bridged Fe^III^‒Mn^II^ heterobimetallic one-dimensional coordination polymer: synthesis, crystal structure, experimental and theoretical magnetism investigation
Acta Crystallographica Section C, 2019, 75
2021790 CIF
HKL
Paper
C13 H18 N2 O4P 21 21 217.347; 10.197; 18.477
90; 90; 90
1384.2Wang, Ai; Englert, Ulli
Absolute structure of the chiral pyrrolidine derivative (2S)-methyl (Z)-5-(2-tert-butoxy-1-cyano-2-oxoethylidene)pyrrolidine-2-carboxylate, a compound with low resonant scattering
Acta Crystallographica Section C Structural Chemistry, 2019, 75
2021791 CIF
HKL
Paper
C13 H18 N2 O4P 21 21 217.3731; 10.1909; 18.4972
90; 90; 90
1389.85Wang, Ai; Englert, Ulli
Absolute structure of the chiral pyrrolidine derivative (2S)-methyl (Z)-5-(2-tert-butoxy-1-cyano-2-oxoethylidene)pyrrolidine-2-carboxylate, a compound with low resonant scattering
Acta Crystallographica Section C Structural Chemistry, 2019, 75
2021792 CIF
HKL
Paper
C6 H8 Mn N2 O4 SC m c m6.6108; 7.3958; 16.9678
90; 90; 90
829.59Gonzalez Guillen, Anabel; Oszajca, Marcin; Luberda-Durnaś, Katarzyna; Lasocha, Wieslaw
Synthesis, crystal structure solution and characterization of two organic‒inorganic hybrid layered materials based on metal sulfates and 1,4-phenylenediamine
Acta Crystallographica Section C, 2019, 75
2021793 CIF
HKL
Paper
C6 H8 Cu N2 O4 SP b c n7.0852; 7.2052; 16.431
90; 90; 90
838.81Gonzalez Guillen, Anabel; Oszajca, Marcin; Luberda-Durnaś, Katarzyna; Lasocha, Wieslaw
Synthesis, crystal structure solution and characterization of two organic‒inorganic hybrid layered materials based on metal sulfates and 1,4-phenylenediamine
Acta Crystallographica Section C, 2019, 75
2021795 CIF
HKL
Paper
C16 H36 Cl3 Fe N4F d d 234.5658; 9.3832; 12.5209
90; 90; 90
4061Clendening, Reese A.; Zeller, Matthias; Ren, Tong
Crystal structures of two (5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane)iron(III) complexes
Acta Crystallographica Section C, 2019, 75
2021796 CIF
HKL
Paper
C16 H36 Cl6 Fe2 N4P 1 21/c 16.5569; 19.1663; 20.2946
90; 95.3558; 90
2539.32Clendening, Reese A.; Zeller, Matthias; Ren, Tong
Crystal structures of two (5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane)iron(III) complexes
Acta Crystallographica Section C, 2019, 75
2021797 CIF
HKL
Paper
C8 H6 Cu2 N6C 1 2/c 116.687; 4.5071; 13.933
90; 114.21; 90
955.7Qin, Ying-Lian; Sun, Hong; Jing, Yan; Jiang, Xiu-Ping; Wang, Gao-Feng; Qin, Jian-Fang
A novel three-dimensional copper(I) cyanide coordination polymer constructed from various bridging ligands: synthesis, crystal structure and characterization
Acta Crystallographica Section C, 2019, 75
2021798 CIF
HKL
Paper
C26 H32 N2 OP 1 21/c 117.491; 16.604; 15.17
90; 101.362; 90
4319.3Bogdanov, Georgii; Tillotson, John P.; Khrustalev, Victor N.; Rigin, Sergei; Timofeeva, Tatiana V.
Synthesis and structural study of organic two-photon-absorbing cycloalkanone chromophores
Acta Crystallographica Section C, 2019, 75
2021799 CIF
HKL
Paper
C27 H34 N2 OP -113.064; 13.3132; 14.9575
78.53; 66.274; 71.554
2251.5Bogdanov, Georgii; Tillotson, John P.; Khrustalev, Victor N.; Rigin, Sergei; Timofeeva, Tatiana V.
Synthesis and structural study of organic two-photon-absorbing cycloalkanone chromophores
Acta Crystallographica Section C, 2019, 75
2021800 CIF
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Paper
C28 H36 N2 OP -111.224; 13.874; 16.93
87.69; 77.11; 67.445
2370Bogdanov, Georgii; Tillotson, John P.; Khrustalev, Victor N.; Rigin, Sergei; Timofeeva, Tatiana V.
Synthesis and structural study of organic two-photon-absorbing cycloalkanone chromophores
Acta Crystallographica Section C, 2019, 75
2021801 CIF
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Paper
C17 H10 N2 O3P 1 21/n 113.9075; 5.1543; 18.801
90; 97.772; 90
1335.3Shishkina, Svitlana V.; Konovalova, Irina S.; Trostianko, Pavlo V.; Geleverya, Anna O.; Kovalenko, Sergiy M.; Bunyatyan, Natalya D.
Polymorphism of 3-(5-phenyl-1,3,4-oxadiazol-2-yl)- and 3-[5-(pyridin-4-yl)-1,3,4-oxadiazol-2-yl]-2<i>H</i>-chromen-2-ones
Acta Crystallographica Section C, 2019, 75
2021802 CIF
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Paper
C17 H10 N2 O3P 1 21/n 115.611; 3.8414; 21.974
90; 90.74; 90
1317.6Shishkina, Svitlana V.; Konovalova, Irina S.; Trostianko, Pavlo V.; Geleverya, Anna O.; Kovalenko, Sergiy M.; Bunyatyan, Natalya D.
Polymorphism of 3-(5-phenyl-1,3,4-oxadiazol-2-yl)- and 3-[5-(pyridin-4-yl)-1,3,4-oxadiazol-2-yl]-2<i>H</i>-chromen-2-ones
Acta Crystallographica Section C, 2019, 75
2021803 CIF
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Paper
C17 H10 N2 O3P 1 21/n 13.9158; 17.717; 18.832
90; 94.67; 90
1302.2Shishkina, Svitlana V.; Konovalova, Irina S.; Trostianko, Pavlo V.; Geleverya, Anna O.; Kovalenko, Sergiy M.; Bunyatyan, Natalya D.
Polymorphism of 3-(5-phenyl-1,3,4-oxadiazol-2-yl)- and 3-[5-(pyridin-4-yl)-1,3,4-oxadiazol-2-yl]-2<i>H</i>-chromen-2-ones
Acta Crystallographica Section C, 2019, 75
2021804 CIF
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Paper
C16 H9 N3 O3P 1 n 13.7788; 9.9655; 16.899
90; 93.466; 90
635.2Shishkina, Svitlana V.; Konovalova, Irina S.; Trostianko, Pavlo V.; Geleverya, Anna O.; Kovalenko, Sergiy M.; Bunyatyan, Natalya D.
Polymorphism of 3-(5-phenyl-1,3,4-oxadiazol-2-yl)- and 3-[5-(pyridin-4-yl)-1,3,4-oxadiazol-2-yl]-2<i>H</i>-chromen-2-ones
Acta Crystallographica Section C, 2019, 75
2021805 CIF
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Paper
C16 H9 N3 O3P c a 2120.931; 3.7708; 16.0887
90; 90; 90
1269.8Shishkina, Svitlana V.; Konovalova, Irina S.; Trostianko, Pavlo V.; Geleverya, Anna O.; Kovalenko, Sergiy M.; Bunyatyan, Natalya D.
Polymorphism of 3-(5-phenyl-1,3,4-oxadiazol-2-yl)- and 3-[5-(pyridin-4-yl)-1,3,4-oxadiazol-2-yl]-2<i>H</i>-chromen-2-ones
Acta Crystallographica Section C, 2019, 75
2021806 CIFC16 H35 N7 O7P 1 21 18.8215; 15.0094; 16.6719
90; 95.666; 90
2196.7Jurek, Paul; Kiefer, Garry E.; Fronczek, Frank R.
Crystal structures of two polymorphic forms of DOTAM-mono-acid dihydrate
Acta Crystallographica Section C, 2018, 74, 542-547
2021807 CIFC16 H35 N7 O7P 1 21/c 18.8624; 15.0884; 16.7029
90; 95.302; 90
2223.95Jurek, Paul; Kiefer, Garry E.; Fronczek, Frank R.
Crystal structures of two polymorphic forms of DOTAM-mono-acid dihydrate
Acta Crystallographica Section C, 2018, 74, 542-547
2021808 CIF
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Paper
C19 H14 N2 O4P 1 21/c 14.354; 23.381; 15.8
90; 97.096; 90
1596.1Yamamoto, Ryo; Minami, Shoma; Okuno, Tsunehisa
Crystal polymorphs of 6-[(phenylcarbamoyl)oxy]hexa-2,4-diyn-1-yl isonicotinate
Acta Crystallographica Section C, 2018, 74, 876-881
2021809 CIF
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Paper
C19 H14 N2 O4P 1 21/c 119.861; 5.16; 16.451
90; 109.589; 90
1588.4Yamamoto, Ryo; Minami, Shoma; Okuno, Tsunehisa
Crystal polymorphs of 6-[(phenylcarbamoyl)oxy]hexa-2,4-diyn-1-yl isonicotinate
Acta Crystallographica Section C, 2018, 74, 876-881
2021810 CIF
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Paper
C76 H60 Cd6 F8 N16 O20C 1 c 118.644; 18.646; 26.106
90; 107.16; 90
8671.4Zhang, Yuchi; Wu, Yuanhua; He, Xin; Ma, Junhan; Shen, Xuan; Zhu, Dunru
Topological identification of the first uninodal 8-connected lsz MOF built from 2,2'-difluorobiphenyl-4,4'-dicarboxylate pillars and cadmium(II)‒triazolate layers
Acta Crystallographica Section C, 2018, 74, 256-262
2021811 CIF
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Paper
C8 H9 N O2P c 1 111.75455; 8.57201; 14.5155
84.16; 90; 90
1454.99Reiss, Céleste A.; van Mechelen, Jan B.; Goubitz, Kees; Peschar, René
Reassessment of paracetamol orthorhombic Form III and determination of a novel low-temperature monoclinic Form III-m from powder diffraction data
Acta Crystallographica Section C, 2018, 74, 392-399
2021812 CIF
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Paper
C8 H9 N O2P c a 2111.8376; 8.5688; 14.81837
90; 90; 90
1503.09Reiss, Céleste A.; van Mechelen, Jan B.; Goubitz, Kees; Peschar, René
Reassessment of paracetamol orthorhombic Form III and determination of a novel low-temperature monoclinic Form III-m from powder diffraction data
Acta Crystallographica Section C, 2018, 74, 392-399
2021813 CIF
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Paper
C37 H30 Cd2 N4 O11P 1 21/c 113.8999; 18.0445; 14.4096
90; 99.568; 90
3563.9He, Yuan-Chun; Xiao, Li-Yuan; Yuan, Zi-Han; Zhang, Jie; Wang, Yan; Xu, Na
Two coordination polymers constructed by 5-[(4-carboxyphenoxy)methyl]benzene-1,3-dicarboxylic acid and 2,2′-bipyridine: syntheses, structures and luminescence properties
Acta Crystallographica Section C Structural Chemistry, 2019, 75
2021814 CIF
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Paper
C52 H42 Mn2 N4 O17P -19.9758; 10.529; 13.7445
91.623; 108.25; 116.694
1200.37He, Yuan-Chun; Xiao, Li-Yuan; Yuan, Zi-Han; Zhang, Jie; Wang, Yan; Xu, Na
Two coordination polymers constructed by 5-[(4-carboxyphenoxy)methyl]benzene-1,3-dicarboxylic acid and 2,2′-bipyridine: syntheses, structures and luminescence properties
Acta Crystallographica Section C Structural Chemistry, 2019, 75
2021815 CIF
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Paper
C28 H34 Co N7 O9 SP 1 21/c 110.8248; 21.331; 13.546
90; 94.595; 90
3117.8Zhang, Chong; Zhang, Qing-Hong; Zhang, Kou-Lin
Band gap, sorption properties and fluorescence sensing behaviour of a novel 1D→2D cathenane-like cobalt(II)‒organic framework
Acta Crystallographica Section C, 2019, 75
2021816 CIF
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Paper
C9 H12 F3 N O6 SC 1 2/c 118.804; 5.792; 24.523
90; 92.57; 90
2668.2Wołoszyn, Łukasz; Ilczyszyn, Maria M.; Kinzhybalo, Vasyl
The dehydration process in the <small>DL</small>-phenylglycinium trifluoromethanesulfonate monohydrate crystal revealed by XRD, vibrational and DSC studies
Acta Crystallographica Section C, 2019, 75
2021817 CIF
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Paper
C9 H10 F3 N O5 SP -110.485; 10.635; 13.734
104.79; 98.04; 118.07
1244.4Wołoszyn, Łukasz; Ilczyszyn, Maria M.; Kinzhybalo, Vasyl
The dehydration process in the <small>DL</small>-phenylglycinium trifluoromethanesulfonate monohydrate crystal revealed by XRD, vibrational and DSC studies
Acta Crystallographica Section C, 2019, 75
2021818 CIF
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Paper
C70.5 H58.5 N5.5 Ni3 O22.5C 1 2/c 127.7272; 15.8769; 19.7083
90; 132.525; 90
6394.1Yang, Dong-Dong; Lu, Li-Ping; Zhu, Miao-Li
Structural diversity, magnetic properties and luminescence of Ni^II^, Co^II^ and Zn^II^ coordination polymers derived from 3,3'-[(5-carboxy-1,3-phenylene)bis(oxy)]dibenzoic acid and 1,10-phenanthroline
Acta Crystallographica Section C, 2019, 75
2021819 CIF
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Paper
C70 H64 Co3 N6 O22C 1 2/c 127.9723; 15.9725; 19.7372
90; 132.662; 90
6484.7Yang, Dong-Dong; Lu, Li-Ping; Zhu, Miao-Li
Structural diversity, magnetic properties and luminescence of Ni^II^, Co^II^ and Zn^II^ coordination polymers derived from 3,3'-[(5-carboxy-1,3-phenylene)bis(oxy)]dibenzoic acid and 1,10-phenanthroline
Acta Crystallographica Section C, 2019, 75
2021820 CIF
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Paper
C33 H22 N2 O9 ZnP -19.012; 10.866; 15.755
89.462; 74.554; 66.57
1356.3Yang, Dong-Dong; Lu, Li-Ping; Zhu, Miao-Li
Structural diversity, magnetic properties and luminescence of Ni^II^, Co^II^ and Zn^II^ coordination polymers derived from 3,3'-[(5-carboxy-1,3-phenylene)bis(oxy)]dibenzoic acid and 1,10-phenanthroline
Acta Crystallographica Section C, 2019, 75
2021821 CIF
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Paper
Cl2 D11.52 H0.48 Mg O6P -15.89632; 6.0225; 6.0147
86.454; 87.276; 70.898
201.354Yamashita, Keishiro; Komatsu, Kazuki; Hattori, Takanori; Machida, Shinichi; Kagi, Hiroyuki
Crystal structure of a high-pressure phase of magnesium chloride hexahydrate determined by <i>in-situ</i> X-ray and neutron diffraction methods
Acta Crystallographica Section C, 2019, 75
2021822 CIF
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Paper
Cl2 H12 Mg O6P -15.7639; 5.9218; 5.9806
84.68; 86.72; 70.99
192.09Yamashita, Keishiro; Komatsu, Kazuki; Hattori, Takanori; Machida, Shinichi; Kagi, Hiroyuki
Crystal structure of a high-pressure phase of magnesium chloride hexahydrate determined by <i>in-situ</i> X-ray and neutron diffraction methods
Acta Crystallographica Section C, 2019, 75
2021823 CIF
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Paper
C48 H40 As2 F6 O2 TcP -110.043; 11.036; 21.159
75.991; 77.963; 71.388
2134.3Balasekaran, Samundeeswari Mariappan; Poineau, Frederic
Bis(tetraphenylarsonium) hexafluoridotechnetate(IV) dihydrate: preparation, structure and spectroscopic analysis
Acta Crystallographica Section C, 2019, 75
2021824 CIF
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Paper
C18 H14 Cl N3P 1 21/c 18.1413; 19.3495; 9.9395
90; 97.44; 90
1552.6Zhang, Yan; Li, Mei; Li, Shi-Li; Zhang, Xian-Ming
The photochromic behaviour of two viologen salts modulated by the distances between the halide anions and the cationic N atoms of viologen
Acta Crystallographica Section C, 2019, 75
2021825 CIF
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Paper
C18 H14 Br N3P 1 21/c 18.2921; 18.943; 10.2348
90; 97.849; 90
1592.59Zhang, Yan; Li, Mei; Li, Shi-Li; Zhang, Xian-Ming
The photochromic behaviour of two viologen salts modulated by the distances between the halide anions and the cationic N atoms of viologen
Acta Crystallographica Section C, 2019, 75
2021826 CIF
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Paper
C18 H24 N6 O7P 1 21/c 110.6765; 28.819; 6.8163
90; 104.395; 90
2031.4Rivera, Augusto; Rojas, Jicli José; Sadat-Bernal, John; Ríos-Motta, Jaime; Bolte, Michael
Mechanochemical synthesis and X-ray structural characterization of three 3-nitrophenol cocrystals with three aminal cage azaadamantanes: the role of the stereoelectronic effect on intermolecular hydrogen-bonding patterns
Acta Crystallographica Section C, 2019, 75
2021827 CIF
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Paper
C19 H24 N6 O6C 1 m 17.2053; 25.253; 6.5134
90; 120.939; 90
1016.52Rivera, Augusto; Rojas, Jicli José; Sadat-Bernal, John; Ríos-Motta, Jaime; Bolte, Michael
Mechanochemical synthesis and X-ray structural characterization of three 3-nitrophenol cocrystals with three aminal cage azaadamantanes: the role of the stereoelectronic effect on intermolecular hydrogen-bonding patterns
Acta Crystallographica Section C, 2019, 75
2021828 CIF
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Paper
C20 H26 N6 O6C 1 c 126.159; 6.4931; 12.807
90; 106.338; 90
2087.5Rivera, Augusto; Rojas, Jicli José; Sadat-Bernal, John; Ríos-Motta, Jaime; Bolte, Michael
Mechanochemical synthesis and X-ray structural characterization of three 3-nitrophenol cocrystals with three aminal cage azaadamantanes: the role of the stereoelectronic effect on intermolecular hydrogen-bonding patterns
Acta Crystallographica Section C, 2019, 75
2021829 CIF
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Paper
C11 H16 Co N4 O5 SP 1 21/c 19.5941; 14.9735; 10.7212
90; 105.719; 90
1482.58Fang, Zi-Yi; Zhang, Li; Ma, Jian-Ping; Zhao, Long; Wang, Shi-Ling; Xie, Nan-Hua; Liu, Yi-Qin; Guo, Xiao-Ying; Qin, Jie
Dinuclear cobalt and nickel complexes of a mercaptoacetic acid substituted 1,2,4-triazole ligand: syntheses, structures and urease inhibitory studies
Acta Crystallographica Section C, 2019, 75
2021830 CIF
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Paper
C10 H16 N4 Ni O6 SI 41/a :225.9178; 25.9178; 9.4186
90; 90; 90
6326.8Fang, Zi-Yi; Zhang, Li; Ma, Jian-Ping; Zhao, Long; Wang, Shi-Ling; Xie, Nan-Hua; Liu, Yi-Qin; Guo, Xiao-Ying; Qin, Jie
Dinuclear cobalt and nickel complexes of a mercaptoacetic acid substituted 1,2,4-triazole ligand: syntheses, structures and urease inhibitory studies
Acta Crystallographica Section C, 2019, 75
2021831 CIF
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Paper
C34 H32 Cl2 N2 O8P b c a20.8602; 8.76477; 34.5299
90; 90; 90
6313.27Sun, Wei; Zuo, Limin; Zhao, Ting; Zhu, Zhiling; Shan, Guangzhi
Five solvates of a multicomponent pharmaceutical salt formed by berberine and diclofenac
Acta Crystallographica Section C, 2019, 75
2021832 CIF
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Paper
C34.5 H33 Cl3 N2 O8C 1 2/c 124.0513; 7.23787; 37.2921
90; 93.1167; 90
6482.21Sun, Wei; Zuo, Limin; Zhao, Ting; Zhu, Zhiling; Shan, Guangzhi
Five solvates of a multicomponent pharmaceutical salt formed by berberine and diclofenac
Acta Crystallographica Section C, 2019, 75
2021833 CIF
HKL
Paper
C36 H34 Cl2 N2 O7P 1 21/n 18.15748; 15.9353; 25.4325
90; 93.9667; 90
3298.1Sun, Wei; Zuo, Limin; Zhao, Ting; Zhu, Zhiling; Shan, Guangzhi
Five solvates of a multicomponent pharmaceutical salt formed by berberine and diclofenac
Acta Crystallographica Section C, 2019, 75
2021834 CIF
HKL
Paper
C35 H32 Cl2 N2 O7P 1 21/n 120.8841; 7.44641; 21.5399
90; 110.049; 90
3146.71Sun, Wei; Zuo, Limin; Zhao, Ting; Zhu, Zhiling; Shan, Guangzhi
Five solvates of a multicomponent pharmaceutical salt formed by berberine and diclofenac
Acta Crystallographica Section C, 2019, 75
2021835 CIF
HKL
Paper
C36 H36 Cl2 N2 O8P -18.1183; 13.7384; 15.0469
97.102; 97.62; 91.886
1648.56Sun, Wei; Zuo, Limin; Zhao, Ting; Zhu, Zhiling; Shan, Guangzhi
Five solvates of a multicomponent pharmaceutical salt formed by berberine and diclofenac
Acta Crystallographica Section C, 2019, 75
2021836 CIF
HKL
Paper
C32 H44 F12 N6 P2P -19.29; 11.228; 18
95.133; 97.423; 100.66
1817Thapa, Rajesh; Kilyanek, Stefan M.
Synthesis and structural characterization of iridium(I) complexes of 20-membered macrocyclic rings bearing chelating bis(N-heterocyclic carbene) ligands
Acta Crystallographica Section C, 2019, 75
2021837 CIF
HKL
Paper
C41 H56 Br Cl2 Ir N6 OP -110.3943; 13.6413; 15.8517
91.6088; 95.5859; 110.427
2091.66Thapa, Rajesh; Kilyanek, Stefan M.
Synthesis and structural characterization of iridium(I) complexes of 20-membered macrocyclic rings bearing chelating bis(N-heterocyclic carbene) ligands
Acta Crystallographica Section C, 2019, 75
2021838 CIF
HKL
Paper
C56 H70 Br2 Ir2 N6P b c a12.6186; 27.239; 30.2461
90; 90; 90
10396.1Thapa, Rajesh; Kilyanek, Stefan M.
Synthesis and structural characterization of iridium(I) complexes of 20-membered macrocyclic rings bearing chelating bis(N-heterocyclic carbene) ligands
Acta Crystallographica Section C, 2019, 75
2021839 CIF
HKL
Paper
C17 H22 N2 OP 21 21 2111.887; 12.2535; 27.7511
90; 90; 90
4042.2Chernyshov, Vladimir V.; Gatilov, Yuri V.; Yarovaya, Olga I.; Koskin, Igor P.; Yarovoy, Spartak S.; Brylev, Konstantin A.; Salakhutdinov, Nariman F.
The first example of the stereoselective synthesis and crystal structure of a spirobicycloquinazolinone based on (‒)-fenchone and anthranilamide
Acta Crystallographica Section C, 2019, 75
2021840 CIF
HKL
C58 H62 Cd3 N6 O23P 1 2/c 116.2511; 11.612; 20.2609
90; 124.02; 90
3169Yu, Yu'e; Chen, Yuqian; Mi, Xiuna; Wang, Suna; Lu, Jing
A novel (3,6)-connected Cd^II^ coordination polymer based on an ether-linked tricarboxylate ligand: synthesis, topology and luminescence sensing properties in aqueous solution
Acta Crystallographica Section C, 2019, 75
2021841 CIF
HKL
Paper
C9 H8 N4I 1 2/a 111.4608; 5.3791; 26.74
90; 91.457; 90
1648Moreno-Fuquen, Rodolfo; Arango-Daraviña, Kevin; Garcia, Esteban; Tenorio, Juan-C.; Ellena, Javier
Synthesis, spectroscopic (FT‒IR and UV‒Vis), crystallographic and theoretical studies, and amolecular docking simulation of an imatinib-like template
Acta Crystallographica Section C, 2019, 75
2021842 CIF
Paper
C38 H34 Cu2 I2 N10 O4P -19.6124; 9.7864; 12.7314
96.787; 110.599; 93.325
1106.82Jin, Guo-Xia; You, Tian-Chao; Ma, Jian-Ping
Three Ag^I^, Cu^I^ and Cd^II^ coordination polymers based on the new asymmetrical ligand 2-{4-[(1<i>H</i>-imidazol-1-yl)methyl]phenyl}-5-(pyridin-4-yl)-1,3,4-oxadiazole: syntheses, characterization and emission properties
Acta Crystallographica Section C, 2019, 75
2021843 CIF
Paper
C36 H35.3 Cd N12 O10.65P -19.4532; 14.9309; 15.8386
108.975; 99.904; 104.901
1961.42Jin, Guo-Xia; You, Tian-Chao; Ma, Jian-Ping
Three Ag^I^, Cu^I^ and Cd^II^ coordination polymers based on the new asymmetrical ligand 2-{4-[(1<i>H</i>-imidazol-1-yl)methyl]phenyl}-5-(pyridin-4-yl)-1,3,4-oxadiazole: syntheses, characterization and emission properties
Acta Crystallographica Section C, 2019, 75
2021844 CIF
Paper
C17 H13 Ag F6 N5 O PP 1 21 15.1714; 22.8649; 8.0202
90; 92.875; 90
947.14Jin, Guo-Xia; You, Tian-Chao; Ma, Jian-Ping
Three Ag^I^, Cu^I^ and Cd^II^ coordination polymers based on the new asymmetrical ligand 2-{4-[(1<i>H</i>-imidazol-1-yl)methyl]phenyl}-5-(pyridin-4-yl)-1,3,4-oxadiazole: syntheses, characterization and emission properties
Acta Crystallographica Section C, 2019, 75
2021845 CIF
HKL
Paper
C128 H228 Cr2 O26 P6P 1 21 116.0576; 24.7423; 18.2142
90; 105.443; 90
6975.3Tavtorkin, Alexander N.; Korchagina, Sof'ya A.; Komarov, Pavel D.; Vinogradov, Alexey A.; Churakov, Andrei V.; Nifant'ev, Ilya E.; Minyaev, Mikhail E.
Chromium complexes bearing disubstituted organophosphate ligands and their use in ethylene polymerization
Acta Crystallographica Section C, 2020, 76, 93-103
2021846 CIF
HKL
Paper
C84 H136 Cl Cr2 O18 P3P 21 21 2115.4994; 23.1995; 25.5787
90; 90; 90
9197.5Tavtorkin, Alexander N.; Korchagina, Sof'ya A.; Komarov, Pavel D.; Vinogradov, Alexey A.; Churakov, Andrei V.; Nifant'ev, Ilya E.; Minyaev, Mikhail E.
Chromium complexes bearing disubstituted organophosphate ligands and their use in ethylene polymerization
Acta Crystallographica Section C, 2020, 76, 93-103
2021847 CIF
HKL
Paper
C116 H172 Cl2 Cr2 O20 P4P -112.8003; 14.3922; 19.0048
76.5044; 74.5363; 66.3984
3060.2Tavtorkin, Alexander N.; Korchagina, Sof'ya A.; Komarov, Pavel D.; Vinogradov, Alexey A.; Churakov, Andrei V.; Nifant'ev, Ilya E.; Minyaev, Mikhail E.
Chromium complexes bearing disubstituted organophosphate ligands and their use in ethylene polymerization
Acta Crystallographica Section C, 2020, 76, 93-103
2021848 CIF
HKL
Paper
C23 H18 OP b c a10.6325; 14.7734; 21.7751
90; 90; 90
3420.39Pineda, Leslie W.; Arias, María Laura; Cabezas, Jorge A.
Crystal structures and biological activity of 1,1,4-triphenyl-substituted 1,3-enyne compounds
Acta Crystallographica Section C, 2020, 76, 87-92
2021849 CIF
HKL
Paper
C22 H15 N O2P 1 21/c 19.6548; 22.2107; 7.9248
90; 105.749; 90
1635.6Pineda, Leslie W.; Arias, María Laura; Cabezas, Jorge A.
Crystal structures and biological activity of 1,1,4-triphenyl-substituted 1,3-enyne compounds
Acta Crystallographica Section C, 2020, 76, 87-92
2021850 CIF
HKL
Paper
C23 H18P 1 21/n 114.3054; 5.8354; 19.0365
90; 90.935; 90
1588.91Pineda, Leslie W.; Arias, María Laura; Cabezas, Jorge A.
Crystal structures and biological activity of 1,1,4-triphenyl-substituted 1,3-enyne compounds
Acta Crystallographica Section C, 2020, 76, 87-92
2021851 CIF
HKL
Paper
C19 H24 N O3 PP n a 219.3538; 9.7899; 19.3432
90; 90; 90
1771.31Vahdani Alviri, Banafsheh; Pourayoubi, Mehrdad; Abdul Salam, Abdul Ajees; Nečas, Marek; van der Lee, Arie; Chithran, Akshara; Damodaran, Krishnan
Conformational flexibility in amidophosphoesters: a CSD analysis completed with two new crystal structures of (C~6~H~5~O)~2~P(O)<i>X</i> [<i>X</i>~= NHC~7~H~13~ and N(CH~2~C~6~H~5~)~2~]
Acta Crystallographica Section C, 2020, 76, 104-116
2021852 CIF
HKL
Paper
C26 H24 N O3 PP -18.3404; 9.5349; 14.9677
76.28; 75.778; 72.055
1080.73Vahdani Alviri, Banafsheh; Pourayoubi, Mehrdad; Abdul Salam, Abdul Ajees; Nečas, Marek; van der Lee, Arie; Chithran, Akshara; Damodaran, Krishnan
Conformational flexibility in amidophosphoesters: a CSD analysis completed with two new crystal structures of (C~6~H~5~O)~2~P(O)<i>X</i> [<i>X</i>~= NHC~7~H~13~ and N(CH~2~C~6~H~5~)~2~]
Acta Crystallographica Section C, 2020, 76, 104-116
2021867 CIFC18 H14 Cl N SP 21 21 215.739; 7.621; 36.561
90; 90; 90
1599.1Roche, D.; Métin, J.; Madesclaire, M.
(E)-3-(4-Chlorophenyl)-3-cyclopropyl-2-(phenylthio)acrylonitrile
Acta Crystallographica Section C Crystal Structure Communications, 1996, 52, 3104
2021868 CIF
Paper
C6 H11 Br Cu N2 O3P 21 21 216.8175; 10.762; 13.71
90; 90; 90
1005.9Chen, W.; Lim, M.-C.
Bromo(n-propionamido-α-alaninato)copper(II) and its Hydrate
Acta Crystallographica Section C Crystal Structure Communications, 1997, 53, 537
2021869 CIF
Paper
C6 H13 Br Cu N2 O4P 21 21 217.6203; 10.2094; 14.045
90; 90; 90
1092.68Chen, W.; Lim, M.-C.
Bromo(n-propionamido-α-alaninato)copper(II) and its Hydrate
Acta Crystallographica Section C Crystal Structure Communications, 1997, 53, 537
2021870 CIFC13 H14 N4 O3P n a 2117.02; 13.906; 5.811
90; 90; 90
1375.3Paixão, J. A.; Pereira Silva, P. S.; Matos Beja, A.; Ramos Silva, M.; Alte da Veiga, L.
N,N'-Diphenylguanidinium Nitrate
Acta Crystallographica Section C Crystal Structure Communications, 1998, 54, 805
2021871 CIFC14 H28 N2 S4P b c a11.0232; 15.1645; 24.2826
90; 90; 90
4059.11Jian, F.; Jiang, L.; Fun, H.-K.; Chinnakali, K.; Razak, I. A.; You, X.
Bis(dipropylthiocarbamoyl) disulfide
Acta Crystallographica Section C Crystal Structure Communications, 1999, 55, 573
2021872 CIFC17 H18 O4P 1 21/n 18.4341; 15.5112; 11.4293
90; 90.397; 90
1495.18Li, S.; Lundquist, K.; Stomberg, R.
An investigation of 2,4'-dihydroxy-3,3'-dimethoxy-5'-methylstilbene using X-ray crystallography and NMR spectroscopy
Acta Crystallographica Section C Crystal Structure Communications, 1999, 55, 1012
2021873 CIFC19 H26 N2 O2P -19.198; 10.559; 10.593
68.94; 79.01; 67.41
884.78Sievert, M.; Nagel, N.; Bock, H.; Dienelt, R.
Diisopropylammonium diphenylmethylnitronate at 200K
Acta Crystallographica Section C Crystal Structure Communications, 1999, 55, 1147
2021925 CIF
HKL
Paper
C32 H24 N6P 1 21/c 113.023; 7.34; 27.762
90; 97.693; 90
2629.9Tan, Xue-Jie; Wang, Di; Hei, Xiao-Ming; Yang, Feng-Cun; Zhu, Ya-Ling; Xing, Dian-Xiang; Ma, Jian-Ping
Synthesis, crystal structures, antiproliferative activities and reverse docking studies of eight novel Schiff bases derived from benzil
Acta Crystallographica Section C, 2020, 76, 44-63
2021926 CIF
HKL
Paper
C34 H28 N6P -110.2585; 11.961; 12.8232
64.941; 79.573; 76.829
1381.45Tan, Xue-Jie; Wang, Di; Hei, Xiao-Ming; Yang, Feng-Cun; Zhu, Ya-Ling; Xing, Dian-Xiang; Ma, Jian-Ping
Synthesis, crystal structures, antiproliferative activities and reverse docking studies of eight novel Schiff bases derived from benzil
Acta Crystallographica Section C, 2020, 76, 44-63
2021927 CIF
HKL
Paper
C70 H59 N13P -111.271; 11.6944; 12.5164
79.875; 87.701; 64.941
1470.1Tan, Xue-Jie; Wang, Di; Hei, Xiao-Ming; Yang, Feng-Cun; Zhu, Ya-Ling; Xing, Dian-Xiang; Ma, Jian-Ping
Synthesis, crystal structures, antiproliferative activities and reverse docking studies of eight novel Schiff bases derived from benzil
Acta Crystallographica Section C, 2020, 76, 44-63
2021928 CIF
HKL
Paper
C36 H26 N4C 1 2/c 126.195; 9.809; 11.806
90; 115.23; 90
2744.1Tan, Xue-Jie; Wang, Di; Hei, Xiao-Ming; Yang, Feng-Cun; Zhu, Ya-Ling; Xing, Dian-Xiang; Ma, Jian-Ping
Synthesis, crystal structures, antiproliferative activities and reverse docking studies of eight novel Schiff bases derived from benzil
Acta Crystallographica Section C, 2020, 76, 44-63
2021929 CIF
HKL
Paper
C23 H17 N3 OP 21 21 216.8767; 8.3698; 32.6317
90; 90; 90
1878.17Tan, Xue-Jie; Wang, Di; Hei, Xiao-Ming; Yang, Feng-Cun; Zhu, Ya-Ling; Xing, Dian-Xiang; Ma, Jian-Ping
Synthesis, crystal structures, antiproliferative activities and reverse docking studies of eight novel Schiff bases derived from benzil
Acta Crystallographica Section C, 2020, 76, 44-63
2021930 CIF
HKL
Paper
C24 H19 N3 OP 43 21 28.358; 8.358; 54.6705
90; 90; 90
3819.07Tan, Xue-Jie; Wang, Di; Hei, Xiao-Ming; Yang, Feng-Cun; Zhu, Ya-Ling; Xing, Dian-Xiang; Ma, Jian-Ping
Synthesis, crystal structures, antiproliferative activities and reverse docking studies of eight novel Schiff bases derived from benzil
Acta Crystallographica Section C, 2020, 76, 44-63
2021931 CIF
HKL
Paper
C24 H19 N3 OP 1 21/c 118.6779; 8.6694; 12.7956
90; 106.91; 90
1982.36Tan, Xue-Jie; Wang, Di; Hei, Xiao-Ming; Yang, Feng-Cun; Zhu, Ya-Ling; Xing, Dian-Xiang; Ma, Jian-Ping
Synthesis, crystal structures, antiproliferative activities and reverse docking studies of eight novel Schiff bases derived from benzil
Acta Crystallographica Section C, 2020, 76, 44-63
2021932 CIF
HKL
Paper
C25 H18 N2 OP 1 21/c 117.2081; 9.4075; 11.9703
90; 94.814; 90
1931Tan, Xue-Jie; Wang, Di; Hei, Xiao-Ming; Yang, Feng-Cun; Zhu, Ya-Ling; Xing, Dian-Xiang; Ma, Jian-Ping
Synthesis, crystal structures, antiproliferative activities and reverse docking studies of eight novel Schiff bases derived from benzil
Acta Crystallographica Section C, 2020, 76, 44-63
2021933 CIF
HKL
Paper
C14 H11 N O3P 1 21/c 19.419; 8.322; 14.342
90; 93.612; 90
1122Tan, Xue-Jie; Liu, Shuai; Hei, Xiao-Ming; Yang, Feng-Cun; He, Peng-Bing; Guo, Feng; Xing, Dian-Xiang
Structural and theoretical study of four novel norcantharidine derivatives: two new cases of conditional isomorphism
Acta Crystallographica Section C, 2020, 76, 75-86
2021934 CIF
HKL
Paper
C14 H10 N2 O5P 1 21 15.285; 18.418; 6.699
90; 100.105; 90
642Tan, Xue-Jie; Liu, Shuai; Hei, Xiao-Ming; Yang, Feng-Cun; He, Peng-Bing; Guo, Feng; Xing, Dian-Xiang
Structural and theoretical study of four novel norcantharidine derivatives: two new cases of conditional isomorphism
Acta Crystallographica Section C, 2020, 76, 75-86
2021935 CIF
HKL
Paper
C14 H12 N2 O5P 1 21 15.3661; 18.6171; 6.6116
90; 98.918; 90
652.52Tan, Xue-Jie; Liu, Shuai; Hei, Xiao-Ming; Yang, Feng-Cun; He, Peng-Bing; Guo, Feng; Xing, Dian-Xiang
Structural and theoretical study of four novel norcantharidine derivatives: two new cases of conditional isomorphism
Acta Crystallographica Section C, 2020, 76, 75-86
2021936 CIF
HKL
Paper
C10 H13 N O4P m n 2110.035; 5.5937; 8.9634
90; 90; 90
503.14Tan, Xue-Jie; Liu, Shuai; Hei, Xiao-Ming; Yang, Feng-Cun; He, Peng-Bing; Guo, Feng; Xing, Dian-Xiang
Structural and theoretical study of four novel norcantharidine derivatives: two new cases of conditional isomorphism
Acta Crystallographica Section C, 2020, 76, 75-86
2021937 CIF
Paper
C96 H86 N20 O17 Zn3P 1 c 116.908; 8.432; 34.872
90; 102.782; 90
4848.4Wang, Saier; Bi, Rong; Liu, Jiadi; Shi, Ying; Wang, Kuaibing; Mao, Feifei; Wu, Hua
A self-penetrated three-dimensional zinc(II) coordination framework based on 4,4',4''-(1,3,5-triazine-2,4,6-triyl)tribenzoic acid and 1,3-bis[(imidazol-1-yl)methyl]benzene ligands: synthesis, structure and properties
Acta Crystallographica Section C, 2020, 76, 10-16
2021938 CIF
HKL
Paper
C5 H8 N8F d d 218.632; 19.933; 4.3095
90; 90; 90
1600.5Li, Hongya; Yan, Biao; Ma, Haixia; Sun, Zhiyong; Ma, Yajun; Zhang, Zhifang
Crystal structure, thermodynamic properties and detonation characterization of bis(5-amino-1,2,4-triazol-3-yl)methane
Acta Crystallographica Section C, 2020, 76, 64-68
2021939 CIF
HKL
Paper
C28 H18 Cu N4 O5 S2C 1 2/c 121.086; 8.0671; 15.9578
90; 103.623; 90
2638.1Shi, Zhi-Qiang; Ji, Ning-Ning; Hu, Hai-Liang
One-pot concomitant preparation of two copper(II) coordination polymers with different configurations of bridging bithiophene ligands
Acta Crystallographica Section C, 2020, 76, 37-43
2021940 CIF
HKL
Paper
C42 H28 Cu2 N4 O11 S2P -111.14; 12.522; 14.911
74.487; 87.709; 79.511
1970.7Shi, Zhi-Qiang; Ji, Ning-Ning; Hu, Hai-Liang
One-pot concomitant preparation of two copper(II) coordination polymers with different configurations of bridging bithiophene ligands
Acta Crystallographica Section C, 2020, 76, 37-43
2021941 CIF
HKL
Paper
C50 H38 Co N12 O10P -17.4985; 11.3099; 14.7152
101.142; 95.336; 99.286
1198.41Wang, Zhi-Xiang; Tian, Hai-Xin; Ding, Jian-Gang; Li, Bao-Long; Wu, Bing
A Co-MOF with a (4,4)-connected binodal two-dimensional topology: synthesis, structure and photocatalytic properties
Acta Crystallographica Section C, 2020, 76, 23-29
2021942 CIF
HKL
Paper
C17 H16 N2 O4 SP 328.3729; 8.3729; 20.0206
90; 90; 120
1215.51Shishkina, Svitlana V.; Ukrainets, Igor V.; Vashchenko, Olga V.; Voloshchuk, Natali I.; Bondarenko, Pavlo S.; Petrushova, Lidiya A.; Sim, Galina
Biological properties of two enantiomorphic forms of <i>N</i>-(2,6-dimethylphenyl)-4-hydroxy-2,2-dioxo-1<i>H</i>-2λ^6^,1-benzothiazine-3-carboxamide, a structural analogue of piroxicam
Acta Crystallographica Section C, 2020, 76, 69-74
2021943 CIF
HKL
Paper
C17 H16 N2 O4 SP 318.3735; 8.3735; 20.0299
90; 90; 120
1216.25Shishkina, Svitlana V.; Ukrainets, Igor V.; Vashchenko, Olga V.; Voloshchuk, Natali I.; Bondarenko, Pavlo S.; Petrushova, Lidiya A.; Sim, Galina
Biological properties of two enantiomorphic forms of <i>N</i>-(2,6-dimethylphenyl)-4-hydroxy-2,2-dioxo-1<i>H</i>-2λ^6^,1-benzothiazine-3-carboxamide, a structural analogue of piroxicam
Acta Crystallographica Section C, 2020, 76, 69-74
2021944 CIF
HKL
Paper
C49 H61 N5 O9P 1 21 110.645; 19.161; 11.503
90; 93.75; 90
2341.2Linden, Anthony; Magirius, J. E. Florian; Heimgartner, Heinz
Solid-state conformations of linear depsipeptide amides with an alternating sequence of α,α-disubstituted α-amino acid and α-hydroxy acid
Acta Crystallographica Section C Structural Chemistry, 2019, 76, 1
2021945 CIF
HKL
Paper
C28 H37 N3 O6P 1 21 110.388; 12.756; 21.624
90; 93.55; 90
2859.9Linden, Anthony; Magirius, J. E. Florian; Heimgartner, Heinz
Solid-state conformations of linear depsipeptide amides with an alternating sequence of α,α-disubstituted α-amino acid and α-hydroxy acid
Acta Crystallographica Section C Structural Chemistry, 2019, 76, 1
2021946 CIF
HKL
Paper
C32 H41 N3 O6P 1 21/n 19.937; 18.319; 16.436
90; 90.19; 90
2992Linden, Anthony; Magirius, J. E. Florian; Heimgartner, Heinz
Solid-state conformations of linear depsipeptide amides with an alternating sequence of α,α-disubstituted α-amino acid and α-hydroxy acid
Acta Crystallographica Section C Structural Chemistry, 2019, 76, 1
2021947 CIF
HKL
Paper
C30 H37 N3 O6P n a 2118.922; 18.3; 8.072
90; 90; 90
2795Linden, Anthony; Magirius, J. E. Florian; Heimgartner, Heinz
Solid-state conformations of linear depsipeptide amides with an alternating sequence of α,α-disubstituted α-amino acid and α-hydroxy acid
Acta Crystallographica Section C Structural Chemistry, 2019, 76, 1
2021948 CIF
HKL
Paper
C15 H23 N O2P 21 21 2115.3994; 11.5152; 7.8087
90; 90; 90
1384.69Żesławska, Ewa; Kalinowska-Tłuścik, Justyna; Nitek, Wojciech; Marona, Henryk; Waszkielewicz, Anna M.
Influence of the position of the methyl substituent and <i>N</i>-oxide formation on the geometry and intermolecular interactions of 1-(phenoxyethyl)piperidin-4-ol derivatives
Acta Crystallographica Section C, 2020, 76, 30-36
2021949 CIF
HKL
Paper
C15 H23 N O2P b c a8.517; 10.019; 32.323
90; 90; 90
2758.18Żesławska, Ewa; Kalinowska-Tłuścik, Justyna; Nitek, Wojciech; Marona, Henryk; Waszkielewicz, Anna M.
Influence of the position of the methyl substituent and <i>N</i>-oxide formation on the geometry and intermolecular interactions of 1-(phenoxyethyl)piperidin-4-ol derivatives
Acta Crystallographica Section C, 2020, 76, 30-36
2021950 CIF
HKL
Paper
C15 H25 N O4P 1 21/c 119.3892; 6.1746; 12.6588
90; 100.87; 90
1488.33Żesławska, Ewa; Kalinowska-Tłuścik, Justyna; Nitek, Wojciech; Marona, Henryk; Waszkielewicz, Anna M.
Influence of the position of the methyl substituent and <i>N</i>-oxide formation on the geometry and intermolecular interactions of 1-(phenoxyethyl)piperidin-4-ol derivatives
Acta Crystallographica Section C, 2020, 76, 30-36
2021951 CIF
HKL
Paper
C24 H26 Cl Mn N8 O6P 1 21 18.2608; 14.0676; 11.5967
90; 97.9839; 90
1334.6Olmstead, Marilyn M.
Bond length of perchlorate at different temperatures: X-ray and neutron comparison
Acta Crystallographica Section C, 2020, 76
2021952 CIF
HKL
Paper
C24 H26 Cl Mn N8 O6P 1 21 18.2788; 14.0816; 11.6343
90; 98.0814; 90
1342.84Olmstead, Marilyn M.
Bond length of perchlorate at different temperatures: X-ray and neutron comparison
Acta Crystallographica Section C, 2020, 76
2021953 CIF
HKL
Paper
C24 H26 Cl Mn N8 O6P 1 21 18.3188; 14.1117; 11.6994
90; 98.3222; 90
1358.96Olmstead, Marilyn M.
Bond length of perchlorate at different temperatures: X-ray and neutron comparison
Acta Crystallographica Section C, 2020, 76
2021954 CIF
HKL
Paper
C12 H10 Co N6 O6P 1 21/c 17.134; 9.882; 10.3
90; 100.484; 90
714Cai, Hua; Li, Na; Zhang, Nan; Yang, Zhenyun; Cao, Jing; Lin, Yating; Min, Nan; Wang, Jia
Metal-directed supramolecular architectures based on the bifunctional ligand 2,5-bis(1H-1,2,4-triazol-1-yl)terephthalic acid
Acta Crystallographica Section C Structural Chemistry, 2020, 76
2021955 CIF
HKL
Paper
C12 H14 N6 Ni O8P -17.3533; 7.9541; 8.1396
65.416; 88.89; 69.788
401.92Cai, Hua; Li, Na; Zhang, Nan; Yang, Zhenyun; Cao, Jing; Lin, Yating; Min, Nan; Wang, Jia
Metal-directed supramolecular architectures based on the bifunctional ligand 2,5-bis(1H-1,2,4-triazol-1-yl)terephthalic acid
Acta Crystallographica Section C Structural Chemistry, 2020, 76
2021956 CIF
HKL
Paper
C5 H9 Au Cl5 N5 OP n a 2115.7712; 13.0392; 13.0556
90; 90; 90
2684.8Savchenkov, Anton; Demina, Ludmila; Safonov, Alexey; Grigoriev, Mikhail; Solovov, Roman; Abkhalimov, Evgeny
Syntheses and crystal structures of new aurate salts of adenine or guanine nucleobases
Acta Crystallographica Section C, 2020, 76
2021957 CIF
HKL
Paper
C5 H7 Au Cl4 N5 O1.5P -18.1408; 11.9063; 12.4678
84.918; 84.475; 85.649
1195.35Savchenkov, Anton; Demina, Ludmila; Safonov, Alexey; Grigoriev, Mikhail; Solovov, Roman; Abkhalimov, Evgeny
Syntheses and crystal structures of new aurate salts of adenine or guanine nucleobases
Acta Crystallographica Section C, 2020, 76
2021958 CIF
HKL
Paper
C24 H24 N4 O6 ZnP 1 21 18.288; 14.3767; 10.2288
90; 104.514; 90
1179.91Xu, Zhong-Xuan; Chen, Guo-Guo; Li, Li-Feng
Temperature-induced solid-to-solid transformation in helical homochiral coordination polymers
Acta Crystallographica Section C, 2020, 76
2021959 CIF
HKL
Paper
C24 H24 N4 O6 ZnP 1 21 18.2888; 14.3618; 10.2195
90; 104.509; 90
1177.75Xu, Zhong-Xuan; Chen, Guo-Guo; Li, Li-Feng
Temperature-induced solid-to-solid transformation in helical homochiral coordination polymers
Acta Crystallographica Section C, 2020, 76
2021960 CIF
HKL
Paper
C24 H22 N4 O5 ZnP 1 21 19.0631; 11.8412; 11.6382
90; 112.456; 90
1154.28Xu, Zhong-Xuan; Chen, Guo-Guo; Li, Li-Feng
Temperature-induced solid-to-solid transformation in helical homochiral coordination polymers
Acta Crystallographica Section C, 2020, 76
2021961 CIF
HKL
Paper
C24 H22 N4 O5 ZnP 1 21 19.0571; 11.8439; 11.6393
90; 112.441; 90
1154.01Xu, Zhong-Xuan; Chen, Guo-Guo; Li, Li-Feng
Temperature-induced solid-to-solid transformation in helical homochiral coordination polymers
Acta Crystallographica Section C, 2020, 76
2021962 CIF
HKL
Paper
C42 H54 N8 Ni2 O11C 1 2/c 112.188; 15.6516; 22.7466
90; 95.989; 90
4315.5Zhao, Fang-Hua; Li, Zhong-Lin; Zhang, Shu-Fang; Han, Jian-Hui; Zhang, Mei; Han, Jun; Lin, Yu-Wen; You, Jin-Mao
Two new Ni^II^ and Zn^II^ metal‒organic frameworks of glutarate and 1,4-bis[(2-methyl-1<i>H</i>-imidazol-1-yl)methyl]benzene ligands: syntheses, structures and luminescence sensing properties
Acta Crystallographica Section C, 2020, 76
2021963 CIF
HKL
Paper
C21 H32 N4 O8 ZnP 1 21/c 19.6488; 17.7245; 14.9109
90; 96.47; 90
2533.8Zhao, Fang-Hua; Li, Zhong-Lin; Zhang, Shu-Fang; Han, Jian-Hui; Zhang, Mei; Han, Jun; Lin, Yu-Wen; You, Jin-Mao
Two new Ni^II^ and Zn^II^ metal‒organic frameworks of glutarate and 1,4-bis[(2-methyl-1<i>H</i>-imidazol-1-yl)methyl]benzene ligands: syntheses, structures and luminescence sensing properties
Acta Crystallographica Section C, 2020, 76
2021964 CIF
HKL
Paper
C59.5 H76.5 Mo10 N8.5 O60.029 P4P -114.8316; 15.2679; 23.237
89.1396; 78.1097; 75.4959
4981.24Skorepova, Eliska; Harchani, Ali; Ftini, Mohamed Mongi; Dušek, Michal; Haddad, Amor
Crystal structure of a new polyoxometalate (POM) compound with a high level of crystallographic disorder
Acta Crystallographica Section C, 2020, 76
2021965 CIF
HKL
Paper
C52 H43 Cl2 Cu F6 N3 P3P 1 21/c 120.089; 11.1502; 21.972
90; 97.945; 90
4874.4Wang, Dan-Dan; Wang, Jian-Teng; Song, Li; Wang, You-Yu; Chai, Wen-Xiang
A new heteroleptic phosphorescent cuprous complex supported by a BINAP ligand: synthesis, structure, luminescence properties and theoretical analyses
Acta Crystallographica Section C, 2020, 76
2021966 CIF
HKL
Paper
C20 H16 Eu2 N4 O16P -17.49; 9.42; 9.6533
117.97; 93.19; 99.12
587.3Zheng, Wenxu; Wu, Kechen
Anion-directed assemblies of europium(III) coordination polymers based on 1<i>H</i>-benzimidazole-5,6-dicarboxylate: structures and luminescence properties
Acta Crystallographica Section C, 2020, 76
2021967 CIF
HKL
Paper
C9 H5 Eu N2 O8 SP -16.961; 7.9482; 10.9901
101.579; 106.761; 95.588
562.51Zheng, Wenxu; Wu, Kechen
Anion-directed assemblies of europium(III) coordination polymers based on 1<i>H</i>-benzimidazole-5,6-dicarboxylate: structures and luminescence properties
Acta Crystallographica Section C, 2020, 76
2021968 CIF
HKL
Paper
C7 H9 N O2P b c a7.185; 12.917; 13.697
90; 90; 90
1271.2Rajendrakumar, Satyasree; Durga, Anuja Surampudi Venkata Sai; Nanubolu, Jagadeesh Babu; Balasubramanian, Sridhar
Two novel polymorphic forms of iron-chelating agent deferiprone
Acta Crystallographica Section C, 2020, 76, 193-200
2021969 CIF
HKL
Paper
C7 H9 N O2P 1 21/c 16.4847; 13.6853; 7.1462
90; 95.6583; 90
631.1Rajendrakumar, Satyasree; Durga, Anuja Surampudi Venkata Sai; Nanubolu, Jagadeesh Babu; Balasubramanian, Sridhar
Two novel polymorphic forms of iron-chelating agent deferiprone
Acta Crystallographica Section C, 2020, 76, 193-200
2021970 CIF
HKL
Paper
C7 H9 N O2P 1 21/c 119.4132; 13.7057; 7.1809
90; 91.775; 90
1909.7Rajendrakumar, Satyasree; Durga, Anuja Surampudi Venkata Sai; Nanubolu, Jagadeesh Babu; Balasubramanian, Sridhar
Two novel polymorphic forms of iron-chelating agent deferiprone
Acta Crystallographica Section C, 2020, 76, 193-200
2021972 CIF
HKL
Paper
C8 H20 N Re S4P 63 m c8.15; 8.15; 13.092
90; 90; 120
753.1Bernhardt, Eduard; Herbst-Irmer, Regine
Phase transition and structures of the twinned low-temperature phases of (Et~4~N)[ReS~4~]
Acta Crystallographica Section C, 2020, 76
2021973 CIF
HKL
Paper
C8 H20 N Re S4P 6324.17; 24.17; 12.916
90; 90; 120
6534.5Bernhardt, Eduard; Herbst-Irmer, Regine
Phase transition and structures of the twinned low-temperature phases of (Et~4~N)[ReS~4~]
Acta Crystallographica Section C, 2020, 76

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