Crystallography Open Database

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2022358 CIF
HKL
Paper
Al0.33 Li4 Mg SiI -4 3 d10.7338; 10.7338; 10.7338
90; 90; 90
1236.69Pavlyuk, Volodymyr; Ciesielski, Wojciech; Kulawik, Damian; Pavlyuk, Nazar; Dmytriv, Grygoriy
Structural and enhanced hydrogen storage properties of the Li~12~Mg~3~Si~3~Al phase
Acta Crystallographica Section C, 2021, 77, 227-234
2022359 CIF
Paper
C12 H17 N5 O SP 1 21/c 114.0601; 10.9903; 8.7228
90; 97.16; 90
1337.38Szczesio, Małgorzata; Gobis, Katarzyna; Korona-Głowniak, Izabela; Mazerant-Politowicz, Ida; Ziembicka, Dagmara; Foks, Henryk; Główka, Marek; Olczak, Andrzej
Synthesis, structure and biological activity of four new picolinohydrazonamide derivatives
Acta Crystallographica, Section C, 2020, 76, 673-680
2022360 CIF
HKL
Paper
C12 H18 Cl N5 O2 SP 1 21/c 16.8829; 11.8924; 19.0594
90; 98.737; 90
1541.99Szczesio, Małgorzata; Gobis, Katarzyna; Korona-Głowniak, Izabela; Mazerant-Politowicz, Ida; Ziembicka, Dagmara; Foks, Henryk; Główka, Marek; Olczak, Andrzej
Synthesis, structure and biological activity of four new picolinohydrazonamide derivatives
Acta Crystallographica, Section C, 2020, 76, 673-680
2022361 CIF
HKL
Paper
C17 H19 Cl N6 SP 1 21/n 111.2996; 9.387; 18.9935
90; 101.8; 90
1972.05Szczesio, Małgorzata; Gobis, Katarzyna; Korona-Głowniak, Izabela; Mazerant-Politowicz, Ida; Ziembicka, Dagmara; Foks, Henryk; Główka, Marek; Olczak, Andrzej
Synthesis, structure and biological activity of four new picolinohydrazonamide derivatives
Acta Crystallographica, Section C, 2020, 76, 673-680
2022362 CIF
HKL
Paper
C6 H7 Cl N4P 21 21 213.77379; 5.63483; 32.9783
90; 90; 90
701.273Szczesio, Małgorzata; Gobis, Katarzyna; Korona-Głowniak, Izabela; Mazerant-Politowicz, Ida; Ziembicka, Dagmara; Foks, Henryk; Główka, Marek; Olczak, Andrzej
Synthesis, structure and biological activity of four new picolinohydrazonamide derivatives
Acta Crystallographica, Section C, 2020, 76, 673-680
2022363 CIF
HKL
Paper
C30 H36 Cd Cl2 Fe O P2P -19.8113; 9.8273; 16.6898
91.454; 106.989; 101.534
1501.86Chaudhary, Karan; Trivedi, Manoj; Masram, Dhanraj T.; Rath, Nigam P.
Transition-metal complexes of group 12 with 1,1'-bis(phosphanyl)ferrocene ligands
Acta Crystallographica Section C, 2021, 77, 240-248
2022364 CIF
HKL
Paper
C52 H54 Cl2 Fe2 O6 P4 Zn2P -110.8762; 11.3163; 13.5343
83.078; 87.002; 70.848
1561.97Chaudhary, Karan; Trivedi, Manoj; Masram, Dhanraj T.; Rath, Nigam P.
Transition-metal complexes of group 12 with 1,1'-bis(phosphanyl)ferrocene ligands
Acta Crystallographica Section C, 2021, 77, 240-248
2022365 CIF
HKL
Paper
C26 H44 Fe P2 S2P 1 21/c 114.7589; 14.0445; 14.7141
90; 116.982; 90
2718Chaudhary, Karan; Trivedi, Manoj; Masram, Dhanraj T.; Rath, Nigam P.
Transition-metal complexes of group 12 with 1,1'-bis(phosphanyl)ferrocene ligands
Acta Crystallographica Section C, 2021, 77, 240-248
2022366 CIF
HKL
Paper
C35.75 H52 Cl0.25 Fe N1.75 P2 ZnP 1 21/m 18.2992; 21.6504; 9.9175
90; 112.451; 90
1646.9Chaudhary, Karan; Trivedi, Manoj; Masram, Dhanraj T.; Rath, Nigam P.
Transition-metal complexes of group 12 with 1,1'-bis(phosphanyl)ferrocene ligands
Acta Crystallographica Section C, 2021, 77, 240-248
2022367 CIF
HKL
Paper
B8 Eu Na3 O15P -16.2861; 7.5366; 13.4963
90.547; 100.667; 113.489
573.81Bi, Wen-Yan; Wang, Wei; Zhang, Rui-Juan
New red phosphor Na~3~EuB~8~O~15~ with an open-window tubular structure
Acta Crystallographica Section C, 2021, 77, 235-239
2022368 CIF
HKL
Paper
C5 H7 N3 S2P -16.088; 7.826; 8.623
79.8; 72.96; 80.62
383.9Slyvka, Yurii; Kinzhybalo, Vasyl; Shyyka, Olga; Mys'kiv, Marian
Synthesis, structure and computational study of 5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-amine (<i>Pesta</i>) and its heterometallic π,σ-complex [Cu~2~FeCl~2~(<i>Pesta</i>)~4~][FeCl~4~]
Acta Crystallographica Section C, 2021, 77, 249-256
2022369 CIF
HKL
Paper
C20 H28 Cl6 Cu2 Fe2 N12 S8C 1 2/c 117.65; 10.686; 21.107
90; 90.15; 90
3981Slyvka, Yurii; Kinzhybalo, Vasyl; Shyyka, Olga; Mys'kiv, Marian
Synthesis, structure and computational study of 5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-amine (<i>Pesta</i>) and its heterometallic π,σ-complex [Cu~2~FeCl~2~(<i>Pesta</i>)~4~][FeCl~4~]
Acta Crystallographica Section C, 2021, 77, 249-256
2022370 CIFC7 H5 Br O3P 1 21/n 13.8053; 14.661; 12.9396
90; 97.32; 90
716.01Roy, Monalisa; Li, Keyao; Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D.
Varying degrees of homostructurality in a series of cocrystals of antimalarial drug 11-azaartemisinin with salicylic acids
Acta Crystallographica Section C, 2021, 77, 262-270
2022371 CIFC7 H5 Br O3P -16.9581; 7.1413; 8.0284
81.959; 73.812; 71.352
362.44Roy, Monalisa; Li, Keyao; Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D.
Varying degrees of homostructurality in a series of cocrystals of antimalarial drug 11-azaartemisinin with salicylic acids
Acta Crystallographica Section C, 2021, 77, 262-270
2022372 CIFC7 H4 Br2 O3C 1 2/c 110.3703; 10.9444; 14.8108
90; 103.35; 90
1635.55Roy, Monalisa; Li, Keyao; Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D.
Varying degrees of homostructurality in a series of cocrystals of antimalarial drug 11-azaartemisinin with salicylic acids
Acta Crystallographica Section C, 2021, 77, 262-270
2022373 CIF
HKL
Paper
C22 H28 Br N O7P 1 21 19.9325; 9.0196; 12.3942
90; 93.844; 90
1107.86Roy, Monalisa; Li, Keyao; Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D.
Varying degrees of homostructurality in a series of cocrystals of antimalarial drug 11-azaartemisinin with salicylic acids
Acta Crystallographica Section C, 2021, 77, 262-270
2022374 CIF
HKL
Paper
C22 H27 Br2 N O7P 1 21 19.522; 9.3214; 13.3453
90; 99.6446; 90
1167.77Roy, Monalisa; Li, Keyao; Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D.
Varying degrees of homostructurality in a series of cocrystals of antimalarial drug 11-azaartemisinin with salicylic acids
Acta Crystallographica Section C, 2021, 77, 262-270
2022375 CIF
HKL
Paper
C22 H28 Br N O7P 1 21 111.0814; 9.28293; 11.1404
90; 98.638; 90
1132.99Roy, Monalisa; Li, Keyao; Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D.
Varying degrees of homostructurality in a series of cocrystals of antimalarial drug 11-azaartemisinin with salicylic acids
Acta Crystallographica Section C, 2021, 77, 262-270
2022376 CIF
HKL
Paper
C32 H24 Cd N4 O5P 4310.6631; 10.6631; 25.203
90; 90; 90
2865.6Wu, Ji-Pei; Cheng, Yi-Chuan; Lu, Lei; Wang, Jun; Qiao, Shan-Bao
A fourfold interpenetrating three-dimensional cadmium(II) coordination polymer: synthesis, crystal structure and physical properties
Acta Crystallographica Section C, 2021, 77, 257-261
2022378 CIF
HKL
Paper
C12 H8 N2 O4 SeP -17.653; 7.8066; 11.5939
76.603; 88.358; 61.263
588.04Saravanan, Raju; Singh, Harkesh B.; Butcher, Ray J.
Bis(2-nitrophenyl) selenide, bis(2-aminophenyl) selenide and bis(2-aminophenyl) telluride: structural and theoretical analysis
Acta Crystallographica Section C, 2021, 77
2022379 CIF
HKL
Paper
C12 H12 N2 SeP 1 21/n 18.4557; 7.053; 18.0521
90; 92.643; 90
1075.45Saravanan, Raju; Singh, Harkesh B.; Butcher, Ray J.
Bis(2-nitrophenyl) selenide, bis(2-aminophenyl) selenide and bis(2-aminophenyl) telluride: structural and theoretical analysis
Acta Crystallographica Section C, 2021, 77
2022380 CIF
HKL
Paper
C12 H12 N2 TeP -17.0048; 8.6062; 10.1392
66.164; 88.628; 88.78
558.9Saravanan, Raju; Singh, Harkesh B.; Butcher, Ray J.
Bis(2-nitrophenyl) selenide, bis(2-aminophenyl) selenide and bis(2-aminophenyl) telluride: structural and theoretical analysis
Acta Crystallographica Section C, 2021, 77
2022381 CIF
HKL
C23 H29 O12.5 Pb2P 1 21/n 111.607; 14.951; 15.017
90; 100.287; 90
2564.1Sun, Yanwen; Chen, Zhen; Wang, Xiaozhong; Wang, Lei; Yang, Xue; Liang, Xiaoting; Fan, Shuangshuang; Zhang, Peiran
Novel Ba^2+^ and Pb^2+^ metal‒organic frameworks based on a semi-rigid tetracarboxylic acid: syntheses, structures, topologies and luminescence properties
Acta Crystallographica Section C, 2021, 77, 291-298
2022382 CIF
HKL
Paper
C26 H41 Ba2 N O16P 1 21/n 115.826; 13.033; 16.03
90; 93.074; 90
3301.6Sun, Yanwen; Chen, Zhen; Wang, Xiaozhong; Wang, Lei; Yang, Xue; Liang, Xiaoting; Fan, Shuangshuang; Zhang, Peiran
Novel Ba^2+^ and Pb^2+^ metal‒organic frameworks based on a semi-rigid tetracarboxylic acid: syntheses, structures, topologies and luminescence properties
Acta Crystallographica Section C, 2021, 77, 291-298
2022383 CIF
HKL
Paper
C17 H17 N O3P 1 21/c 111.675; 8.6138; 14.1504
90; 90.075; 90
1423.05Bargavi, Srinivasan; Gouthaman, Siddan; Sugunalakshmi, Madurai; Lakshmi, Srinivasakannan
Synthesis, spectroscopic investigation, crystal structure analysis, quantum chemical study, biological activity and molecular docking of three isatin derivatives
Acta Crystallographica Section C, 2021, 77
2022384 CIF
HKL
Paper
C16 H17 N O3P 1 21/n 18.9227; 12.8741; 12.5994
90; 93.897; 90
1443.97Bargavi, Srinivasan; Gouthaman, Siddan; Sugunalakshmi, Madurai; Lakshmi, Srinivasakannan
Synthesis, spectroscopic investigation, crystal structure analysis, quantum chemical study, biological activity and molecular docking of three isatin derivatives
Acta Crystallographica Section C, 2021, 77
2022385 CIF
HKL
Paper
C15 H14 Br N O3P n a 217.896; 19.6458; 9.1088
90; 90; 90
1412.99Bargavi, Srinivasan; Gouthaman, Siddan; Sugunalakshmi, Madurai; Lakshmi, Srinivasakannan
Synthesis, spectroscopic investigation, crystal structure analysis, quantum chemical study, biological activity and molecular docking of three isatin derivatives
Acta Crystallographica Section C, 2021, 77
2022387 CIF
HKL
Paper
C37 H34 Cu I N2 P2 SP -19.7713; 11.8827; 16.0872
85.185; 80.369; 69.634
1725.76Liang, Yu; Wang, Jian-Teng; Song, Li; Dai, Ding-Qiu; Wang, You-Yu; Chai, Wen-Xiang
Structural, spectroscopic and DFT theoretical studies of phosphorescent CuIP~2~S-containing cuprous complexes
Acta Crystallographica Section C, 2021, 77
2022388 CIF
HKL
Paper
C43 H36 Cu I N2 P2 SP 1 21/n 110.9718; 15.9975; 44.0539
90; 95.2989; 90
7699.4Liang, Yu; Wang, Jian-Teng; Song, Li; Dai, Ding-Qiu; Wang, You-Yu; Chai, Wen-Xiang
Structural, spectroscopic and DFT theoretical studies of phosphorescent CuIP~2~S-containing cuprous complexes
Acta Crystallographica Section C, 2021, 77
2022389 CIF
HKL
Paper
C10 H11 Cl2 N3 ZnP -17.4115; 8.5345; 10.779
89.682; 72.145; 71.405
611.87Małecka, Magdalena; Kusz, Joachim; Mayer, Peter; Sobiesiak, Marta; Budzisz, Elzbieta
Zinc(II) and nickel(II) complexes of 3,5-dimethyl-1-(pyridin-2-yl)-1H-pyrazole: relationship between fluorescence and crystal packing
Acta Crystallographica Section C Structural Chemistry, 2021, 77
2022390 CIF
HKL
Paper
C20 H26 Cl2 N6 Ni O2P 1 21/c 112.2306; 13.2638; 14.056
90; 100.981; 90
2238.5Małecka, Magdalena; Kusz, Joachim; Mayer, Peter; Sobiesiak, Marta; Budzisz, Elzbieta
Zinc(II) and nickel(II) complexes of 3,5-dimethyl-1-(pyridin-2-yl)-1H-pyrazole: relationship between fluorescence and crystal packing
Acta Crystallographica Section C Structural Chemistry, 2021, 77
2022391 CIF
HKL
Paper
C32 H72.64 Cl Eu3 N8 Na O32.04P -19.2252; 16.937; 17.274
96.37; 92.39; 93.26
2674.9Thomsen, Maria Storm; Madsen, Anders Ø.; Sørensen, Thomas Just
Crystal structure and optical properties of a two-sited Eu^III^ compound: an Eu^III^ ion coordinated by two [Eu^III^(DOTA)]^{-^} complexes (DOTA is 1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetate)
Acta Crystallographica Section C, 2021, 77
2022392 CIF
Paper
C33 H22 OP -19.99; 10.7; 11.016
80.865; 73.669; 82.3
1110.7Shi, Linqi; Sun, Zipei; Tian, Jiajie; Huang, Yaodong; Meng, Jiben
Study of naphthopyran derivatives: structure and photochromic properties in solution and in polymer film
Acta Crystallographica Section C, 2021, 77
2022393 CIF
Paper
C37 H26 OP 1 21/n 110.96; 23.88; 20.385
90; 103.941; 90
5178Shi, Linqi; Sun, Zipei; Tian, Jiajie; Huang, Yaodong; Meng, Jiben
Study of naphthopyran derivatives: structure and photochromic properties in solution and in polymer film
Acta Crystallographica Section C, 2021, 77
2022394 CIF
HKL
Paper
C24 H48 Cl4 O7 Ti2C 1 2/c 119.1347; 9.1227; 18.7937
90; 102.092; 90
3207.84Bloomfield, Hannah R.; Hollett, Joshua W.; Ritch, Jamie S.
Crystal structure and computational study of an oxo-bridged bis-titanium(III) complex
Acta Crystallographica Section C, 2021, 77
2022395 CIF
HKL
Paper
C16 H22 Br2 Cu N14 O4C 1 c 111.062; 8.369; 27.406
90; 92.44; 90
2534.9Parisi, Emmanuele; Centore, Roberto
Stabilization of an elusive tautomer by metal coordination
Acta Crystallographica Section C, 2021, 77
2022396 CIF
HKL
Paper
C16 H16 Br2 N14 O ZnP -18.396; 12.305; 12.724
112.53; 107.78; 92.16
1138.2Parisi, Emmanuele; Centore, Roberto
Stabilization of an elusive tautomer by metal coordination
Acta Crystallographica Section C, 2021, 77
2022397 CIF
HKL
Paper
C24 H34 Cl N O2P 1 21/c 113.4563; 10.7847; 15.5656
90; 104.341; 90
2188.5Hudnall, Todd W.; Reinheimer, Eric W.; Dorsey, Christopher L.
Synthesis, crystal structure determination, and spectroscopic analyses of 1-chloro-2-(2,6-diisopropylphenyl)-4,4-dimethyl-2-azaspiro[5.5]undecane-3,5-dione: an unyielding precursor to a cyclic (alkyl)(amido)carbene
Acta Crystallographica Section C, 2021, 77
2022398 CIF
HKL
Paper
C6 H56 N2 Na5 O46 Sb W6C 1 2/c 121.9761; 13.9179; 16.209
90; 111.189; 90
4622.5Sifaki, Kleanthi; Gumerova, Nadiia I.; Giester, Gerald; Rompel, Annette
Synthesis and characterization of the Anderson‒Evans tungstoantimonate [Na~5~(H~2~O)~18~{(HOCH~2~)~2~CHNH~3~}~2~][SbW~6~O~24~]
Acta Crystallographica Section C, 2021, 77
2022399 CIF
HKL
Paper
C63 H66 N14 O24 ZnP 1 21 110.5897; 22.8595; 14.3102
90; 92.524; 90
3460.78Perić, Berislav; Kokan, Zoran; Kirin, Srećko I.
Induction of Λ-helicity in a zinc complex with an alanine-appended aminopyridine ligand
Acta Crystallographica Section C, 2021, 77
2022400 CIF
HKL
Paper
C29 H34 Cl2 N4 O3P 1 21/n 18.9645; 33.8111; 9.2237
90; 98.698; 90
2763.55Żesławska, Ewa; Szymańska, Ewa; Nitek, Wojciech; Handzlik, Jadwiga
Crystallographic studies of piperazine derivatives of 3-methyl-5-spirofluorenehydantoin in search of structural features of P-gp inhibitors
Acta Crystallographica Section C, 2021, 77
2022401 CIF
HKL
Paper
C29 H31 N5 O5P 1 21/c 121.7033; 7.219; 16.821
90; 103.464; 90
2563.02Żesławska, Ewa; Szymańska, Ewa; Nitek, Wojciech; Handzlik, Jadwiga
Crystallographic studies of piperazine derivatives of 3-methyl-5-spirofluorenehydantoin in search of structural features of P-gp inhibitors
Acta Crystallographica Section C, 2021, 77
2022402 CIF
HKL
Paper
C31 H33 N5 O4P 1 21/n 18.8799; 23.555; 13.2498
90; 99.072; 90
2736.74Żesławska, Ewa; Szymańska, Ewa; Nitek, Wojciech; Handzlik, Jadwiga
Crystallographic studies of piperazine derivatives of 3-methyl-5-spirofluorenehydantoin in search of structural features of P-gp inhibitors
Acta Crystallographica Section C, 2021, 77
2022403 CIF
HKL
Paper
C32 H39.23 Cl2 N4 O2.61P 1 21/c 111.8717; 33.6944; 7.6888
90; 102.259; 90
3005.46Żesławska, Ewa; Szymańska, Ewa; Nitek, Wojciech; Handzlik, Jadwiga
Crystallographic studies of piperazine derivatives of 3-methyl-5-spirofluorenehydantoin in search of structural features of P-gp inhibitors
Acta Crystallographica Section C, 2021, 77
2022404 CIF
HKL
Paper
C36 H30 N12 S12P -19.8898; 15.8351; 16.4327
111.84; 99.655; 104.689
2210.08Wzgarda-Raj, Kinga; Ksiażkiewicz, Olga; Palusiak, Marcin
A rare case of a 2:2:1 ternary cocrystal of pyridine sulfides and trithiocyanuric acid
Acta Crystallographica Section C, 2021, 77
2022405 CIF
HKL
Paper
C30 H17 F3 N2 O2P -18.0037; 12.1365; 13.4922
104.697; 103.023; 106.619
1150.3Bosch, Eric; Bowling, Nathan P.; Oburn, Shalisa M.
Conformational control through co-operative nonconventional C—H···N hydrogen bonds
Acta Crystallographica Section C, 2021, 77
2022406 CIF
HKL
Paper
C9 H18 O5I 1 2 113.7349; 5.0575; 16.08
90; 109.02; 90
1056Lin, Jieye; Oliver, Allen G.; Meredith, Reagan J.; Carmichael, Ian; Serianni, Anthony S.
Isopropyl 3-deoxy-α-<small>D</small>-<i>ribo</i>-hexopyranoside (isopropyl 3-deoxy-α-<small>D</small>-glucopyranoside): evaluating trends in structural parameters
Acta Crystallographica Section C, 2021, 77
2022407 CIF
HKL
Paper
C23 H21 F N2 O4P -18.144; 8.4565; 14.9945
87.549; 79.926; 68.467
945.52Romo, Pablo E.; Quiroga, Jairo; Cobo, Justo; Glidewell, Christopher
Synthesis and spectroscopic and structural characterization of spiro[indoline-3,3′-indolizine]s formed by 1,3-dipolar cycloadditions between isatins, pipecolic acid and an electron-deficient alkene
Acta Crystallographica Section C Structural Chemistry, 2021, 77
2022408 CIF
HKL
Paper
C24 H24 N2 O4P -18.1874; 8.5015; 15.5775
85.775; 77.641; 68.022
982.15Romo, Pablo E.; Quiroga, Jairo; Cobo, Justo; Glidewell, Christopher
Synthesis and spectroscopic and structural characterization of spiro[indoline-3,3′-indolizine]s formed by 1,3-dipolar cycloadditions between isatins, pipecolic acid and an electron-deficient alkene
Acta Crystallographica Section C Structural Chemistry, 2021, 77
2022409 CIF
HKL
Paper
C24 H24 N2 O4P -18.6535; 9.2064; 14.4327
72.66; 74.539; 65.93
988.16Romo, Pablo E.; Quiroga, Jairo; Cobo, Justo; Glidewell, Christopher
Synthesis and spectroscopic and structural characterization of spiro[indoline-3,3′-indolizine]s formed by 1,3-dipolar cycloadditions between isatins, pipecolic acid and an electron-deficient alkene
Acta Crystallographica Section C Structural Chemistry, 2021, 77
2022410 CIF
HKL
Paper
C24 H23 Cl N2 O4P -18.7914; 9.3155; 14.6188
73.437; 76.259; 64.156
1023.83Romo, Pablo E.; Quiroga, Jairo; Cobo, Justo; Glidewell, Christopher
Synthesis and spectroscopic and structural characterization of spiro[indoline-3,3′-indolizine]s formed by 1,3-dipolar cycloadditions between isatins, pipecolic acid and an electron-deficient alkene
Acta Crystallographica Section C Structural Chemistry, 2021, 77
2022411 CIF
HKL
Paper
C29 H34 N2 O4P 1 21/n 111.0442; 17.4707; 13.0081
90; 90.215; 90
2509.89Romo, Pablo E.; Quiroga, Jairo; Cobo, Justo; Glidewell, Christopher
Synthesis and spectroscopic and structural characterization of spiro[indoline-3,3′-indolizine]s formed by 1,3-dipolar cycloadditions between isatins, pipecolic acid and an electron-deficient alkene
Acta Crystallographica Section C Structural Chemistry, 2021, 77
2022412 CIF
HKL
Paper
C20 H20 O8P -14.97902; 18.5654; 19.1368
89.5065; 84.322; 89.375
1760.12Toklo, Placide M.; Yayi Ladekan, Eléonore; Linden, Anthony; Hounzangbe-Adote, Sylvie; Kouam, Siméon F.; Gbenou, Joachim D.
Anthelmintic flavonoids and other compounds from <i>Combretum glutinosum</i> Perr. ex DC (Combretaceae) leaves
Acta Crystallographica Section C, 2021, 77
2022413 CIF
HKL
Paper
C30 H50 O3P 21 21 216.37386; 12.10746; 33.8928
90; 90; 90
2615.55Toklo, Placide M.; Yayi Ladekan, Eléonore; Linden, Anthony; Hounzangbe-Adote, Sylvie; Kouam, Siméon F.; Gbenou, Joachim D.
Anthelmintic flavonoids and other compounds from <i>Combretum glutinosum</i> Perr. ex DC (Combretaceae) leaves
Acta Crystallographica Section C, 2021, 77
2022414 CIF
HKL
Paper
C125 H116 K6 O8 Si6P -113.081; 14.96; 31.017
82.52; 87.24; 69.51
5637.4Wytrych, Patrycja; Utko, Józef; Lis, Tadeusz; John, Łukasz
Polyoxometalate-like structure of new potassium triphenylsiloxides: [K~6~(OSiPh~3~)~6~(C~3~H~7~OH)(H~2~O)]·2C~6~H~5~CH~3~ and [K~6~(OSiPh~3~)~6~(H~2~O)~2~]
Acta Crystallographica Section C, 2021, 77
2022415 CIF
HKL
Paper
C108 H94 K6 O8 Si6P -112.7633; 14.7076; 28.183
89.61; 78.98; 73.26
4966.3Wytrych, Patrycja; Utko, Józef; Lis, Tadeusz; John, Łukasz
Polyoxometalate-like structure of new potassium triphenylsiloxides: [K~6~(OSiPh~3~)~6~(C~3~H~7~OH)(H~2~O)]·2C~6~H~5~CH~3~ and [K~6~(OSiPh~3~)~6~(H~2~O)~2~]
Acta Crystallographica Section C, 2021, 77
2022416 CIF
Paper
C21 H16 F3 N3 OP 3117.1109; 17.1109; 5.4205
90; 90; 120
1374.41Wolińska, Ewa; Wysocki, Waldemar; Branowska, Danuta; Karczmarzyk, Zbigniew
Synthesis and structures of three new pyridine-containing oxazoline ligands of complexes for asymmetric catalysis
Acta Crystallographica Section C, 2021, 77
2022417 CIF
Paper
C18 H17 F4 N3 OP 1 21 17.9933; 24.1126; 9.1926
90; 105.003; 90
1711.38Wolińska, Ewa; Wysocki, Waldemar; Branowska, Danuta; Karczmarzyk, Zbigniew
Synthesis and structures of three new pyridine-containing oxazoline ligands of complexes for asymmetric catalysis
Acta Crystallographica Section C, 2021, 77
2022418 CIF
Paper
C22 H16 F3 N3 OP 1 21 14.933; 10.9919; 17.4202
90; 94.718; 90
941.38Wolińska, Ewa; Wysocki, Waldemar; Branowska, Danuta; Karczmarzyk, Zbigniew
Synthesis and structures of three new pyridine-containing oxazoline ligands of complexes for asymmetric catalysis
Acta Crystallographica Section C, 2021, 77
2022419 CIF
HKL
Paper
C19 H32P 1 21 17.4417; 9.8831; 43.0002
90; 92.742; 90
3158.92Crittenden, Christopher M.; DiPasquale, Antonio G.
Two crystallographic forms and the absolute structure of 5α,14α-androstane
Acta Crystallographica Section C, 2021, 77
2022420 CIF
HKL
Paper
C57 H94 OP 21 21 217.1699; 22.148; 29.8734
90; 90; 90
4743.86Crittenden, Christopher M.; DiPasquale, Antonio G.
Two crystallographic forms and the absolute structure of 5α,14α-androstane
Acta Crystallographica Section C, 2021, 77
2022421 CIF
HKL
Paper
C19 H32P 21 21 217.1465; 22.2064; 30.0679
90; 90; 90
4771.72Crittenden, Christopher M.; DiPasquale, Antonio G.
Two crystallographic forms and the absolute structure of 5α,14α-androstane
Acta Crystallographica Section C, 2021, 77
2022422 CIF
HKL
Paper
C40 H53 B Fe O S3P -110.6835; 12.8042; 15.795
77.614; 75.849; 70.332
1952.1Wang, Peng; Yap, Glenn P. A.; Riordan, Charles G.
Iron(II)‒alkoxide and ‒aryloxide complexes of a tris(thioether)borate ligand: synthesis, molecular structures, and implications on the origin of instability of their iron(II)‒catecholate counterpart
Acta Crystallographica Section C, 2021, 77
2022423 CIF
HKL
Paper
C29 H47 B Fe O S3C 1 2/c 111.496; 15.036; 36.375
90; 91.664; 90
6284.9Wang, Peng; Yap, Glenn P. A.; Riordan, Charles G.
Iron(II)‒alkoxide and ‒aryloxide complexes of a tris(thioether)borate ligand: synthesis, molecular structures, and implications on the origin of instability of their iron(II)‒catecholate counterpart
Acta Crystallographica Section C, 2021, 77
2022424 CIF
HKL
Paper
C68 H102 B2 Fe2 O2 S6P -110.359; 13.084; 13.98
71.048; 87.964; 82.954
1778.5Wang, Peng; Yap, Glenn P. A.; Riordan, Charles G.
Iron(II)‒alkoxide and ‒aryloxide complexes of a tris(thioether)borate ligand: synthesis, molecular structures, and implications on the origin of instability of their iron(II)‒catecholate counterpart
Acta Crystallographica Section C, 2021, 77
2022425 CIF
HKL
Paper
C42 H74 B2 Co2 O4 S6P 1 21/n 114.409; 9.494; 18.745
90; 90.938; 90
2564Wang, Peng; Yap, Glenn P. A.; Riordan, Charles G.
Iron(II)‒alkoxide and ‒aryloxide complexes of a tris(thioether)borate ligand: synthesis, molecular structures, and implications on the origin of instability of their iron(II)‒catecholate counterpart
Acta Crystallographica Section C, 2021, 77
2022426 CIF
HKL
Paper
C26 H12 N4P 1 21/c 17.3192; 8.2802; 31.3093
90; 90.162; 90
1897.5Wu, Pengfei; Zhou, Long; Xia, Shuwei; Yu, Liangmin
Synthesis of luminescent cocrystals based on fluoranthene and the analysis of weak interactions and photophysical properties
Acta Crystallographica Section C, 2021, 77
2022427 CIF
HKL
Paper
C24 H10 F4 N2P 1 21/c 115.4617; 7.0577; 16.9113
90; 95.095; 90
1838.1Wu, Pengfei; Zhou, Long; Xia, Shuwei; Yu, Liangmin
Synthesis of luminescent cocrystals based on fluoranthene and the analysis of weak interactions and photophysical properties
Acta Crystallographica Section C, 2021, 77
2022428 CIF
HKL
Paper
C26 H10 F8P 1 21 16.773; 14.323; 10.02
90; 99.732; 90
958Wu, Pengfei; Zhou, Long; Xia, Shuwei; Yu, Liangmin
Synthesis of luminescent cocrystals based on fluoranthene and the analysis of weak interactions and photophysical properties
Acta Crystallographica Section C, 2021, 77
2022429 CIF
HKL
Paper
C29 H32 N2 O6P 21 21 218.6256; 9.668; 30.557
90; 90; 90
2548.2Harris, Nehemiah; Benedict, Jubilee; Dickie, Diane A.; Pagola, Silvina
Mechanochemical synthesis insights and solid-state characterization of quininium aspirinate, a glass-forming drug‒drug salt
Acta Crystallographica Section C, 2021, 77
2022430 CIF
HKL
Paper
C24 H40 N4 O16 S2C 1 2 19.7415; 16.3378; 9.6396
90; 91.68; 90
1533.53Santana, Carlos L.; Reinheimer, Eric W.; Groeneman, Ryan H.
Square network based upon the molecular salt of the tetraprotonated photoproduct <i>rtct</i>-tetrakis(pyridin-4-yl)cyclobutane and the sulfate anion
Acta Crystallographica Section C, 2021, 77
2022431 CIF
HKL
Paper
C78 H126 N4 O7 Sb2P 1 21/c 121.243; 18.997; 21.743
90; 118.6; 90
7704Al-Dabbagh, Areej; Guo, Zhifang; Junk, Peter; Wang, Jun
Synthesis and characterization of a range of antimony(I/III) <i>N</i>,<i>N</i>'-bis(2,6-diisopropylphenyl)formamidinate complexes
Acta Crystallographica Section C, 2021, 77
2022432 CIF
HKL
Paper
C50 H70 Cl N4 SbP 1 21/c 118.443; 20.455; 12.817
90; 97.46; 90
4794.3Al-Dabbagh, Areej; Guo, Zhifang; Junk, Peter; Wang, Jun
Synthesis and characterization of a range of antimony(I/III) <i>N</i>,<i>N</i>'-bis(2,6-diisopropylphenyl)formamidinate complexes
Acta Crystallographica Section C, 2021, 77
2022433 CIF
HKL
Paper
C50 H70 Br N4 SbP 1 21/c 118.7239; 20.5497; 12.9785
90; 96.886; 90
4957.7Al-Dabbagh, Areej; Guo, Zhifang; Junk, Peter; Wang, Jun
Synthesis and characterization of a range of antimony(I/III) <i>N</i>,<i>N</i>'-bis(2,6-diisopropylphenyl)formamidinate complexes
Acta Crystallographica Section C, 2021, 77
2022434 CIF
HKL
Paper
C50 H70 I N4 SbP 1 21/c 118.616; 20.713; 12.9942
90; 96.75; 90
4975.7Al-Dabbagh, Areej; Guo, Zhifang; Junk, Peter; Wang, Jun
Synthesis and characterization of a range of antimony(I/III) <i>N</i>,<i>N</i>'-bis(2,6-diisopropylphenyl)formamidinate complexes
Acta Crystallographica Section C, 2021, 77
2022435 CIF
HKL
Paper
C25 H35 Br2 N2 SbP -110.105; 10.332; 14.24
96.69; 103.93; 111.72
1305.2Al-Dabbagh, Areej; Guo, Zhifang; Junk, Peter; Wang, Jun
Synthesis and characterization of a range of antimony(I/III) <i>N</i>,<i>N</i>'-bis(2,6-diisopropylphenyl)formamidinate complexes
Acta Crystallographica Section C, 2021, 77
2022436 CIF
HKL
Paper
C25 H35 I2 N2 SbP -110.4137; 10.5559; 14.6097
95.876; 104.946; 111.754
1405.65Al-Dabbagh, Areej; Guo, Zhifang; Junk, Peter; Wang, Jun
Synthesis and characterization of a range of antimony(I/III) <i>N</i>,<i>N</i>'-bis(2,6-diisopropylphenyl)formamidinate complexes
Acta Crystallographica Section C, 2021, 77
2022438 CIF
HKL
Paper
C9 H8 F4 I2 N2 SP 1 21/c 112.1701; 7.9283; 14.3228
90; 98.898; 90
1365.35Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T.
The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding
Acta Crystallographica Section C, 2021, 77
2022439 CIF
HKL
Paper
C7 H4 F4 I2 N2 SP b c a8.5853; 11.6911; 23.4148
90; 90; 90
2350.2Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T.
The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding
Acta Crystallographica Section C, 2021, 77
2022440 CIF
HKL
Paper
C9 H8 F4 I2 N2 SP -17.1432; 7.8452; 13.7688
83.922; 76.598; 69.092
700.94Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T.
The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding
Acta Crystallographica Section C, 2021, 77
2022441 CIF
HKL
Paper
C10 H12 F4 I2 N2 O SC 1 2/c 119.3088; 7.3062; 22.8048
90; 93.93; 90
3209.6Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T.
The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding
Acta Crystallographica Section C, 2021, 77
2022442 CIF
HKL
Paper
C11 H14 F4 I2 N2 O SC 1 2/c 120.3027; 7.5161; 22.5373
90; 93.872; 90
3431.28Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T.
The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding
Acta Crystallographica Section C, 2021, 77
2022443 CIF
HKL
Paper
C9 H8 F4 I2 N2 SC 1 2/c 126.134; 7.4435; 14.732
90; 104.65; 90
2772.6Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T.
The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding
Acta Crystallographica Section C, 2021, 77
2022444 CIF
HKL
Paper
C9 H8 F3 I3 N2 SP -17.5014; 9.1065; 11.8534
79.871; 83.011; 74.41
765.41Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T.
The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding
Acta Crystallographica Section C, 2021, 77
2022445 CIF
HKL
Paper
C5 H8 I4 N2 SC 1 2/c 122.3783; 4.32943; 14.67541
90; 107.243; 90
1357.93Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T.
The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding
Acta Crystallographica Section C, 2021, 77
2022446 CIF
HKL
Paper
C10 H14 I8 N2 O SP -17.7715; 12.3862; 14.129
78.476; 79.61; 74.766
1273.99Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T.
The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding
Acta Crystallographica Section C, 2021, 77
2022447 CIF
HKL
Paper
C14 H14 I14 N4 S2P 1 21/c 17.813; 30.677; 9.085
90; 113.429; 90
1998Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T.
The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding
Acta Crystallographica Section C, 2021, 77
2022448 CIF
HKL
Paper
C16 H24 I16 N8 S2P 1 21/n 17.6879; 16.2822; 19.0763
90; 94.074; 90
2381.86Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T.
The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding
Acta Crystallographica Section C, 2021, 77
2022449 CIF
HKL
Paper
C15 H30 N3 S6 SbP -110.0692; 14.3797; 17.3124
89.98; 80.578; 75.145
2387.95Ng, Seik Weng
Resolvable polymorphism in an intergrowth of two modifications of tris(diethyldithiocarbamato)antimony
Acta Crystallographica Section C, 2021, 77, 610-614
2022450 CIF
HKL
Paper
C15 H30 N3 S6 SbP 1 21/c 112.4204; 13.5117; 14.6614
90; 99.832; 90
2424.3Ng, Seik Weng
Resolvable polymorphism in an intergrowth of two modifications of tris(diethyldithiocarbamato)antimony
Acta Crystallographica Section C, 2021, 77, 610-614
2022451 CIF
HKL
Paper
C16 H11 Gd N2 O10C 1 2/c 125.725; 5.0236; 17.274
90; 127.393; 90
1773.6Wei, Wen-Wen; Lu, Li-Ping; Feng, Si-Si; Zhu, Miao-Li; Englert, Ulli
Synthesis, structure and magnetocaloric properties of a new two-dimensional gadolinium(III) coordination polymer based on azobenzene-2,2',3,3'-tetracarboxylic acid
Acta Crystallographica Section C, 2021, 77, 591-598
2022452 CIF
HKL
Paper
C11 H15 Cl N2R 3 c :H29.3337; 29.3337; 7.3922
90; 90; 120
5508.6Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
The crystalline forms of nine hydrochloride salts of substituted tryptamines
Acta Crystallographica Section C, 2021, 77
2022453 CIF
HKL
Paper
C17 H19 Cl N2P 1 21/n 110.399; 16.3016; 37.091
90; 97.963; 90
6227.1Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
The crystalline forms of nine hydrochloride salts of substituted tryptamines
Acta Crystallographica Section C, 2021, 77
2022454 CIF
HKL
Paper
C11 H15 Cl N2 OP 1 21/c 114.6858; 8.3613; 9.7878
90; 102.742; 90
1172.27Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
The crystalline forms of nine hydrochloride salts of substituted tryptamines
Acta Crystallographica Section C, 2021, 77
2022455 CIF
HKL
Paper
C10 H12 Br Cl N2P b c a8.6153; 9.3766; 29.173
90; 90; 90
2356.7Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
The crystalline forms of nine hydrochloride salts of substituted tryptamines
Acta Crystallographica Section C, 2021, 77
2022456 CIF
HKL
Paper
C10 H12 Cl2 N2P 1 21/c 114.703; 8.6058; 9.4141
90; 106.45; 90
1142.42Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
The crystalline forms of nine hydrochloride salts of substituted tryptamines
Acta Crystallographica Section C, 2021, 77
2022457 CIF
HKL
Paper
C10 H12 Cl F N2P b c a8.6708; 9.6684; 25.6854
90; 90; 90
2153.28Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
The crystalline forms of nine hydrochloride salts of substituted tryptamines
Acta Crystallographica Section C, 2021, 77
2022458 CIF
HKL
Paper
C11 H15 Cl N2P 1 21/c 114.9939; 8.427; 9.5388
90; 107.774; 90
1147.73Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
The crystalline forms of nine hydrochloride salts of substituted tryptamines
Acta Crystallographica Section C, 2021, 77
2022459 CIF
HKL
Paper
C10 H12 Cl F N2P b c a8.3572; 10.3493; 24.3824
90; 90; 90
2108.86Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
The crystalline forms of nine hydrochloride salts of substituted tryptamines
Acta Crystallographica Section C, 2021, 77
2022460 CIF
HKL
Paper
C11 H15 Cl N2P b c a9.1893; 9.3259; 27.5149
90; 90; 90
2358Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
The crystalline forms of nine hydrochloride salts of substituted tryptamines
Acta Crystallographica Section C, 2021, 77

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