Crystallography Open Database

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2021808 CIF
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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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