Crystallography Open Database

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2018805 CIF
HKL
Paper
C16 H19 N5 O3P 1 21/c 115.636; 6.5674; 17.336
90; 113.44; 90
1633.3Acosta, Lina M.; Yepes, Andrés F.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Six closely related 4,6-disubstituted 2-amino-5-formylpyrimidines: different ring conformations, polarized electronic structures, and hydrogen-bonded assembly in zero, one, two and three dimensions
Acta Crystallographica Section C, 2013, 69, 162-171
2018806 CIF
HKL
Paper
C18 H23 N5 O3C 1 2/c 124.8226; 7.1379; 20.601
90; 106.213; 90
3504.9Acosta, Lina M.; Yepes, Andrés F.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Six closely related 4,6-disubstituted 2-amino-5-formylpyrimidines: different ring conformations, polarized electronic structures, and hydrogen-bonded assembly in zero, one, two and three dimensions
Acta Crystallographica Section C, 2013, 69, 162-171
2018807 CIF
HKL
Paper
C15 H23 N5 O3P -18.04; 10.391; 10.458
109.16; 98.19; 103.1
781.2Acosta, Lina M.; Yepes, Andrés F.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Six closely related 4,6-disubstituted 2-amino-5-formylpyrimidines: different ring conformations, polarized electronic structures, and hydrogen-bonded assembly in zero, one, two and three dimensions
Acta Crystallographica Section C, 2013, 69, 162-171
2018808 CIF
HKL
Paper
C50 H58 Cl4 N6 O12P -17.9609; 11.2732; 15.8323
101.794; 95.41; 109.767
1288.2Freire, Eleonora; Polla, Griselda; Baggio, Ricardo
Aripiprazole salts. III. Bis(aripiprazolium) oxalate‒oxalic acid (1/1)
Acta Crystallographica Section C, 2013, 69, 186-190
2018809 CIF
HKL
Paper
C11 H9 F3 N4 O2P -14.957; 8.737; 13.562
93.22; 97.02; 91.05
581.8Portilla, Jaime; Ontiveros, Ina; Cobo, Justo; Glidewell, Christopher
5-Methyl-<i>N</i>-[2-nitro-4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazole-3-amine: a chain of hydrogen-bonded <i>R</i>~2~^2^(6) and <i>R</i>~2~^2^(16) rings
Acta Crystallographica Section C, 2013, 69, 172-174
2018810 CIF
Paper
C5 H10 N2 O7 P2P 1 21/c 16.8162; 10.6307; 13.924
90; 96.954; 90
1001.5Chernyshev, Vladimir V.; Shkavrov, Sergey V.; Paseshnichenko, Ksenia A.; Puryaeva, Tamara P.; Velikodny, Yurii A.
Zoledronic acid: monoclinic and triclinic polymorphs from powder diffraction data
Acta Crystallographica Section C, 2013, 69, 263-266
2018811 CIF
Paper
C5 H10 N2 O7 P2P -18.4217; 8.6039; 8.1818
92.778; 112.415; 116.072
475.33Chernyshev, Vladimir V.; Shkavrov, Sergey V.; Paseshnichenko, Ksenia A.; Puryaeva, Tamara P.; Velikodny, Yurii A.
Zoledronic acid: monoclinic and triclinic polymorphs from powder diffraction data
Acta Crystallographica Section C, 2013, 69, 263-266
2018812 CIF
HKL
Paper
C19 H16 O7P -17.5894; 10.55; 11.238
62.88; 71.89; 77.782
758.6Karmakar, Anirban; Platero-Prats, Ana E.; Öhrström, Lars
A new methanol solvate and Hirshfeld analysis of π-stacking in 2,3,6,7,10,11-hexahydroxytriphenylene solvates
Acta Crystallographica Section C, 2013, 69, 251-254
2018813 CIF
HKL
Paper
C19 Cl15C 1 2/c 113.718; 11.542; 17.946
90; 108.134; 90
2700Guasch, Judith; Fontrodona, Xavier; Ratera, Imma; Rovira, Concepció; Veciana, Jaume
The perchlorotriphenylmethyl (PTM) radical
Acta Crystallographica Section C, 2013, 69, 255-257
2018814 CIF
HKL
Paper
C36 H46 Co N8 O10P -110.0002; 10.1568; 10.2186
89.906; 66.363; 75.805
916.32Nazarenko, Olga M.; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V.
Cobalt(II) and cadmium(II) square grids supported with 4,4'-bipyrazole and accommodating 3-carboxyadamantane-1-carboxylate
Acta Crystallographica Section C, 2013, 69, 232-236
2018815 CIF
HKL
Paper
C36 H46 Cd N8 O10C 1 2/c 114.5363; 14.9862; 18.3813
90; 105.384; 90
3860.8Nazarenko, Olga M.; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V.
Cobalt(II) and cadmium(II) square grids supported with 4,4'-bipyrazole and accommodating 3-carboxyadamantane-1-carboxylate
Acta Crystallographica Section C, 2013, 69, 232-236
2018816 CIF
HKL
Paper
C38 H98 Cl2 Mn N10 O10 P4P -110.978; 12.7452; 12.7755
63.131; 68.173; 83.141
1477.67Tarahhomi, Atekeh; Pourayoubi, Mehrdad; Fejfarová, Karla; Dušek, Michal
A novel amido‒pyrophosphate Mn^II^ chelate complex with the synthetic ligand O{P(O)[NHC(CH~3~)~3~]~2~}~2~ (<i>L</i>): [Mn(<i>L</i>)~2~{OC(H)N(CH~3~)~2~}~2~]Cl~2~·2H~2~O
Acta Crystallographica Section C, 2013, 69, 225-228
2018817 CIF
HKL
Paper
C32 H52.68 Co4 N24 O24.35C 1 2/c 110.548; 18.669; 24.795
90; 92.687; 90
4877.3Atria, Ana María; Parada, José; Garland, Maria Teresa; Baggio, Ricardo
A polymeric cobalt(II) complex derived from citric acid (H~4~cit) and 2,6-diaminopurine (dap): {[Co~4~(cit)~2~(dap)~4~(H~2~O)~4~]·6.35H~2~O}~<i>n~</i>
Acta Crystallographica Section C, 2013, 69, 212-215
2018818 CIF
Paper
C13 H14 N2 O7P 1 21 18.1032; 10.0065; 8.8704
90; 90.609; 90
719.21Fu, Ying; He, Yin-Xia; Hou, Hong-Xia; Zhu, Wen-Bo; Li, Hu-Lin; Wu, Chao; Xian, Fang-Yan
2,2'-Anhydro-1-(3',5'-di-<i>O</i>-acetyl-β-<small>D</small>-arabinofuranosyl)uracil, a cyclouridine nucleoside with a C4'-<i>endo</i> furanosyl conformation
Acta Crystallographica Section C, 2013, 69, 282-284
2018819 CIF
HKL
Paper
C21 H22 Br N O2R -3 :H29.8145; 29.8145; 10.2028
90; 90; 120
7854.3Brzezinski, Krzysztof; Lazny, Ryszard; Nodzewska, Aneta; Sidorowicz, Katarzyna
Relative configuration, absolute configuration and absolute structure of three isomeric 8-benzyl-2-[(4-bromophenyl)(hydroxy)methyl]-8-azabicyclo[3.2.1]octan-3-ones
Acta Crystallographica Section C, 2013, 69, 303-306
2018820 CIF
HKL
Paper
C21 H22 Br N O2P 21 21 215.96905; 14.7659; 20.76083
90; 90; 90
1829.83Brzezinski, Krzysztof; Lazny, Ryszard; Nodzewska, Aneta; Sidorowicz, Katarzyna
Relative configuration, absolute configuration and absolute structure of three isomeric 8-benzyl-2-[(4-bromophenyl)(hydroxy)methyl]-8-azabicyclo[3.2.1]octan-3-ones
Acta Crystallographica Section C, 2013, 69, 303-306
2018821 CIF
HKL
Paper
C21 H22 Br N O2P n a 219.0968; 32.068; 6.1711
90; 90; 90
1800.21Brzezinski, Krzysztof; Lazny, Ryszard; Nodzewska, Aneta; Sidorowicz, Katarzyna
Relative configuration, absolute configuration and absolute structure of three isomeric 8-benzyl-2-[(4-bromophenyl)(hydroxy)methyl]-8-azabicyclo[3.2.1]octan-3-ones
Acta Crystallographica Section C, 2013, 69, 303-306
2018822 CIF
HKL
Paper
C12 H10 Br4P -16.9532; 8.4323; 11.9669
94.706; 91.257; 110.892
652.31Boeré, René T.; Bender, Christopher O.
A tetrabromo-1,4-ethanonaphthalene and related dibromo-1,4-ethenonaphthalene
Acta Crystallographica Section C, 2013, 69, 247-250
2018823 CIF
HKL
Paper
C12 H8 Br2P 1 21/n 19.52; 6.5032; 17.124
90; 100.826; 90
1041.3Boeré, René T.; Bender, Christopher O.
A tetrabromo-1,4-ethanonaphthalene and related dibromo-1,4-ethenonaphthalene
Acta Crystallographica Section C, 2013, 69, 247-250
2018824 CIF
HKL
Paper
C10 H14P 1 21/c 19.0919; 6.0956; 8.9673
90; 114.986; 90
450.46Yufit, Dmitry S.
The low-melting compounds 1,4-diethyl-, 1,2-diethyl- and ethylbenzene
Acta Crystallographica Section C, 2013, 69, 273-276
2018825 CIF
HKL
Paper
C10 H14F d d 213.556; 15.931; 7.7562
90; 90; 90
1675Yufit, Dmitry S.
The low-melting compounds 1,4-diethyl-, 1,2-diethyl- and ethylbenzene
Acta Crystallographica Section C, 2013, 69, 273-276
2018826 CIF
HKL
Paper
C8 H10P 1 21/n 15.6138; 14.97; 8.0481
90; 102.18; 90
661.13Yufit, Dmitry S.
The low-melting compounds 1,4-diethyl-, 1,2-diethyl- and ethylbenzene
Acta Crystallographica Section C, 2013, 69, 273-276
2018827 CIF
HKL
Paper
C12 H30 Cd3 Cl8 N4 O2P 1 21/c 16.8035; 21.209; 9.0101
90; 92.64; 90
1298.7Zhou, Qin-Qin; Jin, Lei; Liao, Wei-Qiang; Zhang, Yi
A potential molecular ferroelectric material: poly[[bis(1-aza-4-azoniabicyclo[2.2.2]octane)di-μ~3~-chlorido-tetra-μ~2~-chlorido-dichloridotricadmium(II)] dihydrate]
Acta Crystallographica Section C, 2013, 69, 237-240
2018828 CIF
HKL
Paper
C30 H30 Cd N2 O9 SP 1 21/c 113.5444; 11.9489; 18.518
90; 105.826; 90
2883.4Wang, Jun; Tao, Jian-Qing; Xu, Xiao-Juan; Tan, Chun-Yun
A one-dimensional coordination polymer with a three-dimensional supramolecular framework: <i>catena</i>-poly[[[(3,4,7,8-tetramethyl-1,10-phenanthroline)cadmium(II)]-μ~3~-4,4'-sulfonyldibenzoato] trihydrate]
Acta Crystallographica Section C, 2013, 69, 241-243
2018829 CIF
HKL
Paper
C7 H12 N2 O8 S ZnP 1 21/c 113.365; 5.714; 15.357
90; 102.98; 90
1142.8Zasłona, Halina; Drożdżewski, Piotr; Barys, Maciej
A helical coordination polymer of zinc(II), 4-hydroxybenzohydrazide and sulfate ions
Acta Crystallographica Section C, 2013, 69, 229-231
2018830 CIF
Paper
C15 H23 Cl2 N3 O2 SP 1 21/c 114.4952; 16.5419; 7.9715
90; 90.858; 90
1911.2Chernyshev, Vladimir V.; Petkune, Sanita; Actins, Andris; Auzins, Raimonds; Davlyatshin, Dmitry I.; Nosyrev, Pavel V.; Velikodny, Yurii A.
Two polymorphs of afobazole from powder diffraction data
Acta Crystallographica Section C, 2013, 69, 299-302
2018831 CIF
Paper
C15 H23 Cl2 N3 O2 SP 1 21/c 19.791; 18.2689; 10.5687
90; 103.225; 90
1840.3Chernyshev, Vladimir V.; Petkune, Sanita; Actins, Andris; Auzins, Raimonds; Davlyatshin, Dmitry I.; Nosyrev, Pavel V.; Velikodny, Yurii A.
Two polymorphs of afobazole from powder diffraction data
Acta Crystallographica Section C, 2013, 69, 299-302
2018832 CIF
HKL
Paper
C11 H16 Ag4 I4 N4P 1 2/n 112.809; 4.541; 18.788
90; 97.621; 90
1083.2Yuan, Shuai; Liu, Shan-Shan; Lu, Hai-Feng; Xu, Meng-Zhen; Sun, Di
A two-dimensional silver‒iodide organic network constructed from a unique [Ag~6~I~6~] hexagonal prism-based one-dimensional column motif
Acta Crystallographica Section C, 2013, 69, 216-218
2018833 CIF
HKL
Paper
C21 H32 N3 O7 PP n a 218.597; 18.023; 15.852
90; 90; 90
2456.2Brzuszkiewicz, Anna; Makowski, Maciej; Lisowski, Marek; Lis, Elżbieta; Otreba, Marta; Lis, Tadeusz
Two phosphonodehydrotripeptides: Boc^0^‒Gly^1^‒Δ(<i>Z</i>)Phe^2^‒α-Abu^3^PO~3~Me~2~ and Boc^0^‒Gly^1^‒Δ(<i>Z</i>)Phe^2^‒α-Nva^3^PO~3~Et~2~
Acta Crystallographica Section C, 2013, 69, 277-281
2018834 CIF
HKL
Paper
C27 H46.24 N3 O8.12 PP -110.131; 12.866; 13.368
68.9; 75.94; 84.11
1576.7Brzuszkiewicz, Anna; Makowski, Maciej; Lisowski, Marek; Lis, Elżbieta; Otreba, Marta; Lis, Tadeusz
Two phosphonodehydrotripeptides: Boc^0^‒Gly^1^‒Δ(<i>Z</i>)Phe^2^‒α-Abu^3^PO~3~Me~2~ and Boc^0^‒Gly^1^‒Δ(<i>Z</i>)Phe^2^‒α-Nva^3^PO~3~Et~2~
Acta Crystallographica Section C, 2013, 69, 277-281
2018835 CIF
HKL
Paper
C26 H44.16 N3 O8.08 PP -110.047; 12.667; 13.499
69.16; 76.54; 83.89
1560.9Brzuszkiewicz, Anna; Makowski, Maciej; Lisowski, Marek; Lis, Elżbieta; Otreba, Marta; Lis, Tadeusz
Two phosphonodehydrotripeptides: Boc^0^‒Gly^1^‒Δ(<i>Z</i>)Phe^2^‒α-Abu^3^PO~3~Me~2~ and Boc^0^‒Gly^1^‒Δ(<i>Z</i>)Phe^2^‒α-Nva^3^PO~3~Et~2~
Acta Crystallographica Section C, 2013, 69, 277-281
2018836 CIF
HKL
Paper
C28 H25 Cl2 N2 P PdC 1 2/c 132.35; 9.9963; 20.8851
90; 128.423; 90
5291.2Motswainyana, William M.; Onani, Martin O.; Jacobs, Jeroen; Van Meervelt, Luc
Dichlorido{<i>N</i>-[2-(diphenylphosphanyl)benzylidene]-2-methylaniline}palladium(II) acetonitrile monosolvate
Acta Crystallographica Section C, 2013, 69, 209-211
2018837 CIF
HKL
Paper
C13 H18 N2 O SP c a 2111.5273; 13.4634; 8.3956
90; 90; 90
1302.97Gomes, Ligia R.; Low, John Nicolson; Wardell, James L.; Pinheiro, Alessandra C.; Mendonça, Thais C. N. de; de Souza, Marcus V. N.
Three 2-(methysulfanyl)nicotinamides
Acta Crystallographica Section C, 2013, 69, 293-298
2018838 CIF
HKL
Paper
C10 H14 N2 O SP 1 21/c 111.42; 8.58; 23.61
90; 94.15; 90
2307Gomes, Ligia R.; Low, John Nicolson; Wardell, James L.; Pinheiro, Alessandra C.; Mendonça, Thais C. N. de; de Souza, Marcus V. N.
Three 2-(methysulfanyl)nicotinamides
Acta Crystallographica Section C, 2013, 69, 293-298
2018839 CIF
HKL
Paper
C9 H16 N2 O4 SP 1 21/n 17.194; 7.285; 22.388
90; 90.341; 90
1173.3Gomes, Ligia R.; Low, John Nicolson; Wardell, James L.; Pinheiro, Alessandra C.; Mendonça, Thais C. N. de; de Souza, Marcus V. N.
Three 2-(methysulfanyl)nicotinamides
Acta Crystallographica Section C, 2013, 69, 293-298
2018840 CIF
HKL
Paper
C56 H44 Cd3 I6 N16 O2P -18.071; 13.0867; 15.2422
81.885; 81.742; 79.87
1557.26Degtyarenko, Anna S.; Domasevitch, Konstantin V.
Cadmium(II) iodide and thiocyanate complexes adopted by polycyclic 1,4-bis(pyridazin-4-yl)benzene: interplay of coordination and π‒π stacking interactions
Acta Crystallographica Section C, 2013, 69, 219-224
2018841 CIF
HKL
Paper
C16 H10 Cd N6 S2P -15.9018; 7.6619; 9.2433
88.98; 75.434; 87.049
404Degtyarenko, Anna S.; Domasevitch, Konstantin V.
Cadmium(II) iodide and thiocyanate complexes adopted by polycyclic 1,4-bis(pyridazin-4-yl)benzene: interplay of coordination and π‒π stacking interactions
Acta Crystallographica Section C, 2013, 69, 219-224
2018842 CIF
HKL
Paper
C22 H19 N O4 SP -111.865; 12.242; 14.7287
68.075; 81.665; 80.437
1948.99de Castro, Mirian R. C.; Aragão, Angelo Q.; Napolitano, Hamilton B.; Noda-Perez, Caridad; Martins, Felipe T.
An additional methylene group driving the conformation and assembly of two arylsulfonamide <i>para</i>-alkoxychalcone hybrids
Acta Crystallographica Section C, 2013, 69, 267-272
2018843 CIF
HKL
Paper
C23 H21 N O4 SP 1 21/c 18.4506; 20.1587; 14.212
90; 119.098; 90
2115.49de Castro, Mirian R. C.; Aragão, Angelo Q.; Napolitano, Hamilton B.; Noda-Perez, Caridad; Martins, Felipe T.
An additional methylene group driving the conformation and assembly of two arylsulfonamide <i>para</i>-alkoxychalcone hybrids
Acta Crystallographica Section C, 2013, 69, 267-272
2018844 CIF
HKL
Paper
C30 H26 Cd N2 O7 SP -18.0981; 12.2931; 14.6297
78.157; 80.994; 74.005
1362.5Tao, Jian-Qing
A one-dimensional coordination polymer based on Cd~2~O~2~ clusters: poly[aqua(μ~3~-4,4'-sulfonyldibenzoato)(3,4,7,8-tetramethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]
Acta Crystallographica Section C, 2013, 69, 244-246
2018845 CIF
HKL
Paper
C15 H13 N O2P 1 21/c 18.8247; 12.0858; 10.9511
90; 102.51; 90
1140.2He, Chang-Shuai; Liu, Lu-Fang; Guo, Lei; Wu, Jian-Zhong
Supramolecular networks of 10-(2-hydroxyethyl)acridin-9(10<i>H</i>)-one and 10-(2-chloroethyl)acridin-9(10<i>H</i>)-one
Acta Crystallographica Section C, 2013, 69, 289-292
2018846 CIF
HKL
Paper
C15 H12 Cl N OP 1 21/c 19.3632; 16.449; 8.0359
90; 92.151; 90
1236.8He, Chang-Shuai; Liu, Lu-Fang; Guo, Lei; Wu, Jian-Zhong
Supramolecular networks of 10-(2-hydroxyethyl)acridin-9(10<i>H</i>)-one and 10-(2-chloroethyl)acridin-9(10<i>H</i>)-one
Acta Crystallographica Section C, 2013, 69, 289-292
2018847 CIF
HKL
Paper
C19 H17 N O SP 21 21 217.0387; 11.5605; 18.1951
90; 90; 90
1480.6Yépes, Andrés F.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Three closely related thienyl-substituted 1,4-epoxynaphtho[1,2-<i>b</i>]azepines: hydrogen-bonded assembly in one, two and three dimensions
Acta Crystallographica Section C, 2013, 69, 307-312
2018848 CIF
HKL
Paper
C19 H17 N O SP 1 21/c 116.165; 5.2505; 20.041
90; 118.813; 90
1490.4Yépes, Andrés F.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Three closely related thienyl-substituted 1,4-epoxynaphtho[1,2-<i>b</i>]azepines: hydrogen-bonded assembly in one, two and three dimensions
Acta Crystallographica Section C, 2013, 69, 307-312
2018849 CIF
HKL
Paper
C18 H14 Br N O SP n a 2115.316; 9.923; 20.225
90; 90; 90
3073.8Yépes, Andrés F.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Three closely related thienyl-substituted 1,4-epoxynaphtho[1,2-<i>b</i>]azepines: hydrogen-bonded assembly in one, two and three dimensions
Acta Crystallographica Section C, 2013, 69, 307-312
2018850 CIF
HKL
Paper
C13 H17 N O4 SP 21 21 216.2335; 8.9651; 24.747
90; 90; 90
1383Akerman, Kate J.; Munro, Orde Q.
An X-ray crystallographic and density functional theory study of (3<i>Z</i>)-4-(5-ethylsulfonyl-2-hydroxyanilino)pent-3-en-2-one and (3<i>Z</i>)-4-(5-<i>tert</i>-butyl-2-hydroxyanilino)pent-3-en-2-one
Acta Crystallographica Section C, 2013, 69, 258-262
2018851 CIF
HKL
Paper
C15 H21 N O2P 1 21/c 112.3617; 8.3063; 14.1054
90; 104.114; 90
1404.62Akerman, Kate J.; Munro, Orde Q.
An X-ray crystallographic and density functional theory study of (3<i>Z</i>)-4-(5-ethylsulfonyl-2-hydroxyanilino)pent-3-en-2-one and (3<i>Z</i>)-4-(5-<i>tert</i>-butyl-2-hydroxyanilino)pent-3-en-2-one
Acta Crystallographica Section C, 2013, 69, 258-262
2018852 CIFAg0.75 Cu3 Y1.25P 41 3 27.127; 7.127; 7.127
90; 90; 90
362.01Zeng Lingmin; Li Dexuan; Zhuang Yinghong
Structure of Ag3 Cu12 Y5, a new ternary compound
Acta Crystallographica C (39,1983-), 1993, 49, 1559-1561
2018853 CIFAg As F7P n m a7.585; 6.997; 9.852
90; 90; 90
522.868Holloway, J.H.; Russell, D.R.; Frlec, B.; Gantar, D.
Structure of the 1:1 silver(II) fluoride - arsenic(V) fluoride adduct, AgF2*AsF5
Acta Crystallographica C (39,1983-), 1987, 43, 618-620
2018854 CIFC10 H17 Au Br4 N4 O7P 17.43; 8.272; 8.768
98.96; 108.02; 94.56
501.5Juan M. Salas; Miguel Quirós; M. Purificación Sánchez; André L. Beauchamp
Structure of Inosinium Tetrabromoaurate(III) Dihydrate
Acta Crystallographica, Section C, 1989, 45, 1874-1877
2018855 CIFAg N O5 TeP b c n5.667; 14.202; 5.232
90; 90; 90
421.086Kazikowski, S.; Olsson, C.; Johansson, L.G.
Structure of silver telluryl nitrate Ag Te O2 N O3.
Acta Crystallographica C (39,1983-), 1988, 44, 427-429
2018856 CIFAg P S4 ZnP n a 2112.502; 7.599; 6.0696
90; 90; 90
576.628Rouland, J.C.; Rodier, N.; Toffoli, P.; Khodadad, P.
Structure du Tetrathiophosphate(V) de Zinc et d'Argent, Zn Ag P S4
Acta Crystallographica C (39,1983-), 1985, 41, 645-647
2018857 CIFAg Pb S3 SbP 1 21/a 17.518; 12.809; 5.904
90; 92.25; 90
568.105Fan, H.-F.; Woolfson, M.M.; Main, P.; Yao, J.-X.
On the Application of Phase Relationships to Complex Structures. XXIII. Automatic Determination of Crystal Structures having Pseudo-Translational Symmetry by a Modified MULTAN Procedure
Acta Crystallographica C (39,1983-), 1983, 39, 566-569
2018858 CIFAg2 Li N3 O6C 1 2/c 110.166; 7.575; 8.479
90; 91.27; 90
652.786Ishihara, M.; Saito, Y.; Matsumoto, F.; Ohba, S.
Structures of mercury(I) nitrite and lithium disilver trinitrite
Acta Crystallographica C (39,1983-), 1986, 42, 1-4
2018859 CIFAg2 Al4 Cl10 O2P b c a11.24; 12.278; 12.955
90; 90; 90
1787.85Jentsch, D.; Schwarzmann, E.; Sheldrick, G.M.; Jones, P.G.
Disilver(I) Decachlorodioxotetraaluminate(III), Ag2 (Al4 Cl10 O2)
Acta Crystallographica C (39,1983-), 1983, 39, 1173-1174
2018860 CIFAg4 P2 S6P 21 21 2113.901; 11.073; 6.303
90; 90; 90
970.194Toffoli, P.; Rodier, N.; Khodadad, P.
Structure d'une Deuxieme Variete d'Hexathiodiphosphate(IV) d'Argent, Ag4 P2 S6. Comparaison des Structures des Deux Varietes
Acta Crystallographica C (39,1983-), 1983, 39, 1485-1488
2018861 CIFAg5 Cu2 N O15 Se4P -15.148; 7.05; 10.54
73.09; 89.08; 88.5
365.853Effenberger, H.
Structure of pentasilver(I) dicopper(II) mononitrate tetraselenite(IV)
Acta Crystallographica C (39,1983-), 1991, 47, 2522-2525
2018862 CIFAg3 K4 N7 O14P n m a11.37; 11.01; 14.091
90; 90; 90
1763.96Saito, Y.; Ohba, S.; Ishihara, M.; Okamura, Y.
Structure of tetrapotassium trisilver heptanitrite and potassium silver dinitrite hemihydrate
Acta Crystallographica C (39,1983-), 1989, 45, 353-356
2018863 CIFAu Cl4 N5 S5P 1 21/m 15.34; 11.997; 10.16
90; 99.51; 90
641.945Dehnicke, K.; Ruangsuttinarupap, S.; Willing, W.; Mueller, U.
Cyclopentaazathienium-tetrachloroaurat
Acta Crystallographica C (39,1983-), 1986, 42, 1263-1264
2018864 CIFAu Cl4 NaP 1 21/n 111.277; 11.234; 20.584
90; 104.58; 90
2523.73Hohbein, R.; Jones, P.G.; Schwarzmann, E.
Anhydrous sodium tetrachloroaurate(III)
Acta Crystallographica C (39,1983-), 1988, 44, 1164-1166
2018865 CIFAu Cl4 TlC 1 2/c 112.298; 5.825; 9.681
90; 102.09; 90
678.125Schelbach, R.; Jones, P.G.; Schwarzmann, E.
Thallium(I) Tetrachloroaurate(III)
Acta Crystallographica C (39,1983-), 1987, 43, 1674-1675
2018866 CIFAu Cl7 SP 1 21/c 18.637; 10.24; 11.618
90; 107.88; 90
977.901Jentsch, D.; Jones, P.G.; Schwarzmann, E.
Trichlorosulfonium(IV) Tetrachloroaurate(III)
Acta Crystallographica C (39,1983-), 1988, 44, 210-212
2018867 CIFAu Cl7 SeP 1 21/c 18.484; 10.184; 12.135
90; 108.37; 90
995.048Schelbach, R.; Jones, P.G.; Schwarzmann, E.
Trichloroselenonium(IV) tatrachloroaurate(III)
Acta Crystallographica C (39,1983-), 1987, 43, 607-609
2018868 CIFAu Cl8 PI m m a15.734; 12.433; 11.646
90; 90; 90
2278.2Schelbach, R.; Jones, P.G.; Sheldrick, G.M.; Erdbruegger, C.F.; Schwarzmann, E.
Tetrachlorophosphonium(V) tetrachloroaurate(III)
Acta Crystallographica C (39,1983-), 1987, 43, 1857-1859
2018869 CIFAu2 KP 63/m m c5.623; 5.623; 9.791
90; 90; 120
268.098Klement, U.; Range, K.J.; Rau, F.
Potassium digold. K Au2
Acta Crystallographica C (39,1983-), 1988, 44, 1485-1486
2018870 CIFB2 Ni5 O10 TiP b a m12.221; 9.199; 2.996
90; 90; 90
336.813Lager, G.A.; Armbruster, T.
Structure of Pentanickel Titanium Diboron Oxide, Ni5 Ti B2 O10
Acta Crystallographica C (39,1983-), 1985, 41, 1400-1402
2018871 CIFB3 Bi O6C 1 2 17.116; 4.993; 6.508
90; 105.62; 90
222.691Liebertz, J.; Froehlich, R.; Bohaty, L.
Die Kristallstruktur von Wismutborat, Bi B3 O6
Acta Crystallographica C (39,1983-), 1984, 40, 343-344
2018872 CIFB3 Ca5 F O9C 1 m 18.129; 16.051; 3.539
90; 100.94; 90
453.372Huang, Q.; Zheng, Y.; Lei, S.; Chen, C.; Jiang, A.
Structure of calcium fluoroborate, Ca5 (B O3)3 F
Acta Crystallographica C (39,1983-), 1989, 45, 1861-1863
2018873 CIFB3 Cl O10 Pb6P b c m7.021; 17.218; 10.952
90; 90; 90
1323.96Behm, H.
Hexalead Chloride Triorthoborate Oxide, Pb4 O (Pb2 (B O3)3 Cl)
Acta Crystallographica C (39,1983-), 1983, 39, 1317-1319
2018874 CIFB F13 Sn5P 1 21/c 113.635; 7.66; 14.112
90; 119.71; 90
1280.16Boenisch, J.; Bergerhoff, G.
Phyllo-Nonafluoropentazinn(II)-tetrafluoroborat, (Sn5 F9) (B F4)
Acta Crystallographica C (39,1983-), 1984, 40, 2005-2006
2018875 CIFB K4.99 O50.01 W12P 62 2 218.97; 18.97; 12.414
90; 90; 120
3868.81Craig, D.C.; Allen, C.C.; Fletcher, H.; Burns, R.C.
Pentapotassium dodecatungstoborate(III) hexadecahydrate
Acta Crystallographica C (39,1983-), 2001, 57, 505-507
2018876 CIFB O3 ScR -3 c :H4.748; 4.748; 15.262
90; 90; 120
297.964Sun, H.; Keszler, D.A.
Structure of Sc B O3
Acta Crystallographica C (39,1983-), 1988, 44, 1505-1507
2018877 CIFB16 K6 O44 UP 1 21/n 112.024; 26.45; 12.543
90; 94.74; 90
3975.47Behm, H.
Hexpotassium(cyclo-Octahydroxotetracosaoxohexadecaborato)diox uranate(VI) Dodecahyrate, K6 (U O2 (B16 O24 (O H)8)) (H2 O)12
Acta Crystallographica C (39,1983-), 1985, 41, 642-645
2018878 CIFB7 Br Co3 O13P c a 218.5614; 8.5657; 12.1196
90; 90; 90
888.783Schmid, H.; Kubel, F.; Mao, S.Y.
Structure of the fully ferroelectric/fully ferroelastic orthorhombic room-temperature phase of cobalt bromine boracite, Co3B7O13Br and nickel chlorine boracite, Ni3B7O13Cl
Acta Crystallographica C (39,1983-), 1992, 48, 1167-1170
2018879 CIFB7 Cl Fe3 O13R 3 c :H8.6231; 8.6231; 21.05029
90; 90; 120
1355.55Yvon, K.; Mendoza-Alvarez, M.E.; Depmeier, W.; Schmid, H.
Structure refinement of trigonal iron-chlorine Boracite
Acta Crystallographica C (39,1983-), 1985, 41, 1551-1552
2018880 CIFB7 Cl Ni3 O13P c a 218.5105; 8.4984; 12.0324
90; 90; 90
870.251Kubel, F.; Mao, S.Y.; Schmid, H.
Structure of the fully ferroelectric/fully ferroelastic orthorhombic room-temperature phase of cobalt bromine boracite, Co3 B7 O13 Br and nickel chlorine boracite, Ni3 B7 O13 Cl
Acta Crystallographica C (39,1983-), 1992, 48, 1167-1170
2018881 CIFB7 Cr3 I O13F -4 3 c12.214; 12.214; 12.214
90; 90; 90
1822.11Schmid, H.; Berset, G.; Monnier, A.
Cubic structure of chromium iodine borazite
Acta Crystallographica C (39,1983-), 1987, 43, 1243-1245
2018882 CIFB7 Cu3 I O13F -4 3 c12.0203; 12.0203; 12.0203
90; 90; 90
1736.78Depmeier, W.; Berset, G.; Schmid, H.; Boutellier, R.
Structure of boracite Cu3 B7 O13 I
Acta Crystallographica C (39,1983-), 1985, 41, 1694-1696
2018883 CIFB4 Er Rh4I 41/a c d :27.461; 7.461; 14.804
90; 90; 90
824.087Muto, Y.; Iwasaki, H.; Watanabe, Y.
Structure of the body-centered tetragonal ErRh4B4
Acta Crystallographica C (39,1983-), 1986, 42, 1469-1472
2018884 CIFB4 Er Rh4P 42/n m c :25.292; 5.292; 7.379
90; 90; 90
206.651Takei, H.; Iwasaki, H.; Watanabe, Y.
Structure of the Primitive Tetragonal Er Rh4 B4
Acta Crystallographica C (39,1983-), 1984, 40, 1644-1646
2018886 CIF
HKL
Paper
C26 H18 Cl N3 O2 ZnP 1 21/n 112.925; 10.175; 17.334
90; 104.804; 90
2204Zhang, Yue-Feng; Ma, Jian-Ping; Liu, Qi-Kui; Dong, Yu-Bin
Three isomorphous two-dimensional coordination polymers generated from a benzimidazole bridging ligand and Zn<i>X</i>~2~ (<i>X</i> = Cl, Br and I)
Acta Crystallographica Section C, 2013, 69, 367-371
2018887 CIF
HKL
Paper
C26 H18 Br N3 O2 ZnP 1 21/n 113.046; 10.276; 17.437
90; 105.568; 90
2251.9Zhang, Yue-Feng; Ma, Jian-Ping; Liu, Qi-Kui; Dong, Yu-Bin
Three isomorphous two-dimensional coordination polymers generated from a benzimidazole bridging ligand and Zn<i>X</i>~2~ (<i>X</i> = Cl, Br and I)
Acta Crystallographica Section C, 2013, 69, 367-371
2018888 CIF
HKL
Paper
C26 H18 I N3 O2 ZnP 1 21/n 113.212; 10.48; 17.535
90; 107.148; 90
2320Zhang, Yue-Feng; Ma, Jian-Ping; Liu, Qi-Kui; Dong, Yu-Bin
Three isomorphous two-dimensional coordination polymers generated from a benzimidazole bridging ligand and Zn<i>X</i>~2~ (<i>X</i> = Cl, Br and I)
Acta Crystallographica Section C, 2013, 69, 367-371
2018889 CIF
HKL
Paper
Ba15.1 Ga31 K0.9 Sn105F d -3 m :217.0178; 17.0178; 17.0178
90; 90; 90
4928.4Schäfer, Marion C.; Bobev, Svilen
K and Ba distribution in the structures of the clathrate compounds K~<i>x~</i>Ba~16{-~<i>x</i>}(Ga,Sn)~136~ (<i>x</i> = 0.8, 4.4, and 12.9) and K~<i>x~</i>Ba~8{-~<i>x</i>}(Ga,Sn)~46~ (<i>x</i> = 0.3)
Acta Crystallographica Section C, 2013, 69, 319-323
2018890 CIF
HKL
Paper
Ba11.7 Ga27.4 K4.3 Sn108.6F d -3 m :217.0709; 17.0709; 17.0709
90; 90; 90
4974.7Schäfer, Marion C.; Bobev, Svilen
K and Ba distribution in the structures of the clathrate compounds K~<i>x~</i>Ba~16{-~<i>x</i>}(Ga,Sn)~136~ (<i>x</i> = 0.8, 4.4, and 12.9) and K~<i>x~</i>Ba~8{-~<i>x</i>}(Ga,Sn)~46~ (<i>x</i> = 0.3)
Acta Crystallographica Section C, 2013, 69, 319-323
2018891 CIF
HKL
Paper
Ba3.1 Ga19.5 K12.9 Sn116.5F d -3 m :217.1946; 17.1946; 17.1946
90; 90; 90
5083.7Schäfer, Marion C.; Bobev, Svilen
K and Ba distribution in the structures of the clathrate compounds K~<i>x~</i>Ba~16{-~<i>x</i>}(Ga,Sn)~136~ (<i>x</i> = 0.8, 4.4, and 12.9) and K~<i>x~</i>Ba~8{-~<i>x</i>}(Ga,Sn)~46~ (<i>x</i> = 0.3)
Acta Crystallographica Section C, 2013, 69, 319-323
2018892 CIF
HKL
Paper
Ba0.3 Ga8.5 K7.7 Sn37.5P m -3 n11.9447; 11.9447; 11.9447
90; 90; 90
1704.22Schäfer, Marion C.; Bobev, Svilen
K and Ba distribution in the structures of the clathrate compounds K~<i>x~</i>Ba~16{-~<i>x</i>}(Ga,Sn)~136~ (<i>x</i> = 0.8, 4.4, and 12.9) and K~<i>x~</i>Ba~8{-~<i>x</i>}(Ga,Sn)~46~ (<i>x</i> = 0.3)
Acta Crystallographica Section C, 2013, 69, 319-323
2018893 CIF
HKL
Paper
C45.5 H50 N2 O8 Zn2P -110.151; 13.063; 16.297
81.37; 74.2; 85.95
2054.8Petrus, Rafał; Sobota, Piotr
A dinuclear zinc complex containing a diamond-core geometry: [Zn~2~(μ~2~-GueO)~2~(GueO)~2~(py)~2~]·0.5(toluene) (GueOH is guethol)
Acta Crystallographica Section C, 2013, 69, 372-375
2018894 CIF
HKL
Paper
C16 H21 Cl N2 O2P 1 21/c 110.1805; 14.5849; 10.3843
90; 100.404; 90
1516.53Mesto, E.; Quaranta, E.
Hydrogen-bonded and π-interaction assembly in two 8-alkoxycarbonyl-1,8-diazabicyclo[5.4.0]undec-7-enium chloride salts
Acta Crystallographica Section C, 2013, 69, 444-447
2018895 CIF
HKL
Paper
C11 H21 Cl N2 O3P 1 21/c 16.6506; 15.5432; 13.2041
90; 90.237; 90
1364.92Mesto, E.; Quaranta, E.
Hydrogen-bonded and π-interaction assembly in two 8-alkoxycarbonyl-1,8-diazabicyclo[5.4.0]undec-7-enium chloride salts
Acta Crystallographica Section C, 2013, 69, 444-447
2018896 CIF
HKL
Paper
C16 H21 N3 O3P 1 21/c 111.2397; 16.7124; 8.6528
90; 96.15; 90
1616Ravikumar, Krishnan; Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Hariharakrishnan, Venkatasubramanian; Rao, Bandi Venugopal
Frovatriptan salts of aliphatic carboxylic acids
Acta Crystallographica Section C, 2013, 69, 428-435
2018897 CIF
Paper
C18 H25 N3 O6P 1 21 110.6206; 7.9939; 22.3916
90; 92.884; 90
1898.64Ravikumar, Krishnan; Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Hariharakrishnan, Venkatasubramanian; Rao, Bandi Venugopal
Frovatriptan salts of aliphatic carboxylic acids
Acta Crystallographica Section C, 2013, 69, 428-435
2018898 CIF
HKL
Paper
C32 H46 N6 O9P 1 21 18.7239; 18.662; 10.127
90; 96.098; 90
1639.4Ravikumar, Krishnan; Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Hariharakrishnan, Venkatasubramanian; Rao, Bandi Venugopal
Frovatriptan salts of aliphatic carboxylic acids
Acta Crystallographica Section C, 2013, 69, 428-435
2018899 CIF
HKL
Paper
C34 H21 O3 P RuP 1 21/n 110.029; 15.242; 17.922
90; 93.5; 90
2734Arce, Alejandro; De Sanctis, Ysaura; Galarza, Esperanza; Garland, María Teresa; Baggio, Ricardo
Two complexes derived from the reaction of <i>M</i>~3~(CO)~12~ clusters (<i>M</i> = Ru, Os) with the 9-(triphenylphosphonio)fluorenide ylide: tricarbonyl[9-(triphenylphosphonio)fluorenylidene]ruthenium and nonacarbonyl-μ~3~-fluorenylidene-μ~2~-hydrido-<i>triangulo</i>-triosmium(III)
Acta Crystallographica Section C, 2013, 69, 363-366
2018900 CIF
HKL
Paper
C22 H8 O9 Os3P 1 21/n 19.3325; 13.96; 17.865
90; 103.771; 90
2260.6Arce, Alejandro; De Sanctis, Ysaura; Galarza, Esperanza; Garland, María Teresa; Baggio, Ricardo
Two complexes derived from the reaction of <i>M</i>~3~(CO)~12~ clusters (<i>M</i> = Ru, Os) with the 9-(triphenylphosphonio)fluorenide ylide: tricarbonyl[9-(triphenylphosphonio)fluorenylidene]ruthenium and nonacarbonyl-μ~3~-fluorenylidene-μ~2~-hydrido-<i>triangulo</i>-triosmium(III)
Acta Crystallographica Section C, 2013, 69, 363-366
2018901 CIF
HKL
Paper
C33 H48 Br3 Cu3 N6 Nd O24P -111.357; 12.588; 19.254
84.268; 77.257; 66.283
2457.9Xu, Li-Qing; Lu, Li-Ping; Zhu, Miao-Li
Analogy to a Chinese knot in an ion-pair copper(II)‒neodymium(III) complex based on a hexadentate Schiff base condensation product of 5-bromosalicylaldehyde and glycylglycine
Acta Crystallographica Section C, 2013, 69, 376-379
2018902 CIF
HKL
Paper
C9 H12 Au Cl2 NP b c a9.1323; 8.9812; 27.1824
90; 90; 90
2229.47Wood, Matthew R.; Lalancette, Roger A.
Understanding the microcrystal tests of three related phenethylamines: the <i>ortho</i>-metallated (±)-amphetamine formed with gold(III) chloride, and the tetrachloridoaurate(III) salts of (+)-methamphetamine and (±)-ephedrine
Acta Crystallographica Section C, 2013, 69, 388-393
2018903 CIF
HKL
Paper
C10 H16 Au Cl4 NP 1 21 17.3561; 14.2394; 13.9103
90; 90.077; 90
1457.05Wood, Matthew R.; Lalancette, Roger A.
Understanding the microcrystal tests of three related phenethylamines: the <i>ortho</i>-metallated (±)-amphetamine formed with gold(III) chloride, and the tetrachloridoaurate(III) salts of (+)-methamphetamine and (±)-ephedrine
Acta Crystallographica Section C, 2013, 69, 388-393
2018904 CIF
HKL
Paper
C10 H16 Au Cl4 N OP 1 21/c 17.7537; 25.0264; 15.4587
90; 93.92; 90
2992.7Wood, Matthew R.; Lalancette, Roger A.
Understanding the microcrystal tests of three related phenethylamines: the <i>ortho</i>-metallated (±)-amphetamine formed with gold(III) chloride, and the tetrachloridoaurate(III) salts of (+)-methamphetamine and (±)-ephedrine
Acta Crystallographica Section C, 2013, 69, 388-393
2018905 CIF
HKL
Paper
C11 H11 Br O3P -4 21 c16.2247; 16.2247; 7.6586
90; 90; 90
2016.1Goswami, Shailesh K.; Hanton, Lyall R.; McAdam, C. John; Moratti, Stephen C.; Simpson, Jim
Similarities and differences in the structures of 5-bromo-6-hydroxy-7,8-dimethylchroman-2-one and 6-hydroxy-7,8-dimethyl-5-nitrochroman-2-one
Acta Crystallographica Section C, 2013, 69, 407-411

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