Crystallography Open Database

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2243885 CIF
HKL
Paper
C27 H46 N2P 1 21/n 112.3319; 14.4082; 13.6155
90; 96.4589; 90
2403.9Naumann, Roxanne A.; Ziller, Joseph W.; Liberman-Martin, Allegra L.
Crystal structure of 2-(2,6-diisopropylphenyl)-<i>N</i>,<i>N</i>-diethyl-3,3-dimethyl-2-azaspiro[4.5]decan-1-amine: a diethylamine adduct of a cyclic(alkyl)(amino)carbene (CAAC)
Acta Crystallographica Section E, 2021, 77
2243886 CIF
HKL
Paper
C33 H28 N2 O4P -17.6918; 13.299; 14.13
75.026; 81.728; 79.838
1367.1Zhang, Xue-Jun
Crystal structure and Hirshfeld analysis of diethyl (2<i>E</i>,2'<i>E</i>)-3,3'-[1-(8-phenylisoquinolin-1-yl)-1<i>H</i>-indole-2,7-diyl]diacrylate
Acta Crystallographica Section E, 2021, 77
2243887 CIF
HKL
Paper
C27 H51 Bi2 I9 N6P 1 21/c 119.259; 12.5734; 21.6767
90; 115.861; 90
4723.4James, Zoe; Cai, Yunhe; Vaqueiro, Paz
Crystal structure of (C~9~H~17~N~2~)~3~[Bi~2~I~9~]
Acta Crystallographica Section E, 2021, 77
2243888 CIF
HKL
Paper
C15 H12 N2 O3C 1 2/c 117.436; 7.2485; 20.595
90; 99.181; 90
2569.6Atioğlu, Zeliha; Akkurt, Mehmet; Askerova, Ulviyya F.; Mukhtarova, Sevinc H.; Askerov, Rizvan K.; Mlowe, Sixberth
Crystal structure and Hirshfeld surface analysis of (3<i>Z</i>)-7-methoxy-3-(2-phenylhydrazinylidene)-1-benzofuran-2(3<i>H</i>)-one
Acta Crystallographica Section E, 2021, 77
2243889 CIF
HKL
Paper
C23 H18 Cl Fe NP b c a10.0991; 7.7277; 45.979
90; 90; 90
3588.3Sghyar, Riham; Moussaoui, Oussama; Sebbar, Nada Kheira; Ait Elmachkouri, Younesse; Irrou, Ezaddine; Hökelek, Tuncer; Mague, Joel T.; Bentama, Abdesslam; El hadrami, El Mestafa
Crystal structure and Hirshfeld surface analysis study of (<i>E</i>)-1-(4-chlorophenyl)-<i>N</i>-(4-ferrocenylphenyl)methanimine
Acta Crystallographica Section E, 2021, 77
2243890 CIF
HKL
Paper
H12 Li Na3 O14 S2R 3 c :H8.3876; 8.3876; 30.048
90; 90; 120
1830.7Schmidt, Horst; Paschke, Iris; Voigt, Wolfgang
LiNa~3~(SO~4~)~2~·6H~2~O: a lithium double salt causing trouble in the industrial conversion of Li~2~SO~4~ into LiOH
Acta Crystallographica Section E, 2021, 77
2243891 CIF
HKL
Paper
H12 Li Na3 O14 S2R 3 c :H8.4006; 8.4006; 30.111
90; 90; 120
1840.2Schmidt, Horst; Paschke, Iris; Voigt, Wolfgang
LiNa~3~(SO~4~)~2~·6H~2~O: a lithium double salt causing trouble in the industrial conversion of Li~2~SO~4~ into LiOH
Acta Crystallographica Section E, 2021, 77
2243892 CIF
HKL
Paper
H12 Li Na3 O14 S2R 3 c :H8.426; 8.426; 30.197
90; 90; 120
1856.7Schmidt, Horst; Paschke, Iris; Voigt, Wolfgang
LiNa~3~(SO~4~)~2~·6H~2~O: a lithium double salt causing trouble in the industrial conversion of Li~2~SO~4~ into LiOH
Acta Crystallographica Section E, 2021, 77
2243893 CIF
HKL
Paper
H12 Li Na3 O14 S2R 3 c :H8.4337; 8.4337; 30.235
90; 90; 120
1862.4Schmidt, Horst; Paschke, Iris; Voigt, Wolfgang
LiNa~3~(SO~4~)~2~·6H~2~O: a lithium double salt causing trouble in the industrial conversion of Li~2~SO~4~ into LiOH
Acta Crystallographica Section E, 2021, 77
2243894 CIF
HKL
Paper
H12 Li Na3 O14 S2R 3 c :H8.457; 8.457; 30.33
90; 90; 120
1879Schmidt, Horst; Paschke, Iris; Voigt, Wolfgang
LiNa~3~(SO~4~)~2~·6H~2~O: a lithium double salt causing trouble in the industrial conversion of Li~2~SO~4~ into LiOH
Acta Crystallographica Section E, 2021, 77
2243895 CIF
HKL
Paper
C28 H25 Mo O3 PP -19.1719; 11.7493; 12.6049
113.083; 99.148; 99.38
1195.14Whited, Matthew T.; Ball, Margaret A.; Block, Alison; Brewster, Benjamin A.; Ferrer, LouLou; Jin-Lee, Helen J.; King, Colby J.; North, Jamie D.; Shelton, Inger L.; Wilson, David G.
Crystal structures of phosphine-supported (η^5^-cyclopentadienyl)molybdenum(II) propionyl complexes
Acta Crystallographica Section E, 2021, 77
2243896 CIF
HKL
Paper
C28 H22 F3 Mo O3 PP 1 21/c 111.7991; 18.6907; 22.4744
90; 97.256; 90
4916.7Whited, Matthew T.; Ball, Margaret A.; Block, Alison; Brewster, Benjamin A.; Ferrer, LouLou; Jin-Lee, Helen J.; King, Colby J.; North, Jamie D.; Shelton, Inger L.; Wilson, David G.
Crystal structures of phosphine-supported (η^5^-cyclopentadienyl)molybdenum(II) propionyl complexes
Acta Crystallographica Section E, 2021, 77
2243897 CIF
HKL
Paper
C32 H33 Cl2 Mo O6 PP -110.5308; 12.1305; 13.6154
97.66; 104.759; 107.081
1566.43Whited, Matthew T.; Ball, Margaret A.; Block, Alison; Brewster, Benjamin A.; Ferrer, LouLou; Jin-Lee, Helen J.; King, Colby J.; North, Jamie D.; Shelton, Inger L.; Wilson, David G.
Crystal structures of phosphine-supported (η^5^-cyclopentadienyl)molybdenum(II) propionyl complexes
Acta Crystallographica Section E, 2021, 77
2243898 CIF
HKL
Paper
C20 H15 Cl2 N3 O2P 1 21/c 19.662; 27.01; 7.4782
90; 111.571; 90
1814.9Naghiyev, Farid N.; Pavlova, Anastasiya V.; Khrustalev, Victor N.; Akkurt, Mehmet; Khalilov, Ali N.; Akobirshoeva, Anzurat A.; Mamedov, İbrahim G.
Crystal structure and Hirshfeld surface analysis of (<i>Z</i>)-2-amino-4-(2,6-dichlorophenyl)-5-(1-hydroxyethylidene)-6-oxo-1-phenyl-1,4,5,6-tetrahydropyridine-3-carbonitrile
Acta Crystallographica Section E, 2021, 77
2243899 CIF
HKL
Paper
C12 H24 Cd N12 Na2 O20P -17.0501; 10.0314; 19.5058
101.023; 90.468; 97.233
1342.53Divya, R.; Bijini, B. R.; Dhanya, V. S.; Babu, K. Rajendra; Sithambaresan, M.
Synthesis and crystal structure of a heterobimetallic cadmium‒sodium complex of 1,3,5-triazine-2,4,6-trione, [CdNa~2~(C~3~H~2~N~3~O~3~)~4~(H~2~O)~8~]
Acta Crystallographica Section E, 2021, 77
2243900 CIF
Paper
C12 H14.2 Co2 N O11.6P -19.0064; 9.234; 9.8426
93.859; 105.571; 99.483
772.37Ma, Jie; Zhang, Wen-Zhi; Liu, Yong; Yi, Wen-Tao
Synthesis, crystal structure and magnetic properties of poly[[diaqua{μ~6~-2-[bis(carboxylatomethyl)amino]terephthalato}dicobalt(II)] 1.6-hydrate]
Acta Crystallographica Section E, 2021, 77
2243901 CIF
HKL
Paper
C60 H50 Co2 Ge N10 O24P -110.6719; 11.8089; 14.0901
105.697; 94.026; 104.815
1633.99Buchko, Olha; Dyakonenko, Viktoriya; Martsinko, Elena; Chebanenko, Elena
Crystal structure of bis[<i>cis</i>-diaquabis(phenanthroline)cobalt(II)] bis(citrato)germanate(IV) dinitrate
Acta Crystallographica Section E, 2021, 77
2243902 CIF
HKL
Paper
C12 H29 Co2 N O19P -19.7653; 11.725; 11.8191
64.882; 71.276; 86.692
1155.6Ma, Jie; Zhang, Wen-Zhi; Xiong, Jie; Yan, Chun-Yan
Synthesis and crystal structure of <i>catena</i>-poly[[hexaaqua{μ~3~-2-[bis(carboxylatomethyl)amino]terephthalato}dicobalt(II)] pentahydrate] containing water tapes and pentamers
Acta Crystallographica Section E, 2021, 77
2243903 CIF
HKL
Paper
C3 H3 Cl N2P n m a14.9122; 17.641; 4.9878
90; 90; 90
1312.12Rue, Kelly; Raptis, Raphael G.
Low-temperature crystal structure of 4-chloro-1<i>H</i>-pyrazole
Acta Crystallographica Section E, 2021, 77, 1
2243904 CIF
Paper
C12 H9 N3 O2P n a 2116.2689; 12.8086; 4.9983
90; 90; 90
1041.55Xu, Xiaowen; Hoogenboom, Richard; Van Hecke, Kristof
Crystal structures of three <i>N</i>-(pyridine-2-carbonyl)pyridine-2-carboxamides as potential ligands for supramolecular chemistry
Acta Crystallographica Section E, 2021, 77
2243905 CIF
Paper
C12 H8 F N3 O2P n a 2116.6058; 12.9096; 4.9153
90; 90; 90
1053.71Xu, Xiaowen; Hoogenboom, Richard; Van Hecke, Kristof
Crystal structures of three <i>N</i>-(pyridine-2-carbonyl)pyridine-2-carboxamides as potential ligands for supramolecular chemistry
Acta Crystallographica Section E, 2021, 77
2243906 CIF
Paper
C12 H7 F2 N3 O2I 1 2/a 16.7062; 14.119; 11.2074
90; 97.14; 90
1052.94Xu, Xiaowen; Hoogenboom, Richard; Van Hecke, Kristof
Crystal structures of three <i>N</i>-(pyridine-2-carbonyl)pyridine-2-carboxamides as potential ligands for supramolecular chemistry
Acta Crystallographica Section E, 2021, 77
2243907 CIF
HKL
Paper
C16 H14 Cl2 N2 OP 1 21 15.5366; 17.9208; 16.2085
90; 99.173; 90
1587.65Shikhaliyev, Namiq Q.; Atioğlu, Zeliha; Akkurt, Mehmet; Qacar, Ayten M.; Askerov, Rizvan K.; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-1-[2,2-dichloro-1-(4-methylphenyl)ethenyl]-2-(4-methoxyphenyl)diazene
Acta Crystallographica Section E, 2021, 77, 965-970
2243908 CIF
HKL
Paper
C17 H14 Cl2 N4P 1 21/n 112.396; 6.528; 20.758
90; 104.39; 90
1627.1Shikhaliyev, Namiq Q.; Atioğlu, Zeliha; Akkurt, Mehmet; Suleymanova, Gulnar T.; Babayeva, Gulnare V.; Mlowe, Sixberth
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-4-({2,2-dichloro-1-[4-(dimethylamino)phenyl]ethenyl}diazenyl)benzonitrile
Acta Crystallographica Section E, 2021, 77
2243909 CIF
HKL
C8 H5 N3 O3P -15.5587; 8.6673; 8.7649
105.654; 98.56; 90.784
401.45Turgunov, Kambarali; Ziyadullaev, Mirjalol; Khoshimov, Farkhod; Karimov, Rikhsiboy; Elmuradov, Burkhon
Crystal structures of 6-nitroquinazolin-4(3<i>H</i>)-one, 6-aminoquinazolin-4(3<i>H</i>)-one and 4-aminoquinazoline hemihydrochloride dihydrate
Acta Crystallographica Section E, 2021, 77
2243910 CIF
HKL
C8 H7 N3 OP c a 2113.4535; 4.951; 21.6188
90; 90; 90
1439.99Turgunov, Kambarali; Ziyadullaev, Mirjalol; Khoshimov, Farkhod; Karimov, Rikhsiboy; Elmuradov, Burkhon
Crystal structures of 6-nitroquinazolin-4(3<i>H</i>)-one, 6-aminoquinazolin-4(3<i>H</i>)-one and 4-aminoquinazoline hemihydrochloride dihydrate
Acta Crystallographica Section E, 2021, 77
2243911 CIF
HKL
C16 H19 Cl N6 O2P 1 21/n 114.3512; 7.5867; 16.2282
90; 93.544; 90
1763.5Turgunov, Kambarali; Ziyadullaev, Mirjalol; Khoshimov, Farkhod; Karimov, Rikhsiboy; Elmuradov, Burkhon
Crystal structures of 6-nitroquinazolin-4(3<i>H</i>)-one, 6-aminoquinazolin-4(3<i>H</i>)-one and 4-aminoquinazoline hemihydrochloride dihydrate
Acta Crystallographica Section E, 2021, 77
2243912 CIF
HKL
Paper
C21 H25 N5 O8 S2P 1 21/c 111.0631; 9.7215; 21.9271
90; 96.746; 90
2341.93Fujii, Isao
Crystal structure of nafamostat dimesylate
Acta Crystallographica Section E, 2021, 77, 999-1002
2243913 CIF
HKL
Paper
C19 H16 O3P -18.643; 9.9526; 10.0677
79.039; 70.124; 68.366
755Mahesha, Ninganayaka; Yathirajan, Hemmige S.; Nagma Banu, Holalagudu A.; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher
Formation of 1-(thiazol-2-yl)-4,5-dihydropyrazoles from simple precursors: synthesis, spectroscopic characterization and the structures of an intermediate and two products
Acta Crystallographica Section E, 2021, 77
2243914 CIF
HKL
Paper
C28 H23 N3 O2 SC 1 c 115.7724; 17.6042; 9.3589
90; 114.259; 90
2369.1Mahesha, Ninganayaka; Yathirajan, Hemmige S.; Nagma Banu, Holalagudu A.; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher
Formation of 1-(thiazol-2-yl)-4,5-dihydropyrazoles from simple precursors: synthesis, spectroscopic characterization and the structures of an intermediate and two products
Acta Crystallographica Section E, 2021, 77
2243915 CIF
HKL
Paper
C29 H25 N3 O2 SC 1 c 116.5634; 17.725; 9.4032
90; 116.401; 90
2472.7Mahesha, Ninganayaka; Yathirajan, Hemmige S.; Nagma Banu, Holalagudu A.; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher
Formation of 1-(thiazol-2-yl)-4,5-dihydropyrazoles from simple precursors: synthesis, spectroscopic characterization and the structures of an intermediate and two products
Acta Crystallographica Section E, 2021, 77
2243916 CIF
Paper
C73 H79.94 F2 Fe8 N9 O32.47F d d 231.676; 44.806; 12.6056
90; 90; 90
17891Ward, Cassandra L.; Allen, Matthew J.; Lutter, Jacob C.
Hexa-μ-acetato-chlorido(μ-<i>N</i>,2-dioxodobenzene-1-carboximidato)-μ~3~-oxido-tetrairon(III)–water (1/1) and hexa-μ-acetato-(μ-<i>N</i>,2-dioxodobenzene-1-carboximidato)fluorido-μ~3~-oxido-tripyridinetetrairon(III)–pyridine–water (1/1/0.24)
Acta Crystallographica Section E, 2021, 77, 1003-1009
2243917 CIFC34 H39 Cl Fe4 N4 O17P 1 21 111.846; 15.5041; 12.6425
90; 115.449; 90
2096.64Ward, Cassandra L.; Allen, Matthew J.; Lutter, Jacob C.
Hexa-μ-acetato-chlorido(μ-<i>N</i>,2-dioxodobenzene-1-carboximidato)-μ~3~-oxido-tetrairon(III)–water (1/1) and hexa-μ-acetato-(μ-<i>N</i>,2-dioxodobenzene-1-carboximidato)fluorido-μ~3~-oxido-tripyridinetetrairon(III)–pyridine–water (1/1/0.24)
Acta Crystallographica Section E, 2021, 77, 1003-1009
2243918 CIF
HKL
Paper
C12 H60 Cl7 Co2 N12 Na O6P -3 c 111.429; 11.429; 15.5815
90; 90; 120
1762.61Conrad-Marut, Linden H.; Reinheimer, Eric W.; Johnson, Adam R.
Synthesis and structure determination of racemic (Δ/Λ)-tris(ethylenediamine)cobalt(III) trichloride hemi(hexaaquasodium chloride)
Acta Crystallographica Section E, 2021, 77
2243919 CIF
HKL
Paper
C44 H52 N8 O18 Pd Re4C 1 2/c 121.1079; 14.0026; 19.4346
90; 109.342; 90
5420Shapovalov, Sergey; Tikhonova, Olga; Skabitsky, Ivan
Crystal structure of the new palladium complexes tetrakis(1,3-dimethylimidazolium-2-ylidene)palladium(II) hexadecacarbonyltetrarhenium diethyl ether disolvate and octa-μ-carbonyl-dicarbonyltetrakis(triphenylphosphane)palladiumdirhenium (unknown solvate)
Acta Crystallographica Section E, 2021, 77
2243920 CIF
HKL
Paper
C82 H60 O10 P4 Pd4 Re2P -112.9278; 13.5132; 14.1184
105.983; 108.51; 106.129
2060.1Shapovalov, Sergey; Tikhonova, Olga; Skabitsky, Ivan
Crystal structure of the new palladium complexes tetrakis(1,3-dimethylimidazolium-2-ylidene)palladium(II) hexadecacarbonyltetrarhenium diethyl ether disolvate and octa-μ-carbonyl-dicarbonyltetrakis(triphenylphosphane)palladiumdirhenium (unknown solvate)
Acta Crystallographica Section E, 2021, 77
2243921 CIF
HKL
Paper
C12 H22 Li4 N12 O19P -18.853; 9.0592; 9.6621
67.806; 62.887; 68.58
620.88Ponnuvel, Anjapuli; Kala, Arumugam Pillai; Nagaraja, Karachalacherevu Seetharamiah; Karnan, Chandran
Polymeric coordination complex of lithium(I) with aqua and cyanurate ligands
Acta Crystallographica Section E, 2021, 77
2243922 CIF
HKL
Paper
C20 H18 O3P 1 21/c 115.6595; 13.1466; 7.6834
90; 93.146; 90
1579.4Seidel, Pierre; Schwarzer, Anke; Mazik, Monika
Crystal structure of 9,9-diethyl-9<i>H</i>-fluorene-2,4,7-tricarbaldehyde
Acta Crystallographica Section E, 2021, 77, 1
2243923 CIF
HKL
Paper
C18 H42 Cd2 Cl7 Fe N6 O6R -3 :H13.7143; 13.7143; 16.1312
90; 90; 120
2627.51Vassilyeva, Olga Yu.; Kokozay, Vladimir N.; Petrusenko, Svitlana; Sobolev, Alexandre N.
Crystal structure of hexakis(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)iron(III) μ-chlorido-bis(trichloridocadmium)
Acta Crystallographica Section E, 2021, 77
2243924 CIF
HKL
Paper
C23 H28 N2 OP -15.2353; 13.5065; 14.3158
98.045; 98.327; 91.255
990.83Abad, Nadeem; Chkirate, Karim; Al-Ostoot, Fares Hezam; Van Meervelt, Luc; Lahmidi, Sanae; Ferfra, Souad; Ramli, Youssef; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis and density functional theory study of 1-nonyl-3-phenylquinoxalin-2-one
Acta Crystallographica Section E, 2021, 77, 1037-1042
2243925 CIF
HKL
Paper
C24 H18 Cl3 N O3P 1 21/n 115.0134; 8.1336; 18.2841
90; 104.307; 90
2163.48Atioğlu, Zeliha; Akkurt, Mehmet; Mammadova, Gunay Z.; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of 2,2,2-trichloro-<i>N</i>,<i>N</i>-bis{[(1<i>RS</i>,4<i>SR</i>)-1,4-dihydro-1,4-epoxynaphthalen-1-yl]methyl}acetamide
Acta Crystallographica Section E, 2021, 77, 1048-1053
2243926 CIF
HKL
Paper
C99.45 H94.9 B2 Cl2.9 Mn2 N6 O6P -111.6553; 13.6846; 16.1109
96.842; 105.959; 111.907
2220.3Frey, Steven T.; Ballot, Jasper G.; Hands, Allison; Cirka, Haley A.; Rinaolo, Katheryn C.; Phalkun, Nich N.; Kaur, Manpreet; Jasinski, Jerry P.
Geometrical variations of two manganese(II) complexes with closely related quinoline-based tripodal ligands
Acta Crystallographica Section E, 2021, 77, 982-988
2243927 CIF
HKL
C50 H52 B Mn N3 O5P 1 21/c 110.3504; 17.4824; 23.9618
90; 96.222; 90
4310.3Frey, Steven T.; Ballot, Jasper G.; Hands, Allison; Cirka, Haley A.; Rinaolo, Katheryn C.; Phalkun, Nich N.; Kaur, Manpreet; Jasinski, Jerry P.
Geometrical variations of two manganese(II) complexes with closely related quinoline-based tripodal ligands
Acta Crystallographica Section E, 2021, 77, 982-988
2243928 CIF
HKL
Paper
C15 H18 N4 O2P 1 21/c 114.3158; 8.3972; 13.0871
90; 108.04; 90
1495.9Pokhodylo, Nazariy T.; Slyvka, Yurii; Pavlyuk, Volodymyr
Synthesis, crystal structure and Hirshfeld surface analysis of 5-cyclopropyl-<i>N</i>-(2-hydroxyethyl)-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazole-4-carboxamide
Acta Crystallographica Section E, 2021, 77
2243929 CIF
HKL
Paper
C19 H28 N2 O5 SP -18.5368; 9.6594; 13.5173
75.947; 79.302; 74.554
1033.47Mambourg, Kalina; Tumanov, Nikolay; Henon, Gilles; Lanners, Steve; Garcia-Ladona, Javier; Wouters, Johan
Crystal structures of two alanylpiperidine analogues
Acta Crystallographica Section E, 2021, 77
2243930 CIF
HKL
Paper
C17 H24 N2 O5 SP 1 21/n 112.1013; 12.3092; 12.4348
90; 100.546; 90
1820.97Mambourg, Kalina; Tumanov, Nikolay; Henon, Gilles; Lanners, Steve; Garcia-Ladona, Javier; Wouters, Johan
Crystal structures of two alanylpiperidine analogues
Acta Crystallographica Section E, 2021, 77
2243931 CIF
HKL
Paper
C21 H25 N O3P 1 21 115.7976; 5.9184; 19.534
90; 90.31; 90
1826.33Martens, Viktor; Görls, Helmar; Imhof, Wolfgang
Crystal structure of 2-oxo-1,2-diphenylethyl diisopropylcarbamate
Acta Crystallographica Section E, 2021, 77
2243932 CIF
HKL
Paper
C31 H28 F3 N O5 SP 1 21/n 111.1507; 18.4653; 12.8519
90; 91.786; 90
2644.9Atioğlu, Zeliha; Akkurt, Mehmet; Mammadova, Gunay Z.; Mlowe, Sixberth
Crystal structure and Hirshfeld surface analysis of (3a<i>SR</i>,6<i>RS</i>,6a<i>SR</i>,7<i>RS</i>,11b<i>SR</i>,11c<i>RS</i>)-2,2-dibenzyl-2,3,6a,11c-tetrahydro-1<i>H</i>,6<i>H</i>,7<i>H</i>-3a,6:7,11b-diepoxydibenzo[<i>de</i>,<i>h</i>]isoquinolin-2-ium trifluoromethanesulfonate
Acta Crystallographica Section E, 2021, 77
2243933 CIF
HKL
Paper
C3 H6 N4 O2P n a 2110.7174; 13.8944; 4.0643
90; 90; 90
605.22Domasevitch, Kostiantyn V.; Senchyk, Ganna A.; Lysenko, Andrey B.; Rusanov, Eduard B.
Hydrogen-bonding landscape of the carbamoylcyanonitrosomethanide anion in the crystal structure of its ammonium salt
Acta Crystallographica Section E, 2021, 77
2243934 CIF
HKL
Paper
C9 H7 N O3P 1 21 16.8165; 4.4676; 13.2879
90; 95.1319; 90
403.04Poirot, Alexandre; Saffon-Merceron, Nathalie; Leygue, Nadine; Benoist, Eric; Fery-Forgues, Suzanne
Crystal structure of methyl 1,3-benzoxazole-2-carboxylate
Acta Crystallographica Section E, 2021, 77
2243935 CIF
HKL
Paper
C16 H17 N OP b c a7.6699; 11.608; 30.1431
90; 90; 90
2683.7Kansiz, Sevgi; Gul, Adem; Dege, Necmi; Agar, Erbil; Saif, Eiad
Crystal structure and Hirshfeld surface analysis of (<i>Z</i>)-2-{[(2,4-dimethylphenyl)imino]methyl}-4-methylphenol
Acta Crystallographica Section E, 2021, 77
2243936 CIF
HKL
C24 H36 N4 O6 Si2I 1 2/c 112.9641; 16.8966; 13.1085
90; 101.198; 90
2816.7Böhme, Uwe; Schwarzer, Anke; Günther, Betty
Formation of a macrocycle from dichlorodimethylsilane and a pyridoxalimine Schiff base ligand
Acta Crystallographica Section E, 2021, 77
2243937 CIF
HKL
Paper
C6 H N8 O8 RbC 1 2/c 119.44; 8.607; 16.0977
90; 115.264; 90
2435.8Domasevitch, Kostiantyn V.; Ponomarova, Vira V.
Isostructural rubidium and caesium 4-(3,5-dinitropyrazol-4-yl)-3,5-dinitropyrazolates: crystal engineering with polynitro energetic species
Acta Crystallographica Section E, 2021, 77
2243938 CIF
HKL
Paper
C6 H Cs N8 O8C 1 2/c 119.944; 8.6307; 16.2083
90; 113.766; 90
2553.4Domasevitch, Kostiantyn V.; Ponomarova, Vira V.
Isostructural rubidium and caesium 4-(3,5-dinitropyrazol-4-yl)-3,5-dinitropyrazolates: crystal engineering with polynitro energetic species
Acta Crystallographica Section E, 2021, 77
2243939 CIF
HKL
Paper
C30 H58 Co N20 O2 S2P 1 21/c 113.0008; 12.5903; 12.9988
90; 114.899; 90
1929.93Krebs, Christoph; Ceglarska, Magdalena; Näther, Christian
Synthesis and crystal structure of diaquabis(hexamethylenetramine-κ<i>N</i>)bis(thiocyanato-κ<i>N</i>)cobalt(II)–hexamethylenetetramine–acetonitrile (1/2/2)
Acta Crystallographica Section E, 2021, 77
2243940 CIF
HKL
Paper
C32 H46 Cl4 N6 Ni2 O2P 1 21 113.3729; 8.9363; 16.4248
90; 114.014; 90
1792.9Homrani, Yasmina; Dahdouh, Abdelaziz; El Amrani, Mohamed Amin; Loxq, Pauline; Capet, Frédéric; Suisse, Isabelle; Sauthier, Mathieu
Synthesis and crystal structure of a new chiral α-aminooxime nickel(II) complex
Acta Crystallographica Section E, 2021, 77
2243941 CIF
HKL
Paper
C16 H20 Co N6 S2P 1 21/m 15.3708; 15.22; 11.8014
90; 99.076; 90
952.61Krebs, Christoph; Jess, Inke; Näther, Christian
Comparison of the crystal structures of the low- and high-temperature forms of bis[4-(dimethylamino)pyridine]dithiocyanatocobalt(II)
Acta Crystallographica Section E, 2021, 77
2243942 CIF
HKL
Paper
C16 H20 Co N6 S2P 1 21/c 113.9171; 9.5114; 14.4487
90; 90.489; 90
1912.52Krebs, Christoph; Jess, Inke; Näther, Christian
Comparison of the crystal structures of the low- and high-temperature forms of bis[4-(dimethylamino)pyridine]dithiocyanatocobalt(II)
Acta Crystallographica Section E, 2021, 77
2243943 CIF
HKL
Paper
C12 H26 Hg N2 O2 S4P b c n12.235; 8.017; 21.251
90; 90; 90
2084Qadir, Adnan M.; Kansiz, Sevgi; Dege, Necmi; Saif, Eiad
Crystal structure and Hirshfeld surface analysis of bis[(ethoxymethanethioyl)sulfanido](<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethane-1,2-diamine)mercury(II)
Acta Crystallographica Section E, 2021, 77
2243968 CIF
HKL
Paper
C26 H24 N2 O2 S2P b c a9.6963; 17.6307; 25.7044
90; 90; 90
4394.2Yennawar, Hemant P.; Medica, Joseph J.; Silverberg, Lee J.
Synthesis and crystal structure of racemic (<i>R</i>*,<i>R</i>*)-2,2'-(1,4-phenylene)bis(3-phenyl-2,3,5,6-tetrahydro-4<i>H</i>-1,3-thiazin-4-one)
Acta Crystallographica Section E, 2021, 77, 1263-1266
2243969 CIF
HKL
Paper
C14 H18 K4 N8 Ni2 O17P 1 21/c 120.3825; 7.7039; 17.3078
90; 98.24; 90
2689.7Plutenko, Maksym O.; Haukka, Matti; Husak, Alina O.; Golenya, Irina A.; Mulloev, Nurullo U.
A second solvatomorph of poly[[μ~4~-<i>N</i>,<i>N</i>'-(1,3,5-oxadiazinane-3,5-diyl)bis(carbamoylmethanoato)]nickel(II)dipotassium]: crystal structure, Hirshfeld surface analysis and semi-empirical geometry optimization
Acta Crystallographica Section E, 2021, 77, 1289-1295
2243970 CIF
HKL
Paper
Pb2 Rh0.95I 4/m c m6.7068; 6.7068; 5.8623
90; 90; 90
263.69Mochiku, Takashi; Matsushita, Yoshitaka; Subotić, Nikola; Kashiwagi, Takanari; Kadowaki, Kazuo
Redetermination of the crystal structure of RhPb~2~ from single-crystal X-ray diffraction data, revealing a rhodium deficiency
Acta Crystallographica Section E, 2021, 77, 1327-1329
2243971 CIF
HKL
Paper
C14 H22 Au Br2 I N4P -18.4676; 8.8248; 14.0119
76.374; 85.32; 85.251
1011.99Büssing, Rolf; Ott, Ingo; Jones, Peter G.
Crystal structures of the gold NHC complex bis(4-bromo-1,3-diethylimidazol-2-ylidene)gold(I) iodide and its 1:1 adduct with <i>trans</i>-bis(4-bromo-1,3-diethyl-imidazol-2-ylidene)diiodidogold(III) iodide
Acta Crystallographica Section E, 2021, 77, 1249-1252
2243972 CIF
HKL
Paper
C28 H44 Au2 Br4 I4 N8P -18.0245; 8.5782; 15.9814
91.228; 96.517; 92.255
1091.77Büssing, Rolf; Ott, Ingo; Jones, Peter G.
Crystal structures of the gold NHC complex bis(4-bromo-1,3-diethylimidazol-2-ylidene)gold(I) iodide and its 1:1 adduct with <i>trans</i>-bis(4-bromo-1,3-diethyl-imidazol-2-ylidene)diiodidogold(III) iodide
Acta Crystallographica Section E, 2021, 77, 1249-1252
2243973 CIF
HKL
Paper
C17 H20 Cl N5 O4 ZnP 1 21/c 110.6267; 12.8015; 15.1646
90; 104.788; 90
1994.63Shyshkina, Mariia O.; Shishkina, Svitlana V.; Ostras, Konstantin S.; Gorobets, Nikolay Yu.; Chebanov, Valentyn A.; Desenko, Sergey M.
The first coordination complex of (5<i>R</i>,6<i>R</i>,7<i>S</i>)-5-(furan-2-yl)-7-phenyl-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-<i>a</i>]pyrimidin-6-amine with zinc(II) acetate-chloride
Acta Crystallographica Section E, 2021, 77, 1323-1326
2243974 CIF
HKL
Paper
C54 H45 O6 Sb3 TeC 1 2/c 147.714; 9.1176; 22.9324
90; 104.168; 90
9673Domasevitch, Kostiantyn V.; Senchyk, Ganna A.
Tris[triphenylantimony(V)]hexa(μ-oxido)tellurium(VI): a molecular complex with six Te—O—Sb bridges
Acta Crystallographica Section E, 2021, 77, 1229-1233
2243975 CIF
HKL
Paper
C19 H27 Cl2 N5 O2P -17.1579; 8.8119; 17.415
80.357; 80.805; 68.919
1004.51Merabet, Layachi; Tassé, Marine; Mallet-Ladeira, Sonia; Kaboub, Lakhemici; Malfant, Isabelle
Crystal structure of 1,1'-(pyridine-2,6-diyl)bis[<i>N</i>-(pyridin-2-ylmethyl)methanaminium] dichloride dihydrate
Acta Crystallographica Section E, 2021, 77, 1296-1298
2243976 CIF
HKL
Paper
C36 H37 F12 Ge I UC 1 2/c 123.647; 21.123; 16.8132
90; 109.727; 90
7905.2Tarlton, Michael L.; Kelley, Steven P.; Walensky, Justin R.
Crystal structures of metallocene complexes with uranium–germanium bonds
Acta Crystallographica Section E, 2021, 77, 1258-1262
2243977 CIF
HKL
C37 H39 F13 Ge UC 1 2/c 134.16; 13.5237; 16.2986
90; 95.028; 90
7500.5Tarlton, Michael L.; Kelley, Steven P.; Walensky, Justin R.
Crystal structures of metallocene complexes with uranium–germanium bonds
Acta Crystallographica Section E, 2021, 77, 1258-1262
2243978 CIF
HKL
Paper
C16 H18 Cl N3 OP 1 21/c 110.5819; 42.705; 7.2531
90; 108.8; 90
3102.8Fritsky, Igor O.; Sirenko, Valerii Y.; Shova, Sergiu; Kucheriv, Olesia I.; Gural'skiy, Il'ya A.
Crystal structure of 9-aminoacridinium chloride <i>N</i>,<i>N</i>-dimethylformamide monosolvate
Acta Crystallographica Section E, 2021, 77, 1303-1306
2243979 CIF
HKL
Paper
C9 H12 N5 PP b c m6.0092; 13.6227; 13.4716
90; 90; 90
1102.81Purdy, Andrew P.; Butcher, Ray J.; Klug, Christopher A.
The structures of 1:1 and 1:2 adducts of phosphanetricarbonitrile with 1,4-diazabicyclo[2.2.2]octane
Acta Crystallographica Section E, 2021, 77, 1190-1196
2243980 CIF
HKL
C15 H24 N7 PP 1 21/m 16.5807; 12.3447; 10.7719
90; 104.555; 90
846.99Purdy, Andrew P.; Butcher, Ray J.; Klug, Christopher A.
The structures of 1:1 and 1:2 adducts of phosphanetricarbonitrile with 1,4-diazabicyclo[2.2.2]octane
Acta Crystallographica Section E, 2021, 77, 1190-1196
2243981 CIF
HKL
Paper
C48 H33 Cl O6P 16.2278; 9.6965; 14.9822
105.288; 97.126; 96.919
854.82Dyakonenko, Viktoriya V.; Shishkina, Svitlana V.; Bogashchenko, Tatiana Yu.; Lyapunov, Alexander Yu.; Kirichenko, Tatiana I.
Fluorenonophane chlorobenzene solvate: molecular and crystal structures
Acta Crystallographica Section E, 2021, 77, 1285-1288
2243982 CIF
HKL
Paper
C16 H14 N2 O2P 1 21/c 18.8644; 19.9222; 8.1736
90; 107.24; 90
1378.59Atioğlu, Zeliha; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Askerova, Ulviyya F.; Mukhtarova, Sevinc H.; Askerov, Rizvan K.; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of 3-[2-(3,5-dimethylphenyl)hydrazinylidene]benzofuran-2(3<i>H</i>)-one
Acta Crystallographica Section E, 2021, 77, 1280-1284
2243983 CIF
HKL
Paper
C68 H46 O20 Sr3P -19.24; 11.33; 19.414
80.147; 81.815; 85.494
1979Usman, Muhammad; Ogebule, Lydia; Castañeda, Raúl; Oskolkov, Evgenii; Timofeeva, Tatiana
Two metal–organic frameworks based on Sr^2+^ and 1,2,4,5-tetrakis(4-carboxyphenyl)benzene linkers
Acta Crystallographica Section E, 2021, 77, 1243-1248
2243984 CIF
HKL
Paper
C40 H32 N2 O10 Sr2P 1 21/c 15.935; 18.613; 16.1256
90; 91.853; 90
1780.43Usman, Muhammad; Ogebule, Lydia; Castañeda, Raúl; Oskolkov, Evgenii; Timofeeva, Tatiana
Two metal–organic frameworks based on Sr^2+^ and 1,2,4,5-tetrakis(4-carboxyphenyl)benzene linkers
Acta Crystallographica Section E, 2021, 77, 1243-1248
2243985 CIF
HKL
Paper
C20 H78 Cu10 N20 O51 S3 Tb2P -19.637; 11.5888; 16.2367
99.6716; 91.3031; 105.312
1719.81Pavlishchuk, Anna V.; Vasylenko, Inna V.; Zeller, Matthias; Addison, Anthony W.
Crystal structure of a Tb^III^–Cu^II^ glycinehydroxamate 15-metallacrown-5 sulfate complex
Acta Crystallographica Section E, 2021, 77, 1197-1202
2243986 CIF
HKL
Paper
C13 H14 N4 OP 1 21 15.2717; 24.9066; 14.8628
90; 96.214; 90
1940.02Gumus, Mustafa Kemal; Sen, Fatih; Kansiz, Sevgi; Dege, Necmi; Saif, Eiad
Crystal structure and Hirshfeld surface analysis of 2-{[(<i>E</i>)-(3-cyclobutyl-1<i>H</i>-1,2,4-triazol-5-yl)imino]methyl}phenol
Acta Crystallographica Section E, 2021, 77, 1267-1271
2243987 CIF
HKL
C21 H12 Ag F7 N4 O3 SP -19.0627; 10.9637; 12.5727
82.4508; 73.7215; 71.549
1136.26Moon, Suk-Hee; Paek, Sanghyun; Kang, Youngjin
Synthesis, crystal structure and photophysical properties of bis[2,6-difluoro-3-(pyridin-2-yl)pyridine-κ<i>N</i>](trifluoromethanesulfonato-κ<i>O</i>)silver(I)
Acta Crystallographica Section E, 2021, 77, 1224-1228
2243988 CIF
HKL
Paper
C24 H110 N16 Ni4 O38 Ta6P -110.5033; 12.098; 13.864
73.748; 80.918; 80.842
1657.75Krause, Dana-Céline; Näther, Christian; Bensch, Wolfgang
Synthesis and crystal structure of bis[μ-<i>N</i>,<i>N</i>-bis(2-aminoethyl)ethane-1,2-diamine]bis[<i>N</i>,<i>N</i>-bis(2-aminoethyl)ethane-1,2-diamine]-μ~4~-oxido-hexa-μ~3~-oxido-octa-μ~2~-oxido-tetraoxidotetranickel(II)hexatantalum(V) nonadecahydrate
Acta Crystallographica Section E, 2021, 77, 1253-1257
2243989 CIF
HKL
Paper
O8 Sn Te3I a -311.1574; 11.1574; 11.1574
90; 90; 90
1388.96Ketter, Michael; Weil, Matthias
Single crystals of SnTe~3~O~8~ in the millimetre range grown by chemical vapor transport reactions
Acta Crystallographica Section E, 2021, 77, 1276-1279
2243990 CIF
HKL
Paper
Fe K1.65 Na0.35 O12 P3 TiP 21 39.8201; 9.8201; 9.8201
90; 90; 90
947Zatovsky, Igor V.; Strutynska, Nataliia Yu.; Ogorodnyk, Ivan V.; Baumer, Vyacheslav N.; Slobodyanik, Nickolai S.; Butenko, Denis S.
Mixed-metal phosphates K~1.64~Na~0.36~TiFe(PO~4~)~3~ and K~0.97~Na~1.03~Ti~1.26~Fe~0.74~(PO~4~)~3~ with a langbeinite framework
Acta Crystallographica Section E, 2021, 77, 1299-1302
2243991 CIF
HKL
Paper
Fe0.74 K0.97 Na1.03 O12 P3 Ti1.26P 21 39.7945; 9.7945; 9.7945
90; 90; 90
939.608Zatovsky, Igor V.; Strutynska, Nataliia Yu.; Ogorodnyk, Ivan V.; Baumer, Vyacheslav N.; Slobodyanik, Nickolai S.; Butenko, Denis S.
Mixed-metal phosphates K~1.64~Na~0.36~TiFe(PO~4~)~3~ and K~0.97~Na~1.03~Ti~1.26~Fe~0.74~(PO~4~)~3~ with a langbeinite framework
Acta Crystallographica Section E, 2021, 77, 1299-1302
2243992 CIF
HKL
Paper
C11 H11 Br2 NP 21 21 218.7761; 11.3876; 11.8654
90; 90; 90
1185.81Konovalova, Irina S.; Shishkina, Svitlana V.; Kobzev, Dmytro; Semenova, Olha; Tatarets, Anatoliy
Crystal structures and Hirshfeld analysis of 4,6-dibromoindolenine and its quaternized salt
Acta Crystallographica Section E, 2021, 77, 1203-1207
2243993 CIF
HKL
C12 H14 Br2 I NP 1 21/m 18.3507; 7.3719; 11.718
90; 92.755; 90
720.53Konovalova, Irina S.; Shishkina, Svitlana V.; Kobzev, Dmytro; Semenova, Olha; Tatarets, Anatoliy
Crystal structures and Hirshfeld analysis of 4,6-dibromoindolenine and its quaternized salt
Acta Crystallographica Section E, 2021, 77, 1203-1207
2243994 CIF
HKL
Paper
C20 H26 Cu N2 O6P n a 218.3068; 24.328; 10.137
90; 90; 90
2048.6Plyuta, Nataliya; Kokozay, Vladimir N.; Rusanova, Julia A.; Buvailo, Halyna; Goreshnik, Evgeny; Petrusenko, Svitlana
A bis-chelate <i>o</i>-vanillin-2-ethanolamine copper(II) complex bearing both imine and amine forms of the ligand
Acta Crystallographica Section E, 2021, 77, 1272-1275
2243995 CIF
HKL
Paper
C26 H60 Cu N6 O10P 1 21/n 18.5733; 14.2616; 13.9853
90; 97.525; 90
1695.24Yasmin, Sabina; Rabi, Saswata; Chakraborty, Avijit; Kwong, Huey Chong; Tiekink, Edward R. T.; Roy, Tapashi Ghosh
[<i>rac</i>-1,8-Bis(2-carbamoylethyl)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane]copper(II) diacetate tetrahydrate: crystal structure and Hirshfeld surface analysis
Acta Crystallographica Section E, 2021, 77, 1316-1322
2244185 CIF
HKL
Paper
C14 H14 Cl2 N2 O2 ZnP 1 21/n 120.6241; 7.3309; 20.6485
90; 90.532; 90
3121.8Tinapple, Elizabeth; Farrar, Sam; Johnston, Dean H.
Crystal structures and hydrogen-bonding analysis of a series of benzamide complexes of zinc(II) chloride
Acta Crystallographica Section E, 2021, 77, 880-886
2244186 CIF
HKL
Paper
C16 H18 Cl2 N2 O2 ZnP 1 21 17.3802; 8.2491; 14.5953
90; 97.852; 90
880.23Tinapple, Elizabeth; Farrar, Sam; Johnston, Dean H.
Crystal structures and hydrogen-bonding analysis of a series of benzamide complexes of zinc(II) chloride
Acta Crystallographica Section E, 2021, 77, 880-886
2244187 CIF
HKL
Paper
C16 H18 Cl2 N2 O2 ZnC 1 2/c 113.9452; 18.9742; 7.0651
90; 108.021; 90
1777.7Tinapple, Elizabeth; Farrar, Sam; Johnston, Dean H.
Crystal structures and hydrogen-bonding analysis of a series of benzamide complexes of zinc(II) chloride
Acta Crystallographica Section E, 2021, 77, 880-886
2244188 CIF
HKL
Paper
C16 H18 Cl2 N2 O2 ZnP 1 21/c 16.8376; 17.2694; 14.9856
90; 96.893; 90
1756.73Tinapple, Elizabeth; Farrar, Sam; Johnston, Dean H.
Crystal structures and hydrogen-bonding analysis of a series of benzamide complexes of zinc(II) chloride
Acta Crystallographica Section E, 2021, 77, 880-886
2244189 CIF
HKL
Paper
C14 H14 Cl2 N2 O4 ZnC 1 c 17.0532; 21.3776; 11.1181
90; 106.477; 90
1607.5Tinapple, Elizabeth; Farrar, Sam; Johnston, Dean H.
Crystal structures and hydrogen-bonding analysis of a series of benzamide complexes of zinc(II) chloride
Acta Crystallographica Section E, 2021, 77, 880-886
2244190 CIF
HKL
Paper
C23 H25 Br2 N O2P 1 21/n 113.367; 19.966; 16.919
90; 106.099; 90
4338.4Stapf, Manuel; Leibiger, Betty; Schwarzer, Anke; Mazik, Monika
Crystal structures of 2-[3,5-bis(bromomethyl)-2,4,6-triethylbenzyl]isoindoline-1,3-dione and 2-{5-(bromomethyl)-3-[(1,3-dioxoisoindolin-2-yl)methyl]-2,4,6-triethylbenzyl}isoindoline-1,3-dione
Acta Crystallographica Section E, 2021, 77, 919-923
2244191 CIF
HKL
Paper
C31 H29 Br N2 O4P 1 21/n 112.899; 12.9748; 16.763
90; 109.168; 90
2650Stapf, Manuel; Leibiger, Betty; Schwarzer, Anke; Mazik, Monika
Crystal structures of 2-[3,5-bis(bromomethyl)-2,4,6-triethylbenzyl]isoindoline-1,3-dione and 2-{5-(bromomethyl)-3-[(1,3-dioxoisoindolin-2-yl)methyl]-2,4,6-triethylbenzyl}isoindoline-1,3-dione
Acta Crystallographica Section E, 2021, 77, 919-923

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