Crystallography Open Database

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Searching journal of publication like 'Acta Crystallographica Section E'

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9017354 CIFCa0.968 H4 O8 V1.885P -16.2059; 7.0635; 7.7516
93.166; 96.548; 105.883
323.359Kobsch, A.; Downs, R. T.; Domanik, K. J.
Redetermination of metarossite, CaV5+2O6*2H2O
Acta Crystallographica, Section E, 2016, 72, 1280-1284
9017353 CIFAl0.05 Ca1.9 Fe0.07 H8 Mg0.04 Mn1.88 O17 Si4 Sr0.06C 1 2 19.036; 6.1683; 11.9601
90; 91.433; 90
666.409Fendrich, K. V.; Downs, R. T.; Origlieri, M. J.
Redetermination of ruizite, Ca2Mn3+2[Si4O11(OH)](OH)2*2H2O
Acta Crystallographica, Section E, 2016, 72, 959-963
9017352 CIFAs0.02 Fe0.09 H Mn0.82 O9 Pb2 V1.98 Zn0.09P 1 21/m 17.6492; 6.1262; 8.9241
90; 112.195; 90
387.202Lafuente, B.; Downs, R. T.
Redetermination of brackebuschite, Pb2Mn3+(VO4)2(OH)
Acta Crystallographica, Section E, 2016, 72, 293-296
9017351 CIFAl0.534 Ca1.97 Fe1.465 H14 Mg0.5 O20 P3 Sr0.03C 1 2/c 110.1936; 24.1959; 6.3218
90; 91.161; 90
1558.91Lafuente, B.; Downs, R. T.; Yang H and Jenkins, R. A.
Calcioferrite with composition (Ca3.94Sr0.06)Mg1.01(Fe2.93Al1.07)(PO4)6(OH)4*12H2O
Acta Crystallographica, Section E, 2014, 70, 116-117
9017350 CIFAs2.484 Ca0.43 Cu6 Dy0.01 Er0.02 H12.002 Ho0.01 O21.001 P0.516 Y0.52 Yb0.01P 63/m13.5059; 13.5059; 5.8903
90; 90; 120
930.497Morrison, S. M.; Domanik, K. J.; Origlieri, M. J.; Downs, R. T.
Agardite-(Y), Cu2+6Y(AsO4)3(OH)6*3H2O
Acta Crystallographica, Section E, 2013, 69, i61-i62
9017349 CIFCa7 F0.4 Fe0.04 H1.4 K0.89 Li3 Na0.12 O37.4 Si12 Sn0.02 Ti1.8 Zr0.14C 1 2/c 116.9093; 9.7287; 20.9019
90; 112.396; 90
3179.12Andrade, M. B.; Doell, D.; Downs, R. T.; Yang, H.
Redetermination of katayamalite, KLi3Ca7Ti2(SiO3)12(OH)2
Acta Crystallographica, Section E, 2013, 69, i41-i41
9017348 CIFC2 H4 Mn O6C 1 2/c 111.7648; 5.644; 9.6367
90; 125.843; 90
518.704Soleimannejad, J.; Aghabozorg, H.; Hooshmand, S.; Ghadermaz, M.; Gharamaleki, J. A.
The monoclinic polymorph of catena-poly [[diaquamanganese(II)]-mu-oxalato-4O1,O2:O1',O2']
Acta Crystallographica, Section E, 2007, 63, m2389-m2390
9016656 CIFCa0.18 H2 K0.208 Mg2.305 Mn2.915 Na2.344 O24 Si8C 1 2/m 19.9024; 18.1117; 5.2992
90; 104.034; 90
922.04Barkley, M. C.; Yang, H.; Downs, R. T.
Kozulite, a Mn-rich alkali amphibole
Acta Crystallographica, Section E, 2010, 66, i83-i83
9015960 CIFC3 H16 Eu0.03 Gd0.08 La0.61 Nd0.95 O17 Pr0.17 Sm0.12 Y0.04P c c n8.9391; 9.4694; 16.9374
90; 90; 90
1433.72Morrison, S. M.; Andrade, M. B.; Wenz, M. D.; Domanik, K. J.; Downs, R. T.
Lanthanite-(Nd), Nd2(CO3)3*8H2O
Acta Crystallographica, Section E, 2013, 69, i15-i16
9014116 CIFCa0.25 Ce0.348 Fe0.03 Gd0.01 La0.12 Nb1.14 Nd0.14 O6 Pr0.04 Sm0.02 Sr0.01 Th0.06 Ti0.86 Y0.02P n m a11.0563; 7.56; 5.3637
90; 90; 90
448.328Morrison, S. M.; Downs, R. T.; Domanik, K. J.; Yang, H.; Doell, D.
Nioboaeschynite-(Ce), Ce(NbTi)O6
Acta Crystallographica, Section E, 2012, 68, i64-i65
9013405 CIFF2 Fe H4 K2 O8 P2P 1 21/c 14.7586; 8.253; 10.758
90; 92.845; 90
421.975Mi, J. X.; Wang, C. X.; Wei, Z. B.; Chen, F. J.; Xu, C. Y.; Mao, S. Y.
K2Fe[H(HPO4)2]F2
Acta Crystallographica, Section E, 2005, 61, i143-i145
9011401 CIFAs3 Ba5 Cl O12P 63/m10.557; 10.557; 7.73912
90; 90; 120
746.97Bell, A. M. T.; Henderson, C. M. B.; Wendlandt, R. F.; Harrison, W. J.
Rietveld refinement of Ba5(AsO4)3Cl from high-resolution synchrotron data
Acta Crystallographica, Section E, 2008, 64, i63-i64
9011400 CIFAs2 Co0.61 Fe0.17 Ni0.22P n n m5.0669; 5.8739; 3.1346
90; 90; 90
93.293Yang, H.; Downs, R. T.; Eichler, C.
Safflorite, (Co,Ni,Fe)As2, isomorphous with marcasite
Acta Crystallographica, Section E, 2008, 64, i62-i62
9011399 CIFAs0.916 Cu2 H O5 P0.084P 21/n 1 18.5844; 8.2084; 5.9258
90.13; 90; 90
417.556Li, C.; Yang, H.; Downs, R. T.
Redetermination of olivenite from an untwinned single-crystal Note: RRUFF ID: R040181
Acta Crystallographica, Section E, 2008, 64, i60-i61
9011397 CIFFe2.75 Na O10 Si3P -110.3355; 10.7847; 8.9142
105.048; 96.461; 125.302
738.372Burt, J. B.; Downs, R. T.; Costin, G.
Single-crystal X-ray refinement of wilkinsonite, Na2Fe2+4Fe3+2Si6O20.
Acta Crystallographica, Section E, 2007, 63, i122-i124
9011395 CIFAs Ca Co0.95 Cu0.05 H O5P 21 21 217.4919; 8.9946; 5.9158
90; 90; 90
398.646Yang, H.; Costin, G.; Keogh, J.; Lu, R.; Downs, R. T.
Cobaltaustinite, CaCo(AsO4)(OH)
Acta Crystallographica, Section E, 2007, 63, i53-i55
9008009 CIFC4 Mg2 Na6 O16 SF d -3 :213.9038; 13.9038; 13.9038
90; 90; 90
2687.82Schmidt, G. R.; Reynard, J.; Yang, H.; Downs, R. T.
Tychite, Na6Mg2(SO4)(CO3)4: Structure analysis and Raman spectroscopic data
Acta Crystallographica, Section E, 2006, 62, i207-i209
9008008 CIF
Paper
Sc2 Te3F d d d :28.2223; 11.6292; 24.6085
90; 90; 90
2353.03Assoud, A.; Kleinke, H.
The sesquitelluride Sc~2~Te~3~
Acta Crystallographica Section E, 2006, 62, i17-i18
9008005 CIFFe2 H5 Na O11 P2P 1 21/n 19.766; 9.692; 9.811
90; 102.53; 90
906.514Gao, S.; Ng, S. W.
Sodium diiron(III) diphosphate hydroxide dihydrate
Acta Crystallographica, Section E, 2005, 61, i268-i269
9008002 CIFCl2 O2 SrC c c e :15.9799; 12.7519; 5.9787
90; 90; 90
455.906Smolentsev, A. I.; Naumov, D. Y.
Strontium chlorite, Sr(ClO2)2, from X-ray powder diffraction data
Acta Crystallographica, Section E, 2005, 61, i249-i250
9008001 CIFCa Cl2 O2C c c e :15.7434; 12.6002; 5.7405
90; 90; 90
415.428Smolentsev, A. I.; Naumov, D. Y.
Calcium chlorite, Ca(ClO2)2, from X-ray powder diffraction data
Acta Crystallographica, Section E, 2005, 61, i246-i248
9008000 CIFB8 Ca H4 O15P 1 21 17.481; 8.2693; 9.859
90; 108.76; 90
577.502Wiggin, S. B.; Weller, M. T.
Redetermination of CaB8O11(OH)4 at low temperature Note: T = 120 K
Acta Crystallographica, Section E, 2005, 61, i243-i245
9007999 CIFMg O5 Te2P b c n7.2391; 10.658; 5.988
90; 90; 90
462Weil, M.
Redetermination of MgTe2O5
Acta Crystallographica, Section E, 2005, 61, i237-i239
9007998 CIFCr4 K0.31 Li4.998 Na0.69 O24 P6R -3 :H8.3; 8.3; 22.469
90; 90; 120
1340.51Kouass, S.; Boughzala, H.
NASICON-type Li2.5K0.16Na0.34Cr2(PO4)3
Acta Crystallographica, Section E, 2005, 61, i231-i233
9007997 CIFAs2 Ca1.5 Na Nb2 O12C 1 2/c 16.73; 22.302; 7.4309
90; 113.827; 90
1020.26Amor, R. B.; Zid, M. F.
NaCa1.5(NbO)2O2(AsO4)2
Acta Crystallographica, Section E, 2005, 61, i228-i230
9007994 CIFBa5 Cl O12 V3P 63/m10.5565; 10.5565; 7.7584
90; 90; 120
748.76Roh, Y. H.; Hong, S. T.
Apatite-type Ba5(VO4)3Cl
Acta Crystallographica, Section E, 2005, 61, i140-i142
9007991 CIF
Paper
K Nb5 O13P b c m5.672; 10.737; 16.742
90; 90; 90
1019.59Kwak, J.; Yun, H.; Chae, H. K.
A new potassium niobate, KNb~5~O~13~
Acta Crystallographica Section E, 2005, 61, i132-i134
9007990 CIFH8 Ni O12 P2 Zn2P n m a10.562; 18.224; 5.0133
90; 90; 90
964.969Wu, W. Y.; Liang, X. Q.; Li, Y. Z.
NiZn2(PO4)2*4H2O, a nickel-doped modification of hopeite
Acta Crystallographica, Section E, 2005, 61, i108-i110
9007989 CIFCo H8 O12 P2 Zn2P n m a10.568; 18.258; 5.025
90; 90; 90
969.576Wu, W. Y.; Liang, X. Q.; Li, Y. Z.
CoZn2(PO4)2*4H2O, a cobalt-doped modification of hopeite
Acta Crystallographica, Section E, 2005, 61, i105-i107
9007988 CIFCd O3 SiP 1 21/c 16.9463; 7.2563; 15.0697
90; 94.791; 90
756.926Weil, M.
Parawollastonite-type Cd3[Si3O9]
Acta Crystallographica, Section E, 2005, 61, i102-i104
9007987 CIFH8 Mn2 N2 O12 S3P 21 310.188; 10.188; 10.188
90; 90; 90
1057.47Zhang, X. M.; Hao, Z. M.; Ng, S. W.
Langbeinite-type (NH4)2Mn2(SO4)3
Acta Crystallographica, Section E, 2005, 61, i82-i83
9007986 CIFCe2 O7 Si2P 416.7964; 6.7964; 24.7282
90; 90; 90
1142.22Deng, B.; Ibers, J. A.
Dicerium disilicate, Ce2[Si2O7]
Acta Crystallographica, Section E, 2005, 61, i76-i78
9007985 CIFAs4 Fe3 K3 O16C m c e10.898; 21.521; 6.623
90; 90; 90
1553.33Ouerfelli, N.; Zid, M. F.; Jouini, T.
Compose a charpente bidimensionnelle K3Fe3(AsO4)4
Acta Crystallographica, Section E, 2005, 61, i67-i69
9007984 CIFCs2 O15 Si6 ThP c a 2116.292; 7.2154; 13.68
90; 90; 90
1608.13Woodward, J. D.; Almond, P. M.; Albrecht-Schmitt T E
Caesium thorium silicate, Cs2ThSi6O15
Acta Crystallographica, Section E, 2005, 61, i58-i60
9007983 CIFCa0.312 Fe2 Mg Na0.376 O12 P3C 1 2/c 111.852; 12.458; 6.3861
90; 113.84; 90
862.47Zid, M. F.; Driss, A.; Jouini, T.
(Na0.38,Ca0.31)MgFe2P3O12
Acta Crystallographica, Section E, 2005, 61, i46-i48
9007978 CIFLi O12 P4 YbC 1 2/c 116.194; 7.024; 9.498
90; 125.91; 90
875.031Zarkouna, E. B.; Driss, A.
LiYb(PO3)4
Acta Crystallographica, Section E, 2004, 60, i102-i104
9007976 CIFCr H28 N O20 S2P a -312.2491; 12.2491; 12.2491
90; 90; 90
1837.86Rempfer, N.; Lerner, H. W.; Bolte, M.
The ammonium chromium(III) alum NH4Cr(SO4)2*12H2O
Acta Crystallographica, Section E, 2004, 60, i80-i81
9007972 CIFBr Eu IP n m a8.3723; 4.7404; 9.799
90; 90; 90
388.903Liao, W.; Liu, X.; Dronskowski, R.
Europium(II) bromide iodide
Acta Crystallographica, Section E, 2004, 60, i69-i71
9007966 CIFCl2 Cu H16 O16P 1 21/c 16.2908; 12.4043; 9.2181
90; 106.146; 90
690.943Li, X. H.; Xia, F. Y.; Xiao, H. P.; Hu, M. L.
Hexaaquacopper(II) diperchlorate dihydrate
Acta Crystallographica, Section E, 2004, 60, i31-i32
9007965 CIFCs La O12 P4P 1 21 17.218; 9.254; 8.864
90; 99.377; 90
584.163Sun, T.; Shen, G.; Wang, X.; Wang, R.; Wei, J.; Shen, D.
CsLa(PO3)4
Acta Crystallographica, Section E, 2004, 60, i28-i30
9007962 CIFCa K O9 P3P -6 c 26.809; 6.809; 10.376
90; 90; 120
416.608Sandstrom, M.; Bostrom, D.
Calcium potassium cyclo-triphosphate
Acta Crystallographica, Section E, 2004, 60, i15-i17
9007960 CIFRb2 S4 WP n m a9.6254; 7.0218; 12.3761
90; 90; 90
836.471Yao, J.; Ibers, J. A.
Dirubidium tetrathiotungstate, Rb2[WS4]
Acta Crystallographica, Section E, 2004, 60, i10-i11
9007959 CIFNa3 O S3 VC m c 219.6673; 11.9122; 5.8846
90; 90; 90
677.664Huang, F. Q.; Ibers, J. A.
Na3VOS3
Acta Crystallographica, Section E, 2004, 60, i6-i7
9007957 CIFCr3 Cs2 O10P b c a11.887; 9.671; 19.493
90; 90; 90
2240.9Kolitsch, U.
alpha-Cs2Cr3O10
Acta Crystallographica, Section E, 2003, 59, i164-i166
9007954 CIFFe1.839 H Mg0.161 O5 PP 1 21/a 112.274; 13.169; 9.754
90; 108.64; 90
1493.9Kolitsch, U.
Mg-rich wolfeite, (Fe,Mg)2(PO4)(OH): structure refinement and Raman spectroscopic data
Acta Crystallographica, Section E, 2003, 59, i125-i128
9007953 CIFSe3 Yb2F d d d :28.0183; 11.272; 23.961
90; 90; 90
2165.65Assoud, A.; Kleinke, H.
Ytterbium sesquiselenide Yb2Se3
Acta Crystallographica, Section E, 2003, 59, i103-i104
9007952 CIFLi3 O4 TaC 1 2/c 18.508; 8.516; 9.338
90; 116.869; 90
603.535du Boulay, D.; Sakaguchi, A.; Suda, K.; Ishizawa, N.
Reinvestigation of beta-Li3TaO4
Acta Crystallographica, Section E, 2003, 59, i80-i82
9007947 CIFLi3 Mo3 O12 ScP n m a5.13; 10.56; 17.745
90; 90; 90
961.296Kolitsch, U.; Tillmanns, E.
Li3Sc(MoO4)3: substitutional disorder on three (Li,Sc) sites
Acta Crystallographica, Section E, 2003, 59, i55-i58
9007946 CIFH8 K2 O16 P4 ZnP -16.827; 7.333; 7.57
80.753; 72.547; 83.442
355.949Tahiri, A. A.; ouarsal R; Lachkar, M.; Zavalij, P. Y.; El Bali, B.
Dipotassium zinc bis(dihydrogendiphosphate) dihydrate, K2Zn(H2P2O7)2*2H2O
Acta Crystallographica, Section E, 2003, 59, i50-i52
9007944 CIFBi3.041 Mo2 O12 Sc0.959C 1 2/c 116.996; 11.601; 5.319
90; 104.67; 90
1014.56Kolitsch, U.; Tillmanns, E.
Bi3ScMo2O12: the difference from Bi3FeMo2O12
Acta Crystallographica, Section E, 2003, 59, i43-i46
9007943 CIFB4 Hg O7P b c a8.3994; 8.8066; 14.137
90; 90; 90
1045.72Weil, M.
HgB4O7, a member of the isotypic MIIB4O7 family (MII = Mg, Mn, Zn, Cd)
Acta Crystallographica, Section E, 2003, 59, i40-i42
9007941 CIFH8 Mg Na O10 P3P b c a14.806; 9.078; 14.811
90; 90; 90
1990.73Ouarsal, R.; Tahiri, A. A.; Lachkar, M.; Dusek, M.; Fejfarova, K.; El Bali, B.
Sodium magnesium tris(dihydrogenphosphite) monohydrate, NaMg(H2PO3)3*H2O
Acta Crystallographica, Section E, 2003, 59, i33-i35
9007938 CIFAl Ba Ca F7P 1 2/n 15.3664; 5.3846; 18.8262
90; 92.319; 90
543.555Werner, F.; Weil, M.
alpha-BaCaAlF7
Acta Crystallographica, Section E, 2003, 59, i17-i19
9007937 CIFAl Mo2 Na O8C 1 2/c 19.621; 5.339; 13.146
90; 90.01; 90
675.264Kolitsch, U.; Macka, M.; Hanuza, J.
NaAl(MoO4)2: a rare structure type among layered yavapaiite-related AM(XO4)2 compounds
Acta Crystallographica, Section E, 2003, 59, i10-i13
9007935 CIFAl Cs Mo2 O8P -3 m 15.551; 5.551; 8.037
90; 90; 120
214.47Tomaszewski, P. E.; Pietraszko, A.; Maczka, M.; Hanuza, J.
CsAl(MoO4)2
Acta Crystallographica, Section E, 2002, 58, i119-i120
9007932 CIFCl Cr K O3P 1 21/c 17.838; 7.493; 7.812
90; 91.4; 90
458.663Kolitsch, U.
Redetermination of potassium chlorochromate, KCrO3Cl
Acta Crystallographica, Section E, 2002, 58, i105-i107
9007925 CIFDy4 S12 Si3P 1 21/n 19.813; 10.9387; 16.36
90; 102.86; 90
1712.06Hatscher, S. T.; Urland, W.
Dysprosium thiosilicate, Dy4(SiS4)3
Acta Crystallographica, Section E, 2002, 58, i74-i75
9007924 CIFO13 Si3 Sm5P 63/m9.4959; 9.4959; 7.0361
90; 90; 120
549.459Morgan, M. G.; Wang, M.; Mar, A.
Samarium orthosilicate oxyapatite, Sm5(SiO4)3O
Acta Crystallographica, Section E, 2002, 58, i70-i71
9007923 CIFCl2 Hg N4 O6P n m a15.5758; 5.4976; 11.2826
90; 90; 90
966.124Nockemann, P.; Meyer, G.
Ammonium mercury(II) dichloride nitrate, (NH4)2HgCl2(NO3)2
Acta Crystallographica, Section E, 2002, 58, i68-i69
9007921 CIFMn O5 Te2P b c n7.3114; 10.9216; 6.1711
90; 90; 90
492.776Johnston, M. G.; Harrison, W. T. A.
Manganese tellurite, beta-MnTe2O5
Acta Crystallographica, Section E, 2002, 58, i59-i61
9007917 CIFCo2 O7 P2P 1 21/c 17.0022; 8.3634; 9.0114
90; 113.6; 90
483.59Bali, B. E.; Bolte, M.
Rerefinement of cobalt diphosphate against new intensity data
Acta Crystallographica, Section E, 2002, 58, i32-i33
9007916 CIFMg O7 P2 SrP 1 21/n 15.3046; 8.3053; 12.7
90; 90.502; 90
559.493Tahiri, A. A.; Bali, B. E.; Lachkar, M.; Ouarsal, R.; Zavalij, P. Y.
SrMgP2O7
Acta Crystallographica, Section E, 2002, 58, i9-i11
9007915 CIFH12 Mg O10 SeC 1 2/c 110.224; 7.37; 24.866
90; 98.41; 90
1853.53Kolitsch, U.
Magnesium selenate hexahydrate, MgSeO4*6H2O
Acta Crystallographica, Section E, 2002, 58, i3-i5
9007913 CIFH Mn O5 Pb VP n m a7.646; 6.179; 9.507
90; 90; 90
449.155Kolitsch, U.
Refinement of pyrobelonite, PbMnIIVO4(OH), a member of the descloizite group
Acta Crystallographica, Section E, 2001, 57, i119-i121
9007910 CIFCu H10 O9 SeP -16.083; 6.226; 10.867
77.14; 82.2; 72.91
382.43Kolitsch, U.
Copper(II) selenate pentahydrate, CuSeO4*5H2O
Acta Crystallographica, Section E, 2001, 57, i104-i105
9007909 CIFLu Mn O3P 63 c m6.038; 6.038; 11.361
90; 90; 120
358.702Van Aken, B. B.; Meetsma, A.; Palstra, T. T. M.
Hexagonal LuMnO3 revisited
Acta Crystallographica, Section E, 2001, 57, i101-i103
9007907 CIFC2 H6 K4 O9C 1 2/c 111.8175; 13.7466; 7.1093
90; 120.769; 90
992.34Skakle, J. M. S.; Wilson, M.; Feldman, J.
Dipotassium carbonate sesquihydrate: rerefinement against new intensity data
Acta Crystallographica, Section E, 2001, 57, i94-i97
9007906 CIFFe0.05 Mn0.95 SP 63 m c3.982; 3.982; 6.445
90; 90; 120
88.503Eriksson, L.; Kalinowski, M. P.
Mn1-xFexS, x=0.05, an example of an anti-wurtzite structure
Acta Crystallographica, Section E, 2001, 57, i92-i93
9007905 CIFMn O3 YbP 63 c m6.0584; 6.0584; 11.3561
90; 90; 120
360.974Van Aken, B. B.; Meetsma, A.; Palstra, T. T. M.
Hexagonal YbMnO3 revisited
Acta Crystallographica, Section E, 2001, 57, i87-i89
9007904 CIFB Ga O4 PbP n m a6.9944; 5.8925; 8.2495
90; 90; 90
339.999Park, H.; Barbier, J.
PbGaBO4, an orthoborate with a new structure-type
Acta Crystallographica, Section E, 2001, 57, i82-i84
9007902 CIFH10 Na2 O8 S2P 1 21/c 15.947; 21.574; 7.526
90; 103.82; 90
937.637Prasad S M Rani A
Rerefinement of sodium thiosulfate pentahydrate
Acta Crystallographica, Section E, 2001, 57, i67-i69
9007898 CIFC3 Na4 O11 UP -3 c 19.338; 9.338; 12.817
90; 90; 120
967.887Cisarova, I.; Skala, R.; Ondrus, P.; Drabek, M.
Trigonal Na4[UO2(CO3)3] Note: synthetic polymorph of cejkaite
Acta Crystallographica, Section E, 2001, 57, i32-i34
9007897 CIFNi3 O14 P4 SrP 1 21/c 17.4116; 7.6542; 9.4486
90; 112.194; 90
496.304Bolte, M.
SrNi3(P2O7)2
Acta Crystallographica, Section E, 2001, 57, i30-i31
9007895 CIFFe H14 O11 SP 1 21/c 113.9969; 6.4803; 11.0211
90; 105.596; 90
962.853Fronczek, F. R.; Collins, S. N.; Chan, J. Y.
Refinement of ferrous sulfate heptahydrate (melanterite) with low-temperature CCD data Note: T = 120 K Locality: synthetic
Acta Crystallographica, Section E, 2001, 57, i26-i27
9007894 CIFH4 Mg O5 SeP 1 21/n 16.4818; 8.7975; 7.6367
90; 98.753; 90
430.401Johnston, M. G.; Harrison, W. T. A.
Magnesium selenite dihydrate, MgSeO3*2H2O
Acta Crystallographica, Section E, 2001, 57, i24-i25
9007893 CIFAs2 Cd O6P -3 1 m4.8269; 4.8269; 4.866
90; 90; 120
98.184Weil, M.
Cadmium(II) metaarsenate(V), CdAs2O6
Acta Crystallographica, Section E, 2001, 57, i22-i23
2311093 CIFHf Na2 O7 Si2P -16.6123; 8.7948; 5.41074
92.603; 94.0843; 71.3262
297.249Massoni, Nicolas; Pierrick, Chevreux
Crystal structure of Na~2~HfSi~2~O~7~ by Rietveld refinement
Acta Crystallographica, Section e, 2016, 72, 1434
2244218 CIF
HKL
Paper
C14 H10 S2P b c a7.84; 16; 18.51
90; 90; 90
2322Brown, Loren C.; Ghiassi, Kamran B.; Fulton, Ashley C.; Thum, Matthew
Crystal structure of dibenzo[<i>c</i>,<i>e</i>]thiepine-5(7<i>H</i>)-thione
Acta Crystallographica Section E, 2022, 78
2244217 CIF
HKL
Paper
C72 H88 Cu2 N4 O16P 1 21/n 115.542; 14.001; 16.3217
90; 94.791; 90
3539.25Chong, Magdalene W. S.; Ottoboni, Sara; Martin, Alan R. G.; Bowering, Deborah; Price, Chris J.; Nordon, Alison; Oswald, Iain D. H.; Ward, Martin R.
Crystal structure of a copper–mefenamate complex solvated with diglyme and water
Acta Crystallographica Section E, 2022, 78
2244216 CIF
HKL
Paper
C23 H92 Fe4 Li6 N23 Se8P -111.495; 11.665; 22.233
92.885; 92.383; 103.51
2890.7Fuss, Friederike; Thiele, Günther
[Li~6~(C~2~N~2~H~8~)~11.5~][Fe~4~Se~8~]: the first lithium-containing chalcogenidotetraferrate synthesized in solution
Acta Crystallographica Section E, 2022, 78
2244215 CIF
HKL
Paper
C25 H16 N2 O2 SP 1 21/n 110.142; 12.097; 16.2218
90; 104.846; 90
1923.8Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; Arasambattu MohanaKrishnan, K.
Crystal structures of two new carbazole derivatives: ethyl 9-(benzenesulfonyl)-2-(4-fluoro-2-nitrophenyl)-6-methoxy-9<i>H</i>-carbazole-3-carboxylate and 12-(benzenesulfonyl)-12<i>H</i>-quinolino[4,3-<i>b</i>]carbazole
Acta Crystallographica Section E, 2022, 78
2244214 CIF
HKL
Paper
C28 H21 F N2 O7 SP -18.1589; 12.2053; 12.9129
101.569; 93.086; 92.481
1256Madhan, S.; NizamMohideen, M.; Pavunkumar, Vinayagam; Arasambattu MohanaKrishnan, K.
Crystal structures of two new carbazole derivatives: ethyl 9-(benzenesulfonyl)-2-(4-fluoro-2-nitrophenyl)-6-methoxy-9<i>H</i>-carbazole-3-carboxylate and 12-(benzenesulfonyl)-12<i>H</i>-quinolino[4,3-<i>b</i>]carbazole
Acta Crystallographica Section E, 2022, 78
2244213 CIF
HKL
Paper
C72 H112 Dy Mn4 N8 Na O28P 4/n :218.2654; 18.2654; 13.4219
90; 90; 90
4477.9Aziz, Ozha A.; Zeller, Matthias; Zaleski, Curtis M.
Crystal structure of a heterotrimetallic 12-metallacrown-4 with 2-propylvalerate anion bridges
Acta Crystallographica Section E, 2022, 78
2244212 CIF
HKL
Paper
C17 H18 F N5 O2P -17.694; 15.013; 15.281
71.04; 77.874; 87.78
1631.3Richter, Adrian; Goddard, Richard; Schönefeld, Roy; Imming, Peter; Seidel, Rüdiger W.
Structural characterization and antimycobacterial evaluation of a benzimidazole analogue of the antituberculosis clinical drug candidate TBA-7371
Acta Crystallographica Section E, 2022, 78
2244211 CIF
HKL
Paper
C17 H18 O3P 1 21 116.1906; 7.5752; 17.7591
90; 95.36; 90
2168.6Banna, Md. Hasan Al; Ansary, Md. Rezaul Haque; Miyatake, Ryuta; Sheikh, Md. Chanmiya; Zangrando, Ennio
Crystal structure of ethyl 4-[(4-methylbenzyl)oxy]benzoate
Acta Crystallographica Section E, 2022, 78, 1077-1080
2244210 CIF
Paper
C7 H13 N O3P 1 21/n 16.0404; 8.6114; 17.611
90; 98.771; 90
905.35El Mestehdi, Aly Dawa; Abba, Moctar; El Housseine, Mohamed Lemine; Ould Hadou, Abderrahmane; Barry, Aliou Hamady; Ould Elemine, Brahim; Jelsch, Christian; Gaye, Mohamed
Synthesis, crystal structure and Hirshfeld surface analysis of <i>tert</i>-butyl <i>N</i>-acetylcarbamate
Acta Crystallographica Section E, 2022, 78, 1072-1076
2244209 CIF
HKL
Paper
C30 H38 N6 Ni O S2P 1 21/n 110.2275; 25.0468; 12.718
90; 94.6; 90
3247.4Krebs, Christoph; Jess, Inke; Näther, Christian
Syntheses and crystal structures of the ethanol, acetonitrile and diethyl ether Werner clathrates bis(isothiocyanato-κ<i>N</i>)tetrakis(3-methylpyridine-κ<i>N</i>)nickel(II)
Acta Crystallographica Section E, 2022, 78, 993-998
2244208 CIF
HKL
Paper
C30 H34 N8 Ni S2C 1 2/c 118.799; 11.3033; 15.8639
90; 96.825; 90
3347.04Krebs, Christoph; Jess, Inke; Näther, Christian
Syntheses and crystal structures of the ethanol, acetonitrile and diethyl ether Werner clathrates bis(isothiocyanato-κ<i>N</i>)tetrakis(3-methylpyridine-κ<i>N</i>)nickel(II)
Acta Crystallographica Section E, 2022, 78, 993-998
2244207 CIF
HKL
Paper
C30 H40 N6 Ni O2 S2C 1 2/c 118.5763; 11.6179; 15.8998
90; 97.448; 90
3402.51Krebs, Christoph; Jess, Inke; Näther, Christian
Syntheses and crystal structures of the ethanol, acetonitrile and diethyl ether Werner clathrates bis(isothiocyanato-κ<i>N</i>)tetrakis(3-methylpyridine-κ<i>N</i>)nickel(II)
Acta Crystallographica Section E, 2022, 78, 993-998
2244206 CIF
Paper
C12 H19 N3 O8 SP 21 21 218.0717; 9.1135; 22.506
90; 90; 90
1655.6Priyanka, Prabhakar; Jayanna, Bidarur K.; Kiran Kumar, Haruvegowda; Vinaya; Divakara, Thayamma R.; Yathirajan, Hemmige S.; Glidewell, Christopher; Parkin, Sean
Synthesis and crystal structure of topiramate azidosulfate at 90K and 298K
Acta Crystallographica Section E, 2022, 78, 984-988
2244205 CIF
Paper
C12 H19 N3 O8 SP 21 21 217.9857; 9.0145; 22.1621
90; 90; 90
1595.39Priyanka, Prabhakar; Jayanna, Bidarur K.; Kiran Kumar, Haruvegowda; Vinaya; Divakara, Thayamma R.; Yathirajan, Hemmige S.; Glidewell, Christopher; Parkin, Sean
Synthesis and crystal structure of topiramate azidosulfate at 90K and 298K
Acta Crystallographica Section E, 2022, 78, 984-988
2244204 CIF
HKL
Paper
C46 H42 N4 Ni O4P -14.6914; 13.0677; 16.9923
68.441; 83.739; 88.032
963.05Banna, Md. Hasan Al; Howlader, Md. Belayet Hossain; Miyatake, Ryuta; Sheikh, Md. Chanmiya; Zangrando, Ennio
Crystal structure of bis{4-[(4-methylbenzyl)oxy]-<i>N</i>'-(4-methylbenzylidene)benzohydrazidato}nickel(II)
Acta Crystallographica Section E, 2022, 78, 1081-1083
2244203 CIF
HKL
Paper
C34 H26 Cl4 Fe N12 O2P n n a10.4669; 26.589; 12.8313
90; 90; 90
3571Znovjyak, Kateryna; Seredyuk, Maksym; Fritsky, Igor O.; Sliva, Tatiana Y.; Amirkhanov, Vladimir M.; Malinkin, Sergey O.; Shova, Sergiu
Crystal structure of bis{3-(3,5-dichlorophenyl)-5-[6-(1<i>H</i>-pyrazol-1-yl)pyridin-2-yl]-4<i>H</i>-1,2,4-triazol-4-ido}iron(II) methanol disolvate
Acta Crystallographica Section E, 2022, 78
2244202 CIF
HKL
Paper
C12 H16 Cu N6 O12P 1 21/c 15.4741; 22.5679; 7.6478
90; 92.286; 90
944.05Kamolov, Sanjar; Babaev, Bakhrom; Ibragimov, Aziz; Yakubov, Yuldash; Abdullaev, Akhrorjon; Ibragimov, Bakhtiyar; Ashurov, Jamshid
Synthesis, structure and Hirshfeld surface analysis of diaquadinitratobis(4-nitroaniline)copper(II)
Acta Crystallographica Section E, 2022, 78
2244201 CIF
HKL
Paper
C30 H42 N4 O2P b c a12.0297; 14.6357; 32.763
90; 90; 90
5768.4Pollock, Alicia A.; Huther, Holly A.; Birch, Cole M.; Reinheimer, Eric W.; Lewis, David E.; Gerlach, Deidra L.
Crystal structure of 2-(2,2,6,6-tetramethylpiperidin-4-yl)-6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1<i>H</i>-benz[<i>de</i>]isoquinoline-1,3(2<i>H</i>)-dione
Acta Crystallographica Section E, 2022, 78
2244200 CIF
HKL
Paper
C36 H32 Br2 Fe N12 O4P n a 2127.4318; 12.6723; 10.6434
90; 90; 90
3699.9Znovjyak, Kateryna; Fritsky, Igor O.; Sliva, Tatiana Y.; Amirkhanov, Vladimir M.; Malinkin, Sergey O.; Shova, Sergiu; Seredyuk, Maksym
Crystal structure of bis{3-(3-bromo-4-methoxyphenyl)-5-[6-(1<i>H</i>-pyrazol-1-yl)pyridin-2-yl]-1,2,4-triazol-3-ato}iron(II) methanol disolvate
Acta Crystallographica Section E, 2022, 78, 1138-1142
2244199 CIF
HKL
Paper
C8 H7 Cl O2P 1 21/n 14.9172; 12.7016; 11.8573
90; 96.294; 90
736.1Priyanka, Prabhakar; Jayanna, Bidarur K.; Vinaya; Shankara Prasad, Holehundi J.; Divakara, Thayamma R.; Yathirajan, Hemmige S.; Parkin, Sean
Synthesis and crystal structure of 2-chloro-1-(3-hydroxyphenyl)ethanone
Acta Crystallographica Section E, 2022, 78
2244198 CIF
HKL
Paper
C8 H8 O2 S2P c a 2110.7521; 5.5245; 14.48
90; 90; 90
860.1Kellou, Sabah; Brihi, Ouarda; Chetioui, Souheyla; Salah Eddine, Lemallem; Abdelali, Fiala; Boudjada, Ali
Synthesis and crystal structure of 2-(1,3-dithietan-2-ylidene)cyclohexane-1,3-dione
Acta Crystallographica Section E, 2022, 78
2244197 CIF
Paper
C5 H6 O3P 1 21/m 13.8283; 10.972; 6.1096
90; 93.523; 90
256.14Chandrasekaran, Chandru P.; Donahue, James P.
Crystal structure of 4,5-dimethyl-1,3-dioxol-2-one
Acta Crystallographica Section E, 2022, 78
2244196 CIF
HKL
Paper
C38 H38 Fe N12 O2A e a 212.6854; 26.315; 10.6511
90; 90; 90
3555.5Znovjyak, Kateryna; Fritsky, Igor O.; Sliva, Tatiana Y.; Amirkhanov, Vladimir M.; Malinkin, Sergey O.; Shova, Sergiu; Seredyuk, Maksym
Crystal structure of bis{3-(3,4-dimethylphenyl)-5-[6-(1<i>H</i>-pyrazol-1-yl)pyridin-2-yl]-4<i>H</i>-1,2,4-triazol-4-ido}iron(II) methanol disolvate
Acta Crystallographica Section E, 2022, 78
2244195 CIF
HKL
Paper
C16 H17 N5 Ni S2C 1 2/c 118.2934; 11.7472; 9.7341
90; 117.043; 90
1863.11Näther, Christian; Jess, Inke; Krebs, Christoph
Synthesis, crystal structure and properties of <i>catena</i>-poly[[[bis(3-methylpyridine-κ<i>N</i>)nickel(II)]-di-μ-1,3-thiocyanato] acetonitrile monosolvate]
Acta Crystallographica Section E, 2022, 78
2244194 CIF
HKL
Paper
C21 H25 N O5P 1 21/n 19.2745; 22.1655; 11.3475
90; 108.201; 90
2216.03Steiger, Scott A.; Li, Chun; Oliver, Allen G.; Natale, Nicholas R.
Synthesis, crystal structures, and Hirshfeld analysis of three hexahydroquinoline derivatives
Acta Crystallographica Section E, 2022, 78
2244193 CIF
HKL
Paper
C22 H27 N O4P 1 21/n 115.3492; 14.0314; 18.3862
90; 90.0834; 90
3959.8Steiger, Scott A.; Li, Chun; Oliver, Allen G.; Natale, Nicholas R.
Synthesis, crystal structures, and Hirshfeld analysis of three hexahydroquinoline derivatives
Acta Crystallographica Section E, 2022, 78
2244192 CIF
HKL
Paper
C22 H27 N O4P -17.2941; 9.6773; 14.4302
82.1992; 88.3216; 75.9397
978.92Steiger, Scott A.; Li, Chun; Oliver, Allen G.; Natale, Nicholas R.
Synthesis, crystal structures, and Hirshfeld analysis of three hexahydroquinoline derivatives
Acta Crystallographica Section E, 2022, 78
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
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
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
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
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
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
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
2244184 CIF
HKL
Paper
C13 H16 O3P -14.5931; 8.9134; 15.0764
74.808; 85.309; 77.43
581.18Cattey, Hélène; Boni, Gilles; Pourchet, Sylvie; Plasseraud, Laurent
Crystal structure of the monoglycidyl ether of isoeugenol
Acta Crystallographica Section E, 2022, 78
2244183 CIF
HKL
Paper
C36 H39 Cl3 N8 O2I 4/m17.305; 17.305; 26.04
90; 90; 90
7798van der Peet, Phillip L.; Joyce, Rohan D.; Ott, Holger; Marcuccio, Sebastian M.; White, Jonathan M.; Williams, Spencer J.
Synthesis and structure of clozapine <i>N</i>-oxide hemi(hydrochloride): an infinite hydrogen-bonded poly[<i>n</i>]catenane
Acta Crystallographica Section E, 2022, 78
2244182 CIF
HKL
Paper
C12 H13 N3P n a 2113.4639; 7.8555; 20.1288
90; 90; 90
2128.94Collis, Gavin; Bilyk, Alex; Kazanori, Ueno; Forsyth, Craig M.
Intermolecular hydrogen bonding in <i>N</i>-methyl-<i>N</i>'-(pyridin-2-yl)benzene-1,2-diamine
Acta Crystallographica Section E, 2022, 78
2244181 CIF
HKL
Paper
C16 H13 Au Cl P SP 21 21 2110.0322; 12.0784; 12.9412
90; 90; 90
1568.1Neils, Thomas; LaDuca, Andrew; Bender, John E.; Staples, Richard J.; Biros, Shannon M.
Crystal structure of chlorido[diphenyl(thiophen-2-yl)phosphine-κ<i>P</i>]gold(I)
Acta Crystallographica Section E, 2022, 78
2244180 CIF
HKL
Paper
C19 H26 Cl N SiP 1 21/n 19.732; 19.0598; 10.9186
90; 110.526; 90
1896.7Schwab, Christoph; Voss, Andreas; Strohmann, Carsten
Crystal structure and Hirshfeld surface analysis of <i>N-</i>{[diphenyl(vinyl)silyl]methyl}-2-methylpropan-2-ammonium chloride
Acta Crystallographica Section E, 2022, 78
2244179 CIF
HKL
Paper
C17 H17 Br N2 OP 1 21 17.5162; 6.1125; 15.7249
90; 98.625; 90
714.28Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Shankara Prasad, Holehundi J.; Yathirajan, Hemmige S.; Parkin, Sean
Synthesis and crystal structures of 1-benzoyl-4-(4-nitrophenyl)piperazine and 1-(4-bromobenzoyl)-4-phenylpiperazine at 90K
Acta Crystallographica Section E, 2022, 78
2244178 CIF
HKL
Paper
C17 H17 N3 O3P n a 2118.7779; 10.0699; 15.7288
90; 90; 90
2974.18Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Shankara Prasad, Holehundi J.; Yathirajan, Hemmige S.; Parkin, Sean
Synthesis and crystal structures of 1-benzoyl-4-(4-nitrophenyl)piperazine and 1-(4-bromobenzoyl)-4-phenylpiperazine at 90K
Acta Crystallographica Section E, 2022, 78
2244177 CIF
HKL
Paper
C15 H13 Br N2 O3P 1 21/c 127.904; 11.1207; 9.0648
90; 94.485; 90
2804.3Vinaya; Basavaraju, Yeriyur B.; Lakshmana, Beliyaiah; Yathirajan, Hemmige S.; Parkin, Sean
Syntheses and crystal structures of benzyl <i>N</i>'-[(<i>E</i>)-2-hydroxybenzylidene]hydrazinecarboxylate and benzyl <i>N</i>'-[(<i>E</i>)-5-bromo-2-hydroxybenzylidene]hydrazinecarboxylate
Acta Crystallographica Section E, 2022, 78
2244176 CIF
HKL
Paper
C15 H14 N2 O3P 1 n 14.5017; 14.047; 10.567
90; 96.3; 90
664.2Vinaya; Basavaraju, Yeriyur B.; Lakshmana, Beliyaiah; Yathirajan, Hemmige S.; Parkin, Sean
Syntheses and crystal structures of benzyl <i>N</i>'-[(<i>E</i>)-2-hydroxybenzylidene]hydrazinecarboxylate and benzyl <i>N</i>'-[(<i>E</i>)-5-bromo-2-hydroxybenzylidene]hydrazinecarboxylate
Acta Crystallographica Section E, 2022, 78
2244175 CIF
HKL
Paper
C23 H36 N2 O5P 1 21/c 18.0087; 13.7968; 21.878
90; 90.749; 90
2417.2Naeem, Marilyn; Bauer, Barbara E.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
The methanol and ethanol solvates of 4-glutarato-<i>N</i>,<i>N</i>-diisopropyltryptamine
Acta Crystallographica Section E, 2022, 78
2244174 CIF
HKL
Paper
C22 H34 N2 O5P 1 21/c 17.9531; 13.4224; 21.2015
90; 92.484; 90
2261.1Naeem, Marilyn; Bauer, Barbara E.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
The methanol and ethanol solvates of 4-glutarato-<i>N</i>,<i>N</i>-diisopropyltryptamine
Acta Crystallographica Section E, 2022, 78
2244173 CIF
HKL
C14 H18 N2 O4P c a 2126.702; 7.9626; 6.7571
90; 90; 90
1436.68Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J.
The structures of eleven (4-phenyl)piperazinium salts containing organic anions
Acta Crystallographica Section E, 2022, 78, 1016-1027
2244172 CIF
HKL
C14 H22 N2 O7P 21 21 217.1185; 7.5255; 29.955
90; 90; 90
1604.7Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J.
The structures of eleven (4-phenyl)piperazinium salts containing organic anions
Acta Crystallographica Section E, 2022, 78, 1016-1027
2244171 CIF
HKL
C17 H22 N2 O3 SP 1 21 18.325; 10.949; 18.418
90; 92.67; 90
1677Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J.
The structures of eleven (4-phenyl)piperazinium salts containing organic anions
Acta Crystallographica Section E, 2022, 78, 1016-1027
2244170 CIF
HKL
C17 H22 N2 O3P 1 21/c 16.202; 34.573; 7.596
90; 93.83; 90
1625.1Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J.
The structures of eleven (4-phenyl)piperazinium salts containing organic anions
Acta Crystallographica Section E, 2022, 78, 1016-1027
2244169 CIF
HKL
C16 H17 N5 O7P 1 21/c 18.517; 6.825; 30.265
90; 95.33; 90
1751.7Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J.
The structures of eleven (4-phenyl)piperazinium salts containing organic anions
Acta Crystallographica Section E, 2022, 78, 1016-1027
2244168 CIF
HKL
C17 H18 N4 O6P -15.707; 12.505; 13.116
97.41; 93.28; 102.82
901.5Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J.
The structures of eleven (4-phenyl)piperazinium salts containing organic anions
Acta Crystallographica Section E, 2022, 78, 1016-1027
2244167 CIF
HKL
C17 H18 N4 O7P 1 21/c 17.779; 7.411; 31.357
90; 96.82; 90
1794.9Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J.
The structures of eleven (4-phenyl)piperazinium salts containing organic anions
Acta Crystallographica Section E, 2022, 78, 1016-1027
2244166 CIF
HKL
C17 H19 N3 O4P 1 21/c 113.0683; 15.7868; 7.9255
90; 95.137; 90
1628.52Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J.
The structures of eleven (4-phenyl)piperazinium salts containing organic anions
Acta Crystallographica Section E, 2022, 78, 1016-1027
2244165 CIF
HKL
C17 H19 I N2 O2P 1 21/c 110.8507; 23.4045; 13.3019
90; 102.491; 90
3298.13Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J.
The structures of eleven (4-phenyl)piperazinium salts containing organic anions
Acta Crystallographica Section E, 2022, 78, 1016-1027
2244164 CIF
HKL
C17 H21 Br N2 O3P 1 21/c 16.183; 37.748; 7.506
90; 93.69; 90
1748.2Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J.
The structures of eleven (4-phenyl)piperazinium salts containing organic anions
Acta Crystallographica Section E, 2022, 78, 1016-1027
2244163 CIF
HKL
Paper
C17 H21 F N2 O3P -16.239; 7.496; 17.817
93.55; 92.94; 94.87
827.3Archana, Sreeramapura D.; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Butcher, Ray J.
The structures of eleven (4-phenyl)piperazinium salts containing organic anions
Acta Crystallographica Section E, 2022, 78, 1016-1027
2244162 CIF
HKL
Paper
C8 H5 N S3P -15.7955; 7.3789; 10.0344
89.459; 89.719; 78.956
421.15Schriver, Melbourne J.; George, Tanner; Masuda, Jason D.
Synthesis and crystal structure of 3-phenyl-1,4,2-dithiazole-5-thione
Acta Crystallographica Section E, 2022, 78
2244161 CIF
HKL
Paper
C12 H13 N3 O SI 1 a 18.1644; 15.9237; 9.6936
90; 106.661; 90
1207.33Mutalliev, Lukmonjon Z.; Abdullaev, Sirojiddin; Pirnazarova, Nasiba; Obidova, Ibodat; Turgunov, Kambarali; Yakubov, Ubaydullo; Ashurov, Jamshid M.; Elmuradov, Burkhan Zh.; Mamadrakhimov, Azimjon A.
Synthesis, crystal structure and Hirshfeld surface analysis of (1<i>H</i>-benzimidazol-2-yl)(morpholin-4-yl)methanethione
Acta Crystallographica Section E, 2022, 78
2244160 CIF
HKL
Paper
C35 H22 Cl N O7P -18.0202; 9.8474; 19.4712
95.422; 94.693; 103.857
1477.66Selvanandan, S.; Anil kumar, H.; Srinivasa, H. T.; Palakshamurthy, B. S.
Crystal structure and Hirshfeld surface analysis of 3-({4-[(4-cyanophenoxy)carbonyl]phenoxy}carbonyl)phenyl 4-(benzyloxy)-3-chlorobenzoate
Acta Crystallographica Section E, 2022, 78
2244159 CIF
HKL
Paper
B12 H3 K Mg2 O22P a -312.2966; 12.2966; 12.2966
90; 90; 90
1859.32Qiu, Qi-Ming; Song, Jian-Biao
Crystal structure of MgK~0.5~[B~6~O~10~](OH)~0.5~·0.5H~2~O, poly[dimagnesium potassium bis(hexaborate) hydroxide monohydrate]
Acta Crystallographica Section E, 2022, 78, 1003-1005
2244158 CIF
HKL
Paper
C15 H12 F3 N O4 SP 1 21/c 113.5689; 9.2906; 13.4358
90; 118.53; 90
1488.1Schinke, Jascha; Gelbrich, Thomas; Griesser, Ulrich J.
Crystal structure, PIXEL calculations of intermolecular interaction energies and solid-state characterization of the herbicide isoxaflutole
Acta Crystallographica Section E, 2022, 78
2244157 CIF
HKL
Paper
B12 H10 O26 Rb6P n n m13.395; 9.251; 12.368
90; 90; 90
1532.6Qiu, Qi-Ming; Yan, Li; Song, Jian-Biao
Crystal structure of Rb~6~[B~12~O~18~(OH)~6~]·2H~2~O
Acta Crystallographica Section E, 2022, 78, 971-973
2244156 CIF
HKL
Paper
C14 H26 Co O18 S2P -16.7774; 6.9866; 13.721
91.107; 90.401; 117.583
575.66Bettinger, Reuben T.; Squattrito, Philip J.; Aulakh, Darpandeep; Gianopoulos, Christopher G.
Crystal structures of two new divalent transition-metal salts of carboxybenzenesulfonate anions
Acta Crystallographica Section E, 2022, 78, 961-965
2244155 CIF
HKL
Paper
C14 H26 Ni O20 S2P -16.5986; 7.4183; 13.2847
74.1712; 88.6035; 77.92
611.41Bettinger, Reuben T.; Squattrito, Philip J.; Aulakh, Darpandeep; Gianopoulos, Christopher G.
Crystal structures of two new divalent transition-metal salts of carboxybenzenesulfonate anions
Acta Crystallographica Section E, 2022, 78, 961-965
2244154 CIF
HKL
Paper
C7 H6 N4 O3C 1 2/c 115.3747; 4.6699; 23.0423
90; 103.122; 90
1611.2Irrou, Ezaddine; Elmachkouri, Younesse Ait; Oubella, Ali; Ouchtak, Hassan; Dalbouha, Samira; Mague, Joel T.; Hökelek, Tuncer; El Ghayati, Lhoussaine; Sebbar, Nada Kheira; Taha, Mohamed Labd
Crystal structure determination, Hirshfeld surface, crystal void, intermolecular interaction energy analyses, as well as DFT and energy framework calculations of 2-(4-oxo-4,5-dihydro-1<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidin-1-yl)acetic acid
Acta Crystallographica Section E, 2022, 78, 953-960
2244153 CIF
HKL
Paper
C30 H38 N4 O6P n a 2117.8424; 8.8124; 34.9337
90; 90; 90
5492.8Shankara Prasad, Holehundi J.; Devaraju; Vinaya; Yathirajan, Hemmige S.; Parkin, Sean R.; Glidewell, Christopher
Syntheses and crystal structures of 4-(4-methoxyphenyl)piperazin-1-ium 4-methylbenzoate monohydrate and bis[4-(4-methoxyphenyl)piperazin-1-ium] benzene-1,2-dicarboxylate
Acta Crystallographica Section E, 2022, 78
2244152 CIF
HKL
Paper
C19 H26 N2 O4P -17.4141; 12.3595; 19.9917
86.695; 83.654; 82.182
1802.1Shankara Prasad, Holehundi J.; Devaraju; Vinaya; Yathirajan, Hemmige S.; Parkin, Sean R.; Glidewell, Christopher
Syntheses and crystal structures of 4-(4-methoxyphenyl)piperazin-1-ium 4-methylbenzoate monohydrate and bis[4-(4-methoxyphenyl)piperazin-1-ium] benzene-1,2-dicarboxylate
Acta Crystallographica Section E, 2022, 78
2244151 CIF
HKL
Paper
C17 H14 Br N3 O4P b c a9.388; 12.226; 28.693
90; 90; 90
3293.3Naghiyev, Farid N.; Khrustalev, Victor N.; Venskovsky, Nikolai U.; Akkurt, Mehmet; Khalilov, Ali N.; Bhattarai, Ajaya; Mamedov, İbrahim G.
Crystal structure and Hirshfeld surface analysis of ethyl 2'-amino-5-bromo-3'-cyano-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-5'-carboxylate
Acta Crystallographica Section E, 2022, 78
2244150 CIF
HKL
Paper
C37 H60 Cl N3P 1 21/n 112.253; 22.699; 12.884
90; 104.164; 90
3474.5Muñoz Sánchez, Gaby M.; Zdilla, Michael J.
Crystal structure of <i>N</i>-butyl-2,3-bis(dicyclohexylamino)cyclopropeniminium chloride benzene monosolvate
Acta Crystallographica Section E, 2022, 78
2244149 CIF
HKL
Paper
C24 H19 N OI 1 2/a 118.6588; 5.4739; 35.5689
90; 100.729; 90
3569.37Cheng, Dong; Meng, Xiang-Zhen; Tian, Fuyu; Yan, Dong; Wang, Xiaofei; Qian, Xueli; Wang, Junnan
Crystal structure and Hirshfeld surface analysis of 4-(3-methoxyphenyl)-2,6-diphenylpyridine
Acta Crystallographica Section E, 2022, 78
2244148 CIF
HKL
Paper
C36 H43 N O6P 1 21/c 127.091; 6.2408; 18.685
90; 90.975; 90
3158.6Priyanka, Prabhakar; Jayanna, Bidarur K.; Kiran Kumar, Haruvegowda; Vinaya; Divakara, Thayamma R.; Yathirajan, Hemmige S.; Parkin, Sean
Synthesis and crystal structure of ebastinium hydrogen fumarate
Acta Crystallographica Section E, 2022, 78
2244147 CIF
HKL
Paper
C21 H22 N2 O4P 1 21/c 113.8608; 8.8352; 15.5411
90; 98.468; 90
1882.46Nchioua, Intissar; Alsubari, Abdulsalam; Mague, Joel T.; Ramli, Youssef
Crystal structure and Hirshfeld surface analysis of <i>N</i>-(2,6-dimethylphenyl)-2-[3-hydroxy-2-oxo-3-(2-oxopropyl)indolin-1-yl]acetamide
Acta Crystallographica Section E, 2022, 78
2244146 CIF
HKL
C72.5 H85 B F16 N4 TiP -112.1151; 13.2796; 21.1662
77.916; 88.8857; 87.9827
3327.5Fitschen, Kerstin; Frerichs, Nils; Yusufzadeh, Zainab; Schmidtmann, Marc; Beckhaus, Rüdiger
Crystal structures of the Lewis acid–base adducts {[(C~6~H~11~)~2~N]~3~Ti–<i>LB</i>}^+^[MeB(C~6~F~5~)~3~]^{-^}·1.5C~7~H~8~; LB = (C~6~H~5~)~3~PO (1), <i>p</i>-F—C~6~H~4~CN (2)
Acta Crystallographica Section E, 2022, 78
2244145 CIF
HKL
Paper
C83.5 H96 B F15 N3 O P TiP -113.8643; 14.3017; 20.0502
86.4852; 80.0328; 73.6493
3756.9Fitschen, Kerstin; Frerichs, Nils; Yusufzadeh, Zainab; Schmidtmann, Marc; Beckhaus, Rüdiger
Crystal structures of the Lewis acid–base adducts {[(C~6~H~11~)~2~N]~3~Ti–<i>LB</i>}^+^[MeB(C~6~F~5~)~3~]^{-^}·1.5C~7~H~8~; LB = (C~6~H~5~)~3~PO (1), <i>p</i>-F—C~6~H~4~CN (2)
Acta Crystallographica Section E, 2022, 78
2244144 CIF
HKL
Paper
C9 H11 N5 O2P c a 2124.367; 4.3979; 10.1424
90; 90; 90
1086.9Plutenko, Maksym O.; Shishkina, Svitlana V.; Shishkin, Oleg V.; Potaskalov, Vadim A.; Kalibabchuk, Valentina A.
Crystal structure, Hirshfeld surface analysis and geometry optimization of 2-hydroxyimino-<i>N</i>-[1-(pyrazin-2-yl)ethylidene]propanohydrazide
Acta Crystallographica Section E, 2022, 78
2244143 CIF
HKL
Paper
C10 H10 Cl N5 O7P -18.3023; 10.0792; 10.1052
116.966; 105.481; 92.871
711.77Qiu, Qi-Ming; Song, Jian-Biao; Dong, Ai-Guo; Li, Chuan-Tao; Zheng, Zhi-Yuan
Crystal structure of 4,4'-(diazenediyl)dipyridinium nitrate perchlorate
Acta Crystallographica Section E, 2022, 78
2244142 CIF
HKL
Paper
C11 H9 Br N2 OP 1 21/c 17.5654; 11.4972; 12.1025
90; 105.583; 90
1013.99Tojiboev, Akmaljon; Elmuradov, Burkhon; Kattaev, Nuritdin; Abdurazakov, Asqar; Nasrullayev, Azizbek; Tashkhodjaev, Bakhodir
Crystal structure, Hirshfeld surface analysis and DFT calculations of 7-bromo-2,3-dihydropyrrolo[2,1-<i>b</i>]quinazolin-9(1<i>H</i>)-one
Acta Crystallographica Section E, 2022, 78
2244141 CIF
HKL
Paper
C24 H23.5 F N4 O4.25 SP 1 21/c 114.4316; 10.8518; 15.594
90; 109.941; 90
2295.74Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Alfayomy, Abdallah M.; Ragab, Fatma A. F.; Abd ul-Malik, Mokhtar A.
Crystal structure and Hirshfeld surface analysis of ethyl (3<i>E</i>)-5-(4-fluorophenyl)3-{[(4-methoxyphenyl)formamido]imino}-7-methyl-2<i>H</i>,3<i>H</i>,5<i>H</i>-[1,3]thiazolo[3,2-<i>a</i>]pyrimidine-6-carboxylate 0.25-hydrate
Acta Crystallographica Section E, 2022, 78
2244140 CIF
HKL
Paper
C14 H13 N O4P 1 21/n 111.6407; 7.4412; 42.2828
90; 93.038; 90
3657.42Faraj, Imane; Oubella, Ali; Chkirate, Karim; Al Mamari, Khalil; Hökelek, Tuncer; Mague, Joel T.; El Ghayati, Lhoussaine; Sebbar, Nada Kheira; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis and DFT calculations of (<i>E</i>)-3-[1-(2-hydroxyphenylanilino)ethylidene]-6-methylpyran-2,4-dione
Acta Crystallographica Section E, 2022, 78, 864-870
2244139 CIF
HKL
Paper
C21 H26 N2 O3P 1 21/c 114.5241; 10.0718; 13.271
90; 97.042; 90
1926.69Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Abdel-Rahman, Laila H.; Abdel-Hameed, Mohamed; Albayati, Mustafa R.; Al-Taif, Elham A.
Crystal structure and Hirshfeld surface analysis of (±)-<i>N</i>'-(2-hydroxy-3-methoxybenzylidene)-2-(4-isobutylphenyl)propionohydrazide
Acta Crystallographica Section E, 2022, 78, 860-863
2244138 CIF
HKL
Paper
C8 H7 F N4 OP 1 21/c 110.8398; 19.0207; 9.3307
90; 112.378; 90
1778.93Missioui, Mohcine; Guerrab, Walid; Alsubari, Abdulsalam; Mague, Joel T.; Ramli, Youssef
Crystal structure and Hirshfeld surface analysis of 2-azido-<i>N</i>-(4-fluorophenyl)acetamide
Acta Crystallographica Section E, 2022, 78, 855-859
2244137 CIF
HKL
Paper
C23 H20 Cl2 N4 O3 SP 1 21/c 114.8117; 10.7086; 15.1887
90; 112.417; 90
2227.1Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Alfayomy, Abdallah M.; Seri, Sahar M. Abou; Abdel-Raheem, Shaban A. A.; Ul-Malik, Mokhtar A. Abd
Crystal structure and Hirshfeld surface analysis of ethyl (3<i>E</i>)-5-(4-chlorophenyl)-3-{[(4-chlorophenyl)formamido]imino}-7-methyl-2<i>H</i>,3<i>H</i>,5<i>H</i>-[1,3]thiazolo[3,2-<i>a</i>]pyrimidine-6-carboxylate
Acta Crystallographica Section E, 2022, 78
2244136 CIF
HKL
Paper
C30 H50 N4 O4P 1 21/c 114.2508; 15.3046; 15.2593
90; 113.311; 90
3056.43Stapf, Manuel; Schmidt, Ute; Seichter, Wilhelm; Mazik, Monika
Synthesis and crystal structure of 1,3-bis{[<i>N</i>,<i>N</i>-bis(2-hydroxyethyl)amino]methyl}-5-{[(4,6-dimethylpyridin-2-yl)amino]methyl}-2,4,6-triethylbenzene
Acta Crystallographica Section E, 2022, 78
2244135 CIF
HKL
Paper
C48 H51.5 Fe2 N16 O12.75 S2P -19.9635; 14.4905; 20.1131
96.736; 101.49; 95.216
2806.5Petrenko, Yuliia P.; Bibik, Yurii S.; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Gural'skiy, Il`ya A.; Shova, Sergiu; Lampeka, Rostyslav D.; Raspertova, Ilona V.
Synthesis and crystal structure of hydrated μ-oxalato-bis{bis[3-methyl-5-(pyridin-2-yl)-1<i>H</i>-1,2,4-triazole]iron(II)} bis(toluenesulfonate) 2.75-hydrate
Acta Crystallographica Section E, 2022, 78
2244134 CIF
HKL
Paper
C13 H9 N5 OP -18.6444; 8.9104; 16.0902
79.196; 86.485; 69.003
1136.52Naghiyev, Farid N.; Khrustalev, Victor N.; Venskovsky, Nikolai U.; Tereshina, Tatiana A.; Khalilov, Ali N.; Akkurt, Mehmet; Bhattarai, Ajaya; Mamedov, İbrahim G.
Crystal structures and Hirshfeld surface analyses of 2-amino-4-(4-bromophenyl)-6-oxo-1-phenyl-1,4,5,6-tetrahydropyridine-3-carbonitrile hemihydrate and 1,6-diamino-2-oxo-4-phenyl-1,2-dihydropyridine-3,5-dicarbonitrile
Acta Crystallographica Section E, 2022, 78
2244133 CIF
HKL
Paper
C36 H30 Br2 N6 O3C 1 2/c 127.539; 6.343; 21.354
90; 118.17; 90
3288.3Naghiyev, Farid N.; Khrustalev, Victor N.; Venskovsky, Nikolai U.; Tereshina, Tatiana A.; Khalilov, Ali N.; Akkurt, Mehmet; Bhattarai, Ajaya; Mamedov, İbrahim G.
Crystal structures and Hirshfeld surface analyses of 2-amino-4-(4-bromophenyl)-6-oxo-1-phenyl-1,4,5,6-tetrahydropyridine-3-carbonitrile hemihydrate and 1,6-diamino-2-oxo-4-phenyl-1,2-dihydropyridine-3,5-dicarbonitrile
Acta Crystallographica Section E, 2022, 78
2244132 CIF
HKL
Paper
C17 H17 N5 O9P -17.9599; 8.5391; 14.2227
90.426; 105.273; 98.538
921.15Shankara Prasad, Holehundi J.; Devaraju; Vinaya; Yathirajan, Hemmige S.; Parkin, Sean R.; Glidewell, Christopher
Syntheses and crystal structures of 4-(4-nitrophenyl)piperazin-1-ium benzoate monohydrate and 4-(4-nitrophenyl)piperazin-1-ium 2-carboxy-4,6-dinitrophenolate
Acta Crystallographica Section E, 2022, 78
2244131 CIF
HKL
Paper
C17 H21 N3 O5P -16.0768; 7.4427; 18.4737
78.894; 85.87; 83.668
813.77Shankara Prasad, Holehundi J.; Devaraju; Vinaya; Yathirajan, Hemmige S.; Parkin, Sean R.; Glidewell, Christopher
Syntheses and crystal structures of 4-(4-nitrophenyl)piperazin-1-ium benzoate monohydrate and 4-(4-nitrophenyl)piperazin-1-ium 2-carboxy-4,6-dinitrophenolate
Acta Crystallographica Section E, 2022, 78
2244130 CIF
HKL
Paper
C14 H8 Br3 N3 O2P b c a6.6579; 15.7683; 29.0301
90; 90; 90
3047.69Atioğlu, Zeliha; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Mammadova, Naila A.; Babayeva, Gülnara V.; Khrustalev, Victor N.; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of a new polymorph of (<i>E</i>)-2-(4-bromophenyl)-1-[2,2-dibromo-1-(3-nitrophenyl)ethenyl]diazene
Acta Crystallographica Section E, 2022, 78
2244129 CIF
HKL
Paper
C27 H27 N13 OP 1 21/c 18.9102; 13.5595; 22.052
90; 98.024; 90
2638.2Mahmudov, Ibadulla; Atioğlu, Zeliha; Akkurt, Mehmet; Abdullayev, Yusif; Sujayev, Afsun; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of 2-(4-amino-6-phenyl-1,2,5,6-tetrahydro-1,3,5-triazin-2-ylidene)malononitrile dimethylformamide hemisolvate
Acta Crystallographica Section E, 2022, 78
2244128 CIF
HKL
Paper
C16 H10 N4 O2 S2 ZnC 1 2/c 120.4223; 11.326; 7.4019
90; 98.31; 90
1694.11Pirimova, Mehribon; Torambetov, Batirbay; Kadirova, Shakhnoza; Ziyaev, Abdukhakim; Gonnade, Rajesh G.; Ashurov, Jamshid
Synthesis, crystal structure and Hirshfeld surface analysis of a zinc(II) coordination polymer of 5-phenyl-1,3,4-oxadiazole-2-thiolate
Acta Crystallographica Section E, 2022, 78
2244127 CIF
HKL
Paper
C31 H35 N O4P 1 21/n 110.443; 18.4563; 14.2378
90; 107.93; 90
2610.9Sughanya, V.; Loganathan, B.; Praveenkumar, D.; Ayyappan, J.; Sundararajan, M. L.; Prabhakaran, A.; Dhandapani, A.; Suresh Babu, N.
Crystal structure, Hirshfeld surface and frontier molecular orbital analysis of 10-benzyl-9-(4-hydroxy-3-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2<i>H</i>,5<i>H</i>)-dione
Acta Crystallographica Section E, 2022, 78
2244126 CIF
HKL
Paper
C17 H15 F O2P c a 217.1426; 17.0566; 11.152
90; 90; 90
1358.63Bernhard, Merle; Lutter, Jacob C.; Predecki, Allison
Crystal structure of (2<i>E</i>)-1-(4-ethoxyphenyl)-3-(4-fluorophenyl)prop-2-en-1-one
Acta Crystallographica Section E, 2022, 78
2244125 CIF
HKL
Paper
C26 H40 Co2 N4 O22P -19.2008; 9.3137; 10.647
86.551; 79.378; 72.369
854.61Velazquez-Garcia, Jose de Jesus; Techert, Simone
Synthesis and structure of hexaaquacobalt bis(2-methyl-1<i>H</i>-imidazol-3-ium) tetraaquabis(benzene-1,3,5-tricarboxylato-κ<i>O</i>)cobalt
Acta Crystallographica Section E, 2022, 78
2244124 CIFC18 H20 N4 O8P -17.3729; 8.4842; 15.5411
88.954; 81.333; 89.352
960.85Subha, Veerappan; Seethalakshmi, Thangaraj; Balakrishnan, Thangavelu; Percino, M. Judith; Venkatesan, Perumal
Crystal structure of 4-(2-methoxyphenyl)piperazin-1-ium 3,5-dintrosalicylate
Acta Crystallographica Section E, 2022, 78
2244123 CIF
HKL
Paper
Ba3 H12 O17 Se2 SnP 639.255; 9.255; 11.4441
90; 90; 120
848.92Reuter, Hans; Kamaha, Shouassi
Ba~3~[Sn(OH)~6~][SeO~4~]~2~·3H~2~O, a hydrated 1:2 double salt of barium hexahydroxidostannate(IV) and barium selenate(VI)
Acta Crystallographica Section E, 2022, 78
2244122 CIF
HKL
Paper
C27 H27 N OP 1 21/n 114.416; 5.8569; 25.354
90; 96.116; 90
2128.5Liu, Xiaozhou; Wang, Lu; Feng, Ying; Cui, Deliang; Liu, Zhi
Crystal structure of 8-hexyloxy-2-[(<i>Z</i>)-2-(naphthalen-2-yl)ethenyl]quinoline
Acta Crystallographica Section E, 2022, 78
2244121 CIF
HKL
Paper
La2 O24 Sr9 W4I 41/a :211.6365; 11.6365; 16.304
90; 90; 90
2207.69Simura, Rayko; Watanabe, Tomoki; Yamane, Hisanori
Sr~9~La~2~(WO~6~)~4~ containing [WO~6~] octahedra
Acta Crystallographica Section E, 2022, 78
2244120 CIF
HKL
C26 H28 Fe N6 S2P b c n17.3733; 8.94119; 17.24862
90; 90; 90
2679.37Ceglarska, Magdalena; Krebs, Christoph; Näther, Christian
Syntheses, crystal structures and properties of tetrakis(3-methylpyridine-κ<i>N</i>)bis(isothiocyanato-κ<i>N</i>)manganese(II) and tetrakis(3-methylpyridine-κ<i>N</i>)bis(isothiocyanato-κ<i>N</i>)iron(II)
Acta Crystallographica Section E, 2022, 78, 755-760
2244119 CIF
HKL
Paper
C26 H28 Mn N6 S2P b c n17.47811; 8.9357; 17.36177
90; 90; 90
2711.55Ceglarska, Magdalena; Krebs, Christoph; Näther, Christian
Syntheses, crystal structures and properties of tetrakis(3-methylpyridine-κ<i>N</i>)bis(isothiocyanato-κ<i>N</i>)manganese(II) and tetrakis(3-methylpyridine-κ<i>N</i>)bis(isothiocyanato-κ<i>N</i>)iron(II)
Acta Crystallographica Section E, 2022, 78, 755-760
2244118 CIF
HKL
Paper
C26 H30 N2 O4P b c a19.998; 9.7472; 23.54
90; 90; 90
4588.5Rivera, Augusto; Ríos-Motta, Jaime; Bolte, Michael
Synthesis and crystal structure of 2-(2-hydroxyphenyl)-1,3-bis(4-methoxybenzyl)-1,3-diazinan-5-ol
Acta Crystallographica Section E, 2022, 78
2244117 CIF
HKL
Paper
C14 H8 Br3 N3 O2P n a 2113.8678; 13.5442; 8.3017
90; 90; 90
1559.29Akkurt, Mehmet; Yıldırım, Sema Öztürk; Shikhaliyev, Namiq Q.; Mammadova, Naila A.; Niyazova, Ayten A.; Khrustalev, Victor N.; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-2-(4-bromophenyl)-1-[2,2-dibromo-1-(4-nitrophenyl)ethenyl]diazene
Acta Crystallographica Section E, 2022, 78
2244116 CIF
HKL
Paper
C21 H17 N O5P 1 21/c 18.2862; 23.5895; 8.6219
90; 97.728; 90
1669.99Li, Chun; Weaver, Matthew J.; Campbell, Michael J.; Natale, Nicholas R.
Syntheses and crystal structures of a nitro–anthracene–isoxazole and its oxidation product
Acta Crystallographica Section E, 2022, 78
2244115 CIF
HKL
Paper
C21 H16 N2 O5C 1 c 116.4968; 14.8697; 16.1836
90; 114.879; 90
3601.5Li, Chun; Weaver, Matthew J.; Campbell, Michael J.; Natale, Nicholas R.
Syntheses and crystal structures of a nitro–anthracene–isoxazole and its oxidation product
Acta Crystallographica Section E, 2022, 78
2244114 CIF
HKL
Paper
C32 H41 N3 O3 S SiP -18.6752; 8.8765; 20.2299
78.107; 87.922; 89.512
1523.37Friedrich, Erik; Heinrich, Timo; Rosenberger, Lara; Krier, Mireille; Marek, Stephanie; Reggelin, Michael
Synthesis and crystal structure of <i>rac</i>-2-(1,3-dioxoisoindolin-2-yl)ethyl 4-methyl-<i>N</i>-phenyl-<i>N</i>'-(triisopropylsilyl)benzenesulfondiimidoate: the first member of a new substance class
Acta Crystallographica Section E, 2022, 78
2244113 CIF
HKL
Paper
C18 H14 I2 N2 O2 ZnP 1 21/c 116.7231; 7.6155; 15.8689
90; 97.192; 90
2005.08Padgett, Clifford W.; Lynch, Will E.; Groneck, Erin N.; Raymundo, Melina; Adams, Desiree
Crystal structures of three zinc(II) halide coordination complexes with quinoline <i>N</i>-oxide
Acta Crystallographica Section E, 2022, 78
2244112 CIF
HKL
Paper
C18 H14 Br2 N2 O2 ZnP 1 21/c 116.3922; 7.3527; 15.5809
90; 97.113; 90
1863.5Padgett, Clifford W.; Lynch, Will E.; Groneck, Erin N.; Raymundo, Melina; Adams, Desiree
Crystal structures of three zinc(II) halide coordination complexes with quinoline <i>N</i>-oxide
Acta Crystallographica Section E, 2022, 78
2244111 CIF
HKL
Paper
C18 H14 Cl2 N2 O2 ZnP 1 21 18.5167; 7.8697; 13.1617
90; 94.89; 90
878.94Padgett, Clifford W.; Lynch, Will E.; Groneck, Erin N.; Raymundo, Melina; Adams, Desiree
Crystal structures of three zinc(II) halide coordination complexes with quinoline <i>N</i>-oxide
Acta Crystallographica Section E, 2022, 78
2244110 CIF
HKL
Paper
C20 H24 Br N O2P 1 21/c 121.1019; 9.01359; 10.03985
90; 96.1425; 90
1898.65Khalilov, Ali N.; Khrustalev, Victor N.; Fortalnova, Elena A.; Akkurt, Mehmet; Yıldırım, Sema Öztürk; Bhattarai, Ajaya; Mamedov, İbrahim G.
Crystal structure and Hirshfeld surface analysis of 4-bromo-2-[3-methyl-5-(2,4,6-trimethylbenzyl)oxazolidin-2-yl]phenol
Acta Crystallographica Section E, 2022, 78
2244109 CIF
HKL
Paper
C22 H19 N O2P b c n20.8269; 9.09843; 9.0158
90; 90; 90
1708.42Naghiyev, Farid N.; Khrustalev, Victor N.; Safronenko, Marina G.; Akkurt, Mehmet; Khalilov, Ali N.; Bhattarai, Ajaya; Mamedov, İbrahim G.
Crystal structure and Hirshfeld surface analysis of 2,2'-(phenylazanediyl)bis(1-phenylethan-1-one)
Acta Crystallographica Section E, 2022, 78
2244108 CIF
HKL
Paper
C9 H10 Cl N O2P 1 21/c 110.0939; 9.6423; 10.2799
90; 115.531; 90
902.83Missioui, Mohcine; Guerrab, Walid; Nchioua, Intissar; El Moutaouakil Ala Allah, Abderrazzak; Kalonji Mubengayi, Camille; Alsubari, Abdulsalam; Mague, Joel T.; Ramli, Youssef
Crystal structure and Hirshfeld surface analysis of 2-chloro-<i>N</i>-(4-methoxyphenyl)acetamide
Acta Crystallographica Section E, 2022, 78
2244107 CIF
HKL
Paper
C36 H31 N O8C 1 2/c 118.7222; 9.787; 16.9398
90; 113.758; 90
2840.9Magrashi, Maryam Ali; Aazam, Elham Shafik
The co-crystal 4,6-diacetylresorcinol–1-aminopyrene (2/1)
Acta Crystallographica Section E, 2022, 78, 679-681
2244106 CIF
HKL
Paper
C18 H16 Cl N O2 SP 1 21/c 16.6235; 25.1848; 9.8283
90; 96.504; 90
1628.92Guseinov, Firudin I.; Kobrakov, Konstantin I.; Shuvalova, Elena V.; Tuzharov, Egor I.; Akkurt, Mehmet; Yıldırım, Sema Öztürk; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of 2-(4-chlorophenyl)-4-(dimethoxymethyl)-5-phenyl-1,3-thiazole
Acta Crystallographica Section E, 2022, 78
2244105 CIF
HKL
Paper
C4 H9 N7 O6P 1 21/c 17.865; 9.9173; 12.2291
90; 100.836; 90
936.86Dilshad, Sumra; Çınar, Emine Berrin; Ali, Arif; Ahmed, Adeeba; Alam, Mohd Jane; Ahmad, Musheer; Ahmad, Aiman; Dege, Necmi; Saif, Eiad
Crystal structure and Hirshfeld surface analysis of 2,4,6-triaminopyrimidine-1,3-diium dinitrate
Acta Crystallographica Section E, 2022, 78
2244104 CIF
HKL
Paper
C14 H26 Ni O14P b c a11.0812; 7.63258; 23.7986
90; 90; 90
2012.84Ruzmetov, Abror; Ibragimov, Aziz; Ashurov, Jamshid; Boltaeva, Zebo; Ibragimov, Bakhtiyar; Usmanov, Sultan
Synthesis, crystal structure and Hirshfeld surface analysis of hexaaquanickel(II) bis(4-hydroxybenzoate) dihydrate
Acta Crystallographica Section E, 2022, 78
2244103 CIF
HKL
Paper
C23 H16 N6 O3P 1 21/c 112.0085; 12.4719; 15.4909
90; 94.489; 90
2312.94Naghiyev, Farid N.; Khrustalev, Victor N.; Fortalnova, Elena A.; Akkurt, Mehmet; Khalilov, Ali N.; Bhattarai, Ajaya; Mamedov, İbrahim G.
Crystal structure and Hirshfeld surface analysis of methyl 4'-amino-3',5'-dicyano-2,2''-dioxodispiro[indoline-3,1'-cyclopentane-2',3''-indolin]-3'-ene-5'-carboximidate with an unknown solvent
Acta Crystallographica Section E, 2022, 78
2244102 CIF
HKL
Paper
C22 H20 N2 O2C 1 2/c 125.3144; 9.25765; 15.6778
90; 97.8724; 90
3639.49Hebishy, Ali M. S.; Elgemeie, Galal H.; Ali, Rasha A. E.; Jones, Peter G.
Crystal structure of 2-amino-5,6,7,8-tetrahydro-7,7-dimethyl-4-(naphthalen-2-yl)-5-oxo-4<i>H</i>-chromene-3-carbonitrile
Acta Crystallographica Section E, 2022, 78
2244101 CIF
HKL
Paper
C5 H7 Br N4 O3P 1 21/c 14.9225; 22.7572; 7.5601
90; 103.003; 90
825.18Sathya, Udhayasuriyan; Nirmalram, Jeyaraman Selvaraj; Gomathi, Sundaramoorthy; Dhivya, Durairaj; Jegan Jennifer, Samson; Abdul Razak, Ibrahim
A study of the crystal structures, supramolecular patterns and Hirshfeld surfaces of bromide salts of hypoxanthine and xanthine
Acta Crystallographica Section E, 2022, 78
2244100 CIF
HKL
Paper
C5 H7 Br N4 O2P 1 21/c 14.8487; 18.4455; 9.0782
90; 94.808; 90
809.07Sathya, Udhayasuriyan; Nirmalram, Jeyaraman Selvaraj; Gomathi, Sundaramoorthy; Dhivya, Durairaj; Jegan Jennifer, Samson; Abdul Razak, Ibrahim
A study of the crystal structures, supramolecular patterns and Hirshfeld surfaces of bromide salts of hypoxanthine and xanthine
Acta Crystallographica Section E, 2022, 78
2244099 CIF
HKL
Paper
C17 H20 O4P 21 21 216.7641; 6.9254; 31.4538
90; 90; 90
1473.42Lu, Qiang-Qiang; Shi, Xin-Wei; Zhou, Ya-Fu; Cui, Xin-Ai; Wang, Hong
Crystal structure and Hirshfeld analysis of (1a<i>S</i>,3a<i>R</i>,4a<i>S</i>,5a<i>R</i>)-15-acetoxylinden-7(11),8-trieno-12,8-lactone
Acta Crystallographica Section E, 2022, 78, 1
2244098 CIF
HKL
Paper
C19 H20 Cl2 N2 Pd SP -19.2135; 9.406; 12.9032
79.866; 70; 67.753
971.17Butcher, Ray J.; Singh, Puspendra; Shabbani, Gulam
Dichlorido(4-methylaniline-κ<i>N</i>)[<i>N</i>-(4-methylphenyl)-1-(thiophen-2-yl)methanimine-κ<i>N</i>]palladium(II)
Acta Crystallographica Section E, 2022, 78, 1
2244097 CIF
HKL
Paper
C26 H32 Br N2 O2.5P 41 21 29.9254; 9.9254; 47.1267
90; 90; 90
4642.62Janzen, Daron E.; Butler, Maya S.; Reinheimer, Eric W.
Crystal structures of anhydrous and hydrated <i>N</i>-benzylcinchonidinium bromide
Acta Crystallographica Section E, 2022, 78
2244096 CIF
HKL
Paper
C26 H29 Br N2 OP 1 21 111.2574; 8.8445; 11.9039
90; 110.126; 90
1112.85Janzen, Daron E.; Butler, Maya S.; Reinheimer, Eric W.
Crystal structures of anhydrous and hydrated <i>N</i>-benzylcinchonidinium bromide
Acta Crystallographica Section E, 2022, 78
2244095 CIF
HKL
Paper
C21 H22 N2 O3 SI 1 a 110.7979; 10.2238; 17.7316
90; 100.526; 90
1924.55Khrustalev, Victor N.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Kolesnik, Irina A.; Potkin, Vladimir I.; Mlowe, Sixberth
Crystal structure and Hirshfeld surface analysis of <i>N</i>-{[5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl}-1-phenyl-<i>N</i>-(prop-2-en-1-yl)methanesulfonamide
Acta Crystallographica Section E, 2022, 78
2244094 CIF
HKL
Paper
C30 H48 N4 O2P 1 2/c 111.4741; 7.677; 17.2226
90; 108.166; 90
1441.5Rivera, Augusto; Ríos-Motta, Jaime; Bolte, Michael
First hydrogen-bonded adduct of sterically hindered 2-<i>tert</i>-butyl-4-methylphenol (TBMP) with 1,3,6,8-tetraazatricyclo[4.4.1.1^3,8^]dodecane (TATD) <i>via</i> coupling of classical hydrogen bonds and C—H···π non-covalent interactions
Acta Crystallographica Section E, 2022, 78
2244093 CIF
HKL
Paper
C12 H12 O3P 1 21/c 115.5987; 13.0782; 11.0396
90; 109.063; 90
2128.6Assila, Hamza; Zaoui, Younes; Ameziane El Hassani, Issam; El Ghammarti, Samira; Mague, Joel T.; Taoufik, Jamal; Ramli, Youssef; Ansar, Mhammed
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-3-benzylidene-4-oxopentanoic acid
Acta Crystallographica Section E, 2022, 78
2244092 CIF
HKL
Paper
C32 H28 N2 O4P 1 21/c 113.9798; 11.8411; 15.7406
90; 91.901; 90
2604.21Naghiyev, Farid N.; Khrustalev, Victor N.; Dobrokhotova, Ekaterina V.; Akkurt, Mehmet; Khalilov, Ali N.; Bhattarai, Ajaya; Mamedov, İbrahim G.
Crystal structure and Hirshfeld surface analysis of 3-benzoyl-6-(1,3-dioxo-1-phenylbutan-2-yl)-2-hydroxy-2-methyl-4-phenylcyclohexane-1,1-dicarbonitrile
Acta Crystallographica Section E, 2022, 78
2244091 CIF
HKL
Paper
La Te1.9P 42/n :210.1072; 10.1072; 18.2874
90; 90; 90
1868.16Poddig, Hagen; Doert, Thomas
LaTe~1.9~: a tenfold superstructure of the ZrSSi type
Acta Crystallographica Section E, 2022, 78
2244090 CIF
HKL
Paper
C30 H19 N OP 1 21/n 115.835; 7.0408; 37.245
90; 96.464; 90
4126.1Hsiao, Huan-Chang; Chen, Pei-Lin; Chuang, Shih-Ching
Crystal structure and fluorescence of 1-[8-phenyl-9-(phenylethynyl)-4<i>H</i>-benzo[<i>def</i>]carbazol-4-yl]ethan-1-one
Acta Crystallographica Section E, 2022, 78
2244089 CIF
HKL
Paper
C5 H7 Cl N4 O6P 1 21/c 15.0307; 20.386; 9.0181
90; 94.233; 90
922.34Sathya, Udhayasuriyan; Nirmalram, Jeyaraman Selvaraj; Gomathi, Sundaramoorthy; Perdih, Franc; Jegan Jennifer, Samson; Abdul Razak, Ibrahim
Crystal structures and Hirshfeld surface analyses of hypoxanthine salts involving 5-sulfosalicylate and perchlorate anions
Acta Crystallographica Section E, 2022, 78
2244088 CIF
HKL
Paper
C12 H14 N4 O9 SP 1 21/c 18.7055; 25.9927; 13.6479
90; 91.864; 90
3086.6Sathya, Udhayasuriyan; Nirmalram, Jeyaraman Selvaraj; Gomathi, Sundaramoorthy; Perdih, Franc; Jegan Jennifer, Samson; Abdul Razak, Ibrahim
Crystal structures and Hirshfeld surface analyses of hypoxanthine salts involving 5-sulfosalicylate and perchlorate anions
Acta Crystallographica Section E, 2022, 78
2244087 CIF
HKL
Paper
C20 H23 Br N6 O3 S2P 1 21/c 110.394; 26.2421; 8.986
90; 108.056; 90
2330.32Naghiyev, Farid N.; Khrustalev, Victor N.; Novikov, Anton P.; Akkurt, Mehmet; Rzayev, Rovnag M.; Akobirshoeva, Anzurat A.; Mamedov, Ibrahim G.
Crystal structure and Hirshfeld surface analysis of 5-amino-5'-bromo-2'-oxo-2,3-dihydro-1<i>H</i>-spiro[imidazo[1,2-<i>a</i>]pyridine-7,3'-indoline]-6,8-dicarbonitrile dimethyl sulfoxide disolvate
Acta Crystallographica Section E, 2022, 78
2244086 CIF
HKL
Paper
C11 H15 N2 O4 PP b c a13.229; 10.5551; 17.8346
90; 90; 90
2490.3Naeem, Marilyn; Sherwood, Alexander M.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
The crystal structure of baeocystin
Acta Crystallographica Section E, 2022, 78
2244085 CIF
HKL
Paper
C10 H9 Eu O7C 1 2/c 126.5184; 7.2632; 15.3622
90; 130.906; 90
2236.3Jittipiboonwat, Prakottakarn; Chuasaard, Thammanoon; Rujiwatra, Apinpus
Crystal structure and photoluminescent properties of a new Eu^III^–phthalate–acetate coordination polymer
Acta Crystallographica Section E, 2022, 78, 536-539
2244084 CIF
HKL
Paper
C14 H8 Br2 F N3 O2P 1 21/c 116.0658; 7.0329; 12.7934
90; 96.847; 90
1435.21Atioğlu, Zeliha; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Mammadova, Naila A.; Babayeva, Gulnara V.; Khrustalev, Victor N.; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-1-[2,2-dibromo-1-(4-nitrophenyl)ethenyl]-2-(4-fluorophenyl)diazene
Acta Crystallographica Section E, 2022, 78, 530-535
2244083 CIF
HKL
Paper
C32 H56 N2 O3P 1 21/c 113.06508; 5.81242; 41.7384
90; 93.3315; 90
3164.25Khalilov, Ali N.; Khrustalev, Victor N.; Tereshina, Tatiana A.; Akkurt, Mehmet; Rzayev, Rovnag M.; Akobirshoeva, Anzurat A.; Mamedov, İbrahim G.
Crystal structure and Hirshfeld surface analysis of 1-(<i>tert</i>-butylamino)-3-mesitylpropan-2-ol hemihydrate
Acta Crystallographica Section E, 2022, 78, 525-529
2244082 CIF
HKL
Paper
C17 H18 Cu I N4 O S2P 1 21/c 14.5154; 22.2157; 20.4062
90; 94.818; 90
2039.8Chooto, Pipat; Saithong, Saowanit; Aemaeg, Weena; Vataporn, Siriwan; Pakawatchai, Chaveng; Innuphat, Chalermpol; Duangthong, Supunnee; Puetpaiboon, Walailak
Syntheses, crystal structures and Hirshfeld surface analyses of bis(2-mercaptobenzimidazole)bromo- and iodocopper(I) complexes
Acta Crystallographica Section E, 2022, 78
2244081 CIF
HKL
Paper
C14 H12 Br Cu N4 S2P 1 21/c 14.1549; 28.708; 13.2735
90; 95.564; 90
1575.8Chooto, Pipat; Saithong, Saowanit; Aemaeg, Weena; Vataporn, Siriwan; Pakawatchai, Chaveng; Innuphat, Chalermpol; Duangthong, Supunnee; Puetpaiboon, Walailak
Syntheses, crystal structures and Hirshfeld surface analyses of bis(2-mercaptobenzimidazole)bromo- and iodocopper(I) complexes
Acta Crystallographica Section E, 2022, 78
2244080 CIF
HKL
Paper
C19 H23 N3 O5P -17.874; 9.263; 27.996
81.03; 85.675; 68.229
1872.8Mahesha, Ninganayaka; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Abdelbaky, Mohammed S. M.; Garcia-Granda, Santiago
Crystal structures of six 4-(4-nitrophenyl)piperazin-1-ium salts
Acta Crystallographica Section E, 2022, 78
2244079 CIF
HKL
Paper
C36 H44 N6 O11P 1 21/c 115.808; 7.5198; 31.02
90; 92.561; 90
3683.8Mahesha, Ninganayaka; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Abdelbaky, Mohammed S. M.; Garcia-Granda, Santiago
Crystal structures of six 4-(4-nitrophenyl)piperazin-1-ium salts
Acta Crystallographica Section E, 2022, 78
2244078 CIF
HKL
Paper
C18 H23 N3 O5P -16.1136; 7.6965; 19.708
79.577; 87.162; 86.699
909.79Mahesha, Ninganayaka; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Abdelbaky, Mohammed S. M.; Garcia-Granda, Santiago
Crystal structures of six 4-(4-nitrophenyl)piperazin-1-ium salts
Acta Crystallographica Section E, 2022, 78
2244077 CIF
HKL
Paper
C17 H21 N3 O6P -19.636; 10.301; 10.867
103.9; 108.32; 112.96
857.8Mahesha, Ninganayaka; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Abdelbaky, Mohammed S. M.; Garcia-Granda, Santiago
Crystal structures of six 4-(4-nitrophenyl)piperazin-1-ium salts
Acta Crystallographica Section E, 2022, 78
2244076 CIF
HKL
Paper
C17 H22 I N3 O6P -17.7652; 9.2852; 13.93
94.985; 95.331; 104.875
960.09Mahesha, Ninganayaka; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Abdelbaky, Mohammed S. M.; Garcia-Granda, Santiago
Crystal structures of six 4-(4-nitrophenyl)piperazin-1-ium salts
Acta Crystallographica Section E, 2022, 78
2244075 CIF
HKL
Paper
C17 H22 Br N3 O6P -17.738; 9.32; 13.949
94.46; 95.04; 104.71
964Mahesha, Ninganayaka; Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Abdelbaky, Mohammed S. M.; Garcia-Granda, Santiago
Crystal structures of six 4-(4-nitrophenyl)piperazin-1-ium salts
Acta Crystallographica Section E, 2022, 78
2244074 CIF
HKL
C14 H20 Cl2 F6 N3 Ni P SP -18.725; 10.507; 11.316
98.065; 101.274; 96.15
997.6Hirotsu, Masakazu; Sanou, Junhei; Nakae, Toyotaka; Matsunaga, Takumi; Kinoshita, Isamu
Crystal structures and electrochemical properties of nickel(II) complexes with <i>N</i>,<i>N</i>',<i>N</i>'',<i>S</i>-tetradentate Schiff base ligands
Acta Crystallographica Section E, 2022, 78
2244073 CIF
HKL
Paper
C12 H18 Cl N3 Ni SP 1 21/n 17.8601; 9.8884; 18.19
90; 98.677; 90
1397.6Hirotsu, Masakazu; Sanou, Junhei; Nakae, Toyotaka; Matsunaga, Takumi; Kinoshita, Isamu
Crystal structures and electrochemical properties of nickel(II) complexes with <i>N</i>,<i>N</i>',<i>N</i>'',<i>S</i>-tetradentate Schiff base ligands
Acta Crystallographica Section E, 2022, 78
2244072 CIF
HKL
Paper
C32 H22 Cl4 I2 N2P 1 21/n 19.6519; 28.312; 11.1909
90; 92.154; 90
3055.9Dunning, Taylor J.; Bosch, Eric; Groeneman, Ryan H.
Halogen-bonded zigzag molecular network based upon 1,2-diiodoperchlorobenzene and the photoproduct <i>rctt</i>-1,3-bis(pyridin-4-yl)-2,4-diphenylcyclobutane
Acta Crystallographica Section E, 2022, 78
2244071 CIF
HKL
Paper
C34 H82 N14 O2 S8 Sb2 Zn3P -18.7856; 13.1738; 14.0096
67.018; 77.677; 84.22
1458.1Näther, Christian; Danker, Felix; Bensch, Wolfgang
Crystal structure of μ~3~-tetrathioantimonato-tris[(cyclam)zinc(II)] tetrathioantimonate acetonitrile disolvate dihydrate showing Zn disorder over the cyclam ring planes (cyclam = 1,4,8,11-tetraazacyclotetradecane)
Acta Crystallographica Section E, 2022, 78
2244070 CIF
HKL
Paper
C10 H13 Br N2 O3 SC 1 2/c 121.0939; 9.252; 15.0283
90; 116.211; 90
2631.4Bookwala, Mustafa; Patel, Saloni; Flaherty, Patrick T.; Wildfong, Peter L. D.
Crystal structure of 4-bromo-<i>N</i>-(propylcarbamoyl)benzenesulfonamide
Acta Crystallographica Section E, 2022, 78
2244069 CIF
HKL
Paper
C21 H22 Cl N O5P -17.332; 9.886; 13.27
93.359; 102.703; 92.41
935.2Kornilova, Tatiana; Glebov, Viktor; Castañeda, Raúl; Timofeeva, Tatiana V.
A new pseudopolymorph of berberine chloride: crystal structure and Hirshfeld surface analysis
Acta Crystallographica Section E, 2022, 78
2244068 CIF
HKL
Paper
C6 H50 N4 O44 V10 Zn2P 1 21/n 115.5436; 8.6538; 16.7362
90; 108.628; 90
2133.27Ebrahimi, Arash; Gyepes, Róbert; Bujdoš, Marek; Krivosudský, Lukáš
Crystal structure of bis(ammonium) bis[pentaaqua(dimethylformamide)zinc(II)] decavanadate tetrahydrate
Acta Crystallographica Section E, 2022, 78
2244067 CIF
HKL
Paper
C33 H33 N3P -17.9106; 10.4468; 15.5735
79.988; 77.717; 77.909
1218.33Kubono, Koji; Tani, Keita; Kashiwagi, Yukiyasu; Tani, Fumito; Matsumoto, Taisuke
Synthesis and crystal structure of <i>anti</i>-10-butyl-10,11,22,23-tetrahydro-9<i>H</i>,21<i>H</i>-5,8:15,12-bis(metheno)[1,5,11]triazacyclohexadecino[1,16-<i>a</i>:5,6-<i>a</i>']diindole
Acta Crystallographica Section E, 2022, 78
2244066 CIF
HKL
Paper
C16 H14 N2 OP 1 21/n 15.87685; 7.5999; 28.4578
90; 90.604; 90
1270.95Taneda, Masatsugu; Nishi, Masato; Kubono, Koji; Kashiwagi, Yukiyasu; Matsumoto, Taisuke
Crystal structure of <i>N</i>-(1<i>H</i>-indol-2-ylmethylidene)-4-methoxyaniline
Acta Crystallographica Section E, 2022, 78, 449-452
2244065 CIF
HKL
Paper
C18 H19 Cl2 N3 O3I 1 2/a 119.6562; 7.5587; 26.4903
90; 109.762; 90
3704Daoui, Said; Çınar, Emine Berrin; Dege, Necmi; Benchat, Noureddine; Saif, Eiad; Karrouchi, Khalid
Crystal structure of (<i>E</i>)-3-({6-[2-(4-chlorophenyl)ethenyl]-3-oxo-2,3-dihydropyridazin-4-yl}methyl)pyridin-1-ium chloride dihydrate
Acta Crystallographica Section E, 2022, 78, 458-462
2244064 CIF
HKL
Paper
C15 H13 N O2 SP 1 21/c 114.6666; 13.8922; 6.26063
90; 100.127; 90
1255.74Metwally, Nadia H.; Elgemeie, Galal H.; Jones, Peter G.
Crystal structure of 2-(2,5-dimethoxyphenyl)benzo[<i>d</i>]thiazole
Acta Crystallographica Section E, 2022, 78, 445-448
2244063 CIF
HKL
Paper
C11 H8 N4 O SP c a 2111.142; 7.2555; 27.333
90; 90; 90
2209.6Nikitina, Evgeniya V.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Petkevich, Sergey K.; Akishina, Ekaterina A.; Khrustalev, Victor N.; Mlowe, Sixberth
Crystal structure and Hirshfeld surface analysis of 5-(5-phenyl-1,2-oxazol-3-yl)-1,3,4-thiadiazol-2-amine
Acta Crystallographica Section E, 2022, 78, 453-457
2244062 CIF
Paper
C18 H14 N2 O3 SP b c a7.3003; 18.9557; 21.9045
90; 90; 90
3031.2Ifeanyieze, Kenechukwu J.; Ayiya, Bikimi B.; Okpareke, Obinna C.; Groutso, Tatiana V.; Asegbeloyin, Jonnie N.
Crystal structure, Hirshfeld surface and computational study of 1-(9,10-dioxo-9,10-dihydroanthracen-1-yl)-3-propanoylthiourea
Acta Crystallographica Section E, 2022, 78
2244061 CIF
HKL
C14 H9 N3 OP b c a12.0256; 7.7396; 23.8551
90; 90; 90
2220.3Mirgaux, Manon; Scaillet, Tanguy; Kozlova, Arina; Tumanov, Nikolay; Frederick, Raphaël; Bodart, Laurie; Wouters, Johan
Structural study of bioisosteric derivatives of 5-(1<i>H</i>-indol-3-yl)-benzotriazole and their ability to form chalcogen bonds
Acta Crystallographica Section E, 2022, 78
2244060 CIF
HKL
C14 H9 N3 SP b c a7.5884; 7.106; 43.2464
90; 90; 90
2331.98Mirgaux, Manon; Scaillet, Tanguy; Kozlova, Arina; Tumanov, Nikolay; Frederick, Raphaël; Bodart, Laurie; Wouters, Johan
Structural study of bioisosteric derivatives of 5-(1<i>H</i>-indol-3-yl)-benzotriazole and their ability to form chalcogen bonds
Acta Crystallographica Section E, 2022, 78
2244059 CIF
HKL
Paper
C20 H13 N3 O2 S SeP -17.776; 9.9573; 11.4124
90.97; 92.771; 94.283
879.95Mirgaux, Manon; Scaillet, Tanguy; Kozlova, Arina; Tumanov, Nikolay; Frederick, Raphaël; Bodart, Laurie; Wouters, Johan
Structural study of bioisosteric derivatives of 5-(1<i>H</i>-indol-3-yl)-benzotriazole and their ability to form chalcogen bonds
Acta Crystallographica Section E, 2022, 78
2244058 CIF
HKL
Paper
C12 H10 Cl N O3P 1 21/c 18.3515; 16.6672; 7.9705
90; 107.191; 90
1059.9Filali Baba, Yassir; Hayani, Sonia; Dalbouha, Samira; Hökelek, Tuncer; Ouazzani Chahdi, Fouad; Mague, Joel T.; Kandri Rodi, Youssef; Sebbar, Nada Kheira; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis, interaction energy and DFT calculations and energy frameworks of methyl 6-chloro-1-methyl-2-oxo-1,2-dihydroquinoline-4-carboxylate
Acta Crystallographica Section E, 2022, 78
2244057 CIF
HKL
Paper
C14 H8 Br2 F N3 O2P b c n14.87; 15.2915; 13.103
90; 90; 90
2979.42Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Mammadova, Naila A.; Suleymanova, Gulnar T.; Khrustalev, Victor N.; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-1-[2,2-dibromo-1-(2-nitrophenyl)ethenyl]-2-(4-fluorophenyl)diazene
Acta Crystallographica Section E, 2022, 78
2244056 CIF
HKL
Paper
C15 H12 N2 O3 SP 1 21/c 15.7667; 28.4129; 15.5339
90; 91.728; 90
2544.05Benarous, Nesrine; Moussa Slimane, Nabila; Bougueria, Hassiba; Boutebdja, Mehdi; Cherouana, Aouatef
Crystal structure and Hirshfeld surface analysis of 2-(2-hydroxyphenyl)quinoline-6-sulfonamide
Acta Crystallographica Section E, 2022, 78
2244055 CIF
HKL
C46.14 H38.54 N6 O2.14 ZnP 1 21/c 110.1249; 13.54; 27.0447
90; 95.1464; 90
3692.64Chaudhri, Nivedita; Brückner, Christian; Zeller, Matthias
Crystal structure of <i>cis</i>-7,8-dihydroxy-5,10,15,20-tetraphenylchlorin and its zinc(II)–ethylenediamine complex
Acta Crystallographica Section E, 2022, 78
2244054 CIF
HKL
Paper
C51 H42 N6 O2P -110.0193; 15.2554; 17.7983
69.918; 74.926; 84.14
2466.9Chaudhri, Nivedita; Brückner, Christian; Zeller, Matthias
Crystal structure of <i>cis</i>-7,8-dihydroxy-5,10,15,20-tetraphenylchlorin and its zinc(II)–ethylenediamine complex
Acta Crystallographica Section E, 2022, 78
2244053 CIF
HKL
C15 H19.3 N4 O8.65 S2P 21 21 214.669; 17.8029; 23.1486
90; 90; 90
1924.15Nisbet, Matthew L.; Puzan, Marissa; Wojtas, Lukasz; Samas, Brian; Wood, Geoffrey P. F.
Crystal structures of anhydrous and hydrated ceftibuten
Acta Crystallographica Section E, 2022, 78
2244052 CIF
HKL
Paper
C15 H14 N4 O6 S2P 21 21 214.7727; 17.5228; 21.8526
90; 90; 90
1827.56Nisbet, Matthew L.; Puzan, Marissa; Wojtas, Lukasz; Samas, Brian; Wood, Geoffrey P. F.
Crystal structures of anhydrous and hydrated ceftibuten
Acta Crystallographica Section E, 2022, 78
2244051 CIF
HKL
Paper
C20 H23 N O2P 1 21/c 15.7062; 34.009; 8.5042
90; 98.178; 90
1633.6Cheng, Dong; Gao, Xinlei; Huang, Jiating; Meng, Xiang-Zhen
Crystal structure and Hirshfeld surface analysis of 7,7-dimethyl-2-phenyl-3,3a,4,6,7,8,9,9a-octahydro-1<i>H</i>-benzo[<i>f</i>]isoindole-1,5(2<i>H</i>)-dione
Acta Crystallographica Section E, 2022, 78
2244050 CIF
HKL
Paper
C4 H6 N2 OP 1 21/n 110.6201; 8.0201; 18.2085
90; 91.262; 90
1550.5Wysocki, Megan M.; Puzovic, Gorana; Dowell, Keith L.; Reinheimer, Eric W.; Gerlach, Deidra L.
Crystal structure of 1<i>H</i>-imidazole-1-methanol
Acta Crystallographica Section E, 2022, 78
2244049 CIF
HKL
Paper
C14 H14 N2 S3P b c a10.0771; 16.0292; 17.8768
90; 90; 90
2887.6Azzam, Rasha A.; Elgemeie, Galal H.; Elsayed, Rasha E.; Gad, Nagwa M.; Jones, Peter G.
Crystal structure of 2-(benzo[<i>d</i>]thiazol-2-yl)-3,3-bis(ethylsulfanyl)acrylonitrile
Acta Crystallographica Section E, 2022, 78
2244048 CIF
HKL
Paper
C10 H12 N2 OP 21 21 218.2248; 8.7542; 13.0712
90; 90; 90
941.15Naeem, Marilyn; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
Crystal structure of serotonin
Acta Crystallographica Section E, 2022, 78
2244047 CIF
HKL
Paper
C16 H18 Cd Cl3.9 I0.1 N4P -19.4304; 10.7968; 10.7565
99.209; 110.746; 90.837
1007.97Vassilyeva, Olga Yu.; Buvaylo, Elena A.; Kokozay, Vladimir N.; Skelton, Brian W.
Organic–inorganic hybrid mixed-halide Zn^II^ and Cd^II^ tetrahalometallates with the 2-methylimidazo[1,5-<i>a</i>]pyridinium cation
Acta Crystallographica Section E, 2022, 78
2244046 CIF
HKL
Paper
C16 H18 Br2.42 Cd Cl1.58 N4P -19.5172; 10.8293; 10.9697
99.62; 110.413; 90.827
1041.45Vassilyeva, Olga Yu.; Buvaylo, Elena A.; Kokozay, Vladimir N.; Skelton, Brian W.
Organic–inorganic hybrid mixed-halide Zn^II^ and Cd^II^ tetrahalometallates with the 2-methylimidazo[1,5-<i>a</i>]pyridinium cation
Acta Crystallographica Section E, 2022, 78
2244045 CIF
HKL
Paper
C16 H18 Cl3.19 I0.81 N4 ZnP -19.4588; 10.8892; 10.8343
100.305; 110.91; 90.955
1021.67Vassilyeva, Olga Yu.; Buvaylo, Elena A.; Kokozay, Vladimir N.; Skelton, Brian W.
Organic–inorganic hybrid mixed-halide Zn^II^ and Cd^II^ tetrahalometallates with the 2-methylimidazo[1,5-<i>a</i>]pyridinium cation
Acta Crystallographica Section E, 2022, 78
2244044 CIF
HKL
Paper
C21 H23 Cu2 N2 O5.5P 1 21/n 16.9688; 25.8066; 22.829
90; 95.418; 90
4087.25Diallo, Alassane Saïdou; Thiam, Ibrahima Elhadji; Gueye-Ndiaye, Mbossé; Dieng, Moussa; Orton, James; Simon, Coles; Gaye, Mohamed
Tetranuclear copper(II) complex of 2-hydroxy-<i>N</i>,<i>N</i>'-bis[1-(2-hydroxyphenyl)ethylidene]propane-1,3-diamine
Acta Crystallographica Section E, 2022, 78
2244043 CIF
Paper
C23 H24 N2 O5P -19.4329; 10.9974; 11.931
115.244; 93.939; 104.18
1064.01Yennawar, Hemant P.; Sigmon, Anna
Crystal structure of racemic (<i>R</i>/<i>S</i>,<i>E</i>)-2-(4-hydroxyphenyl)-4-(2-phenylhydrazin-1-ylidene)chromane-5,7-diol ethanol monosolvate
Acta Crystallographica Section E, 2022, 78
2244042 CIF
HKL
Paper
C10 H10 N2 O2P 21 21 217.6496; 8.7565; 14.128
90; 90; 90
946.3Pintro, Chirs J.; Long, Analeece K.; Amonette, Allison J.; Lobue, James M.; Padgett, Clifford W.
Crystal structures and Hirshfeld surface analysis of 5-amino-1-(4-methoxyphenyl)pyrazole-4-carboxylic acid and 5-amino-3-(4-methoxyphenyl)isoxazole
Acta Crystallographica Section E, 2022, 78, 336-339
2244041 CIF
HKL
Paper
C11 H11 N3 O3P 1 21/n 13.9608; 24.104; 11.1762
90; 90.189; 90
1067Pintro, Chirs J.; Long, Analeece K.; Amonette, Allison J.; Lobue, James M.; Padgett, Clifford W.
Crystal structures and Hirshfeld surface analysis of 5-amino-1-(4-methoxyphenyl)pyrazole-4-carboxylic acid and 5-amino-3-(4-methoxyphenyl)isoxazole
Acta Crystallographica Section E, 2022, 78, 336-339
2244040 CIF
HKL
Paper
C19 H17 N3 O2P 1 21/n 112.91; 6.32; 21.17
90; 106.48; 90
1656.3Asadov, Khammed A.; Khrustalev, Victor N.; Dobrokhotova, Ekaterina V.; Akkurt, Mehmet; Huseynova, Afet T.; Akobirshoeva, Anzurat A.; Huseynov, Elnur Z.
Crystal structure and Hirshfeld surface analysis of 2-amino-4-(4-methoxyphenyl)-6-oxo-1-phenyl-1,4,5,6-tetrahydropyridine-3-carbonitrile
Acta Crystallographica Section E, 2022, 78
2244039 CIF
HKL
Paper
C22 H15 N3 O4P 1 21/c 115.9256; 14.8256; 7.6787
90; 90.566; 90
1812.9El Kalai, Fouad; Baydere, Cemile; Dege, Necmi; Abudunia, Abdulmalik; Benchat, Noureddine; Karrouchi, Khalid
Crystal structure and Hirshfeld surface analysis of 2-oxo-2-phenylethyl 3-nitroso-2-phenylimidazo[1,2-<i>a</i>]pyridine-8-carboxylate
Acta Crystallographica Section E, 2022, 78
2244038 CIF
HKL
Paper
C18 H32 N2 O6 ZnP 1 21/c 114.6212; 14.8002; 20.1288
90; 101.719; 90
4265Johnson, Keneshia O.; Brown, Antionette; Farris, Gabriella; Starks, Alexabria; Butcher, Ray J.; Matthews, Jason S.
Distorted zinc coordination polyhedra in bis(1-ethoxy-2-{[(2-methoxyethyl)imino]methyl}propan-1-olato)zinc, a possible CVD precursor for zinc oxide thin films
Acta Crystallographica Section E, 2022, 78
2244037 CIF
HKL
Paper
C14 H13 N O2P 1 21/c 126.783; 5.2477; 8.1343
90; 97.594; 90
1133.24Pearson, Wayne H.; Urban, Joseph J.; MacArthur, Amy H. Roy; Lin, Shirley; Cabrera, Dylan W. L.
Crystal structures of <i>N</i>-[4-(trifluoromethyl)phenyl]benzamide and <i>N</i>-(4-methoxyphenyl)benzamide at 173K: a study of the energetics of conformational changes due to crystal packing
Acta Crystallographica Section E, 2022, 78
2244036 CIF
HKL
Paper
C14 H10 F3 N OP -15.3606; 7.7831; 14.415
77.17; 79.421; 89.719
576Pearson, Wayne H.; Urban, Joseph J.; MacArthur, Amy H. Roy; Lin, Shirley; Cabrera, Dylan W. L.
Crystal structures of <i>N</i>-[4-(trifluoromethyl)phenyl]benzamide and <i>N</i>-(4-methoxyphenyl)benzamide at 173K: a study of the energetics of conformational changes due to crystal packing
Acta Crystallographica Section E, 2022, 78
2244035 CIF
HKL
Paper
C34 H82 Co3 N14 O2 S8 Sb2P -18.7292; 12.968; 13.8936
66.218; 77.035; 83.321
1401.93Näther, Christian; Danker, Felix; Bensch, Wolfgang
Synthesis and crystal structure of poly[[di-μ~3~-tetrathioantimonato-tris[(cyclam)cobalt(II)]] acetonitrile disolvate dihydrate] (cyclam = 1,4,8,11-tetraazacyclotetradecane)
Acta Crystallographica Section E, 2022, 78
2244034 CIF
HKL
Paper
C24 H27 Cl F N3 O8P 17.2165; 8.8298; 10.1184
92.997; 95.219; 111.557
594.6Nugraha, Yuda Prasetya; Sugiyama, Haruki; Uekusa, Hidehiro
Ciprofloxacin salt and salt co-crystal with dihydroxybenzoic acids
Acta Crystallographica Section E, 2022, 78
2244033 CIF
HKL
Paper
C24 H24 F N3 O7P 1 21/c 17.9722; 21.2705; 13.086
90; 101.805; 90
2172.1Nugraha, Yuda Prasetya; Sugiyama, Haruki; Uekusa, Hidehiro
Ciprofloxacin salt and salt co-crystal with dihydroxybenzoic acids
Acta Crystallographica Section E, 2022, 78
2244032 CIF
HKL
Paper
C20 H16 Br N3 O2P 1 c 19.5889; 13.2144; 14.4529
90; 103.939; 90
1777.4Mamedov, Ibrahim G.; Khrustalev, Victor N.; Akkurt, Mehmet; Novikov, Anton P.; Asgarova, Ayten R.; Aliyeva, Khatira N.; Akobirshoeva, Anzurat A.
Crystal structure and Hirshfeld surface analysis of 5-acetyl-2-amino-4-(4-bromophenyl)-6-oxo-1-phenyl-1,4,5,6-tetrahydropyridine-3-carbonitrile
Acta Crystallographica Section E, 2022, 78
2244031 CIF
HKL
C14 H30 Co N6 O3 S2P 1 21/n 111.1463; 15.7705; 12.1824
90; 103.886; 90
2078.87Krebs, Christoph; Jess, Inke; Näther, Christian
Crystal structures of two Co(NCS)~2~ urotropine coordination compounds with different Co coordinations
Acta Crystallographica Section E, 2022, 78
2244030 CIF
HKL
Paper
C60 H123.2 Co2 N36 O5.6 S4P -112.1536; 12.9256; 12.9374
76.629; 80.395; 80.578
1932.9Krebs, Christoph; Jess, Inke; Näther, Christian
Crystal structures of two Co(NCS)~2~ urotropine coordination compounds with different Co coordinations
Acta Crystallographica Section E, 2022, 78
2244029 CIF
HKL
Paper
C28 H46 MgP -18.7025; 9.0903; 9.2033
80.829; 81.151; 63.004
637.68Bachmann, Nico; Wirtz, Lisa; Morgenstern, Bernd; Müller, Carsten; Schäfer, André
Crystal structure of 1,1',2,2',4,4'-hexaisopropylmagnesocene
Acta Crystallographica Section E, 2022, 78
2244028 CIF
HKL
C14 H9 I Se2P 1 21/c 112.9606; 13.5999; 8.0448
90; 95.585; 90
1411.27Luz, Eduardo Q.; Santana, Francielli S.; Silverio, Gabriel L.; Tullio, Suelen C. M. C.; Iodice, Bianca; Prola, Liziê D. T.; Barbosa, Ronilson V.; Rampon, Daniel S.
Crystal structures of 3-halo-2-organochalcogenylbenzo[<i>b</i>]chalcogenophenes
Acta Crystallographica Section E, 2022, 78
2244027 CIF
HKL
C14 H9 Br Se2P 1 21/c 112.3864; 13.6816; 8.0982
90; 96.398; 90
1363.82Luz, Eduardo Q.; Santana, Francielli S.; Silverio, Gabriel L.; Tullio, Suelen C. M. C.; Iodice, Bianca; Prola, Liziê D. T.; Barbosa, Ronilson V.; Rampon, Daniel S.
Crystal structures of 3-halo-2-organochalcogenylbenzo[<i>b</i>]chalcogenophenes
Acta Crystallographica Section E, 2022, 78
2244026 CIF
HKL
C14 H9 I S2P 1 21/c 18.4872; 9.9629; 15.6485
90; 97.052; 90
1313.18Luz, Eduardo Q.; Santana, Francielli S.; Silverio, Gabriel L.; Tullio, Suelen C. M. C.; Iodice, Bianca; Prola, Liziê D. T.; Barbosa, Ronilson V.; Rampon, Daniel S.
Crystal structures of 3-halo-2-organochalcogenylbenzo[<i>b</i>]chalcogenophenes
Acta Crystallographica Section E, 2022, 78
2244025 CIF
HKL
C14 H9 Br S2P 1 21/c 18.2471; 9.9562; 15.7601
90; 98.967; 90
1278.2Luz, Eduardo Q.; Santana, Francielli S.; Silverio, Gabriel L.; Tullio, Suelen C. M. C.; Iodice, Bianca; Prola, Liziê D. T.; Barbosa, Ronilson V.; Rampon, Daniel S.
Crystal structures of 3-halo-2-organochalcogenylbenzo[<i>b</i>]chalcogenophenes
Acta Crystallographica Section E, 2022, 78
2244024 CIF
HKL
Paper
C9 H16 Ag B F4 N3 O2 PC 1 c 110.116; 12.186; 10.979
90; 98.26; 90
1339.4Udvardy, Antal; Kathó, Ágnes; Papp, Gábor; Joó, Ferenc; Gál, Gyula Tamás
Novel three-dimensional coordination polymer of 2-(1,3,5-triaza-7-phosphoniatricyclo[3.3.1.1^3,7^]decan-7-yl)ethanoic acid with silver(I) tetrafluoroborate
Acta Crystallographica Section E, 2022, 78
2244023 CIF
HKL
Paper
C5.33 H9.33 Fe N4 O3.33 PtP m -3 m10.5089; 10.5089; 10.5089
90; 90; 90
1160.57Hiiuk, Volodymyr M.; Mykhailovych, Vasyl; Shova, Sergiu; Golenya, Irina A.; Gural'skiy, Il'ya A.
Crystal structure of poly[[diaquatetra-μ~2~-cyanido-platinum(II)iron(II)] methanol 4/3-solvate]: a three-dimensional Hofmann clathrate analogue
Acta Crystallographica Section E, 2022, 78, 216-219
2244022 CIF
HKL
Paper
C48 H56 Co4 N8 O16 S4P -4 21 c15.6121; 15.6121; 11.8359
90; 90; 90
2884.9Park, Ava M.; Golen, James A.; Manke, David R.
A cuboidal [Cu~4~(SO~4~)~4~] structure supported by β-picoline ligands
Acta Crystallographica Section E, 2022, 78, 108-110
2244021 CIF
HKL
Paper
C25 H21 N3 O2 SP 1 21/n 118.2782; 19.1455; 24.6978
90; 96.323; 90
8590.3Mohamed, Shaaban K.; Bakhite, Etify A.; Çelikesir, Sevim Türktekin; Abdu-Allah, Hajjaj H. M.; Akkurt, Mehmet; Ibrahim, Omaima F.; Mague, Joel T.; Al-Waleedy, Safiyyah A. H.
Crystal structure and Hirshfeld surface analysis of 5-acetyl-3-amino-6-methyl-<i>N</i>-phenyl-4-[(<i>E</i>)-2-phenylethenyl]thieno[2,3-<i>b</i>]pyridine-2-carboxamide
Acta Crystallographica Section E, 2022, 78, 225-230
2244020 CIF
HKL
Paper
C7 H7 N3 SC 1 2/c 116.1179; 11.8796; 16.5649
90; 91.974; 90
3169.9Rakhmonova, Dilnoza; Gapurova, Lobar; Razzoqova, Surayyo; Kadirova, Shakhnoza; Torambetov, Batirbay; Kadirova, Zukhra; Shishkina, Svitlana
5-Amino-1<i>H</i>-benzimidazole-2(3<i>H</i>)-thione: molecular, crystal structure and Hirshfeld surface analysis
Acta Crystallographica Section E, 2022, 78, 231-234
2244019 CIF
HKL
Paper
C25 H28 N2 O5 SP -110.0643; 10.3592; 12.0685
83.296; 80.77; 75.638
1199.23Al-Taifi, Elham A.; Marae, Islam S.; El-Ossaily, Yasser A.; Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Bakhite, Etify A.
Crystal structure and Hirshfeld surface analysis of 2-{[7-acetyl-4-cyano-6-hydroxy-8-(4-methoxyphenyl)-1,6-dimethyl-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}acetic acid ethyl ester
Acta Crystallographica Section E, 2022, 78, 220-224
2244018 CIF
HKL
Paper
C10 H13 N3 O4P 1 21/n 18.51; 8.2525; 16.513
90; 93.76; 90
1157.19Rakhmonova, Dilnoza; Kadirova, Zukhra; Torambetov, Batirbay; Kadirova, Shakhnoza; Ashurov, Jamshid; Shishkina, Svitlana
The molecular and crystal structures of 2-(3-hydroxypropyl)benzimidazole and its nitrate salt
Acta Crystallographica Section E, 2022, 78
2244017 CIF
HKL
Paper
C10 H12 N2 OP 21 21 215.852; 12.437; 12.444
90; 90; 90
905.7Rakhmonova, Dilnoza; Kadirova, Zukhra; Torambetov, Batirbay; Kadirova, Shakhnoza; Ashurov, Jamshid; Shishkina, Svitlana
The molecular and crystal structures of 2-(3-hydroxypropyl)benzimidazole and its nitrate salt
Acta Crystallographica Section E, 2022, 78
2244016 CIF
HKL
Paper
C12 H62 N4 Na6 O60 W12P -112.0541; 12.0821; 12.705
73.18; 65.308; 64.345
1502.07Sifaki, Kleanthi; Gumerova, Nadiia I.; Giester, Gerald; Rompel, Annette
Crystal structure of hexasodium tetraserinolium paratungstate B decahydrate, [Na~6~{(CH~2~OH)~2~CHNH~3~}~4~][W~12~O~40~(OH)~2~]·10H~2~O
Acta Crystallographica Section E, 2022, 78
2244015 CIF
HKL
Paper
B37 Mg Na3 Si9R -3 m :H10.163; 10.163; 16.5742
90; 90; 120
1482.54Morito, Haruhiko; Ikeda, Takuji; Katsura, Yukari; Yamane, Hisanori
Na~3~MgB~37~Si~9~: an icosahedral B~12~ cluster framework containing {Si~8~} units
Acta Crystallographica Section E, 2022, 78
2244014 CIF
HKL
Paper
C18 H20 Br N5 Ni O4P -18.3057; 9.23; 14.397
95.338; 104.493; 112.592
964.23Vassilyeva, Olga Yu.; Buvaylo, Elena A.; Kokozay, Vladimir N.; Studzinsky, Sergey L.; Skelton, Brian W.; Vasyliev, Georgii S.
Ni^II^ molecular complex with a tetradentate aminoguanidine-derived Schiff base ligand: structural, spectroscopic and electrochemical studies and photoelectric response
Acta Crystallographica Section E, 2022, 78
2244013 CIF
HKL
C15 H24 N2 SR -3 :H25.5231; 25.5231; 12.6225
90; 90; 120
7121.03Dhaene, Evert; Van Driessche, Isabel; De Buysser, Klaartje; Van Hecke, Kristof
Crystal structures of three <i>N</i>,<i>N</i>,<i>N</i>'-trisubstituted thioureas for reactivity-controlled nanocrystal synthesis
Acta Crystallographica Section E, 2022, 78
2244012 CIF
HKL
C14 H14 N2 SP -19.8379; 10.8014; 13.2328
65.913; 87.752; 84.059
1276.82Dhaene, Evert; Van Driessche, Isabel; De Buysser, Klaartje; Van Hecke, Kristof
Crystal structures of three <i>N</i>,<i>N</i>,<i>N</i>'-trisubstituted thioureas for reactivity-controlled nanocrystal synthesis
Acta Crystallographica Section E, 2022, 78
2244011 CIF
HKL
C22 H22 N2 SP 1 21/c 111.2378; 14.7792; 11.3165
90; 102.042; 90
1838.15Dhaene, Evert; Van Driessche, Isabel; De Buysser, Klaartje; Van Hecke, Kristof
Crystal structures of three <i>N</i>,<i>N</i>,<i>N</i>'-trisubstituted thioureas for reactivity-controlled nanocrystal synthesis
Acta Crystallographica Section E, 2022, 78
2244010 CIF
HKL
C19 H16 N2P b c a11.6878; 18.0941; 26.9604
90; 90; 90
5701.6Kalle, Paulina; Tatarin, Sergei V.; Kiseleva, Marina A.; Zakharov, Alexander Yu.; Smirnov, Daniil E.; Bezzubov, Stanislav I.
Syntheses and crystal structures of 2-(<i>p</i>-tolyl)-1<i>H</i>-perimidine hemihydrate and 1-methyl-2-(<i>p</i>-tolyl)-1<i>H</i>-perimidine
Acta Crystallographica Section E, 2022, 78
2244009 CIF
HKL
Paper
C18 H15 N2 O0.5F d d d :27.2131; 13.8648; 53.4532
90; 90; 90
5345.8Kalle, Paulina; Tatarin, Sergei V.; Kiseleva, Marina A.; Zakharov, Alexander Yu.; Smirnov, Daniil E.; Bezzubov, Stanislav I.
Syntheses and crystal structures of 2-(<i>p</i>-tolyl)-1<i>H</i>-perimidine hemihydrate and 1-methyl-2-(<i>p</i>-tolyl)-1<i>H</i>-perimidine
Acta Crystallographica Section E, 2022, 78
2244008 CIF
HKL
Paper
C20 H23 N OP 1 21 18.3063; 7.5842; 13.841
90; 104.174; 90
845.39Periyannan, P.; Beemarao, M.; Karthik, K .; Ponnuswamy, S.; Ravichandran, K.
Crystal structure, DFT and Hirshfeld surface analysis of <i>N</i>-acetyl-<i>t</i>-3-methyl-<i>r</i>-2,<i>c</i>-6-diphenylpiperidine
Acta Crystallographica Section E, 2022, 78
2244007 CIF
HKL
Paper
C5 H11 N O S2P b c a9.716; 8.9709; 17.8577
90; 90; 90
1556.5Schultheiss, Nate; Holtsclaw, Jeremy; Zeller, Matthias
An orthorhombic polymorph of 2-(1,3,5-dithiazinan-5-yl)ethanol or MEA-dithiazine
Acta Crystallographica Section E, 2022, 78
2244006 CIF
HKL
Paper
C5 H11 N O S2P b c a9.5828; 8.8467; 17.64
90; 90; 90
1495.45Schultheiss, Nate; Holtsclaw, Jeremy; Zeller, Matthias
An orthorhombic polymorph of 2-(1,3,5-dithiazinan-5-yl)ethanol or MEA-dithiazine
Acta Crystallographica Section E, 2022, 78
2244005 CIF
HKL
C13 H21 N5 O8P -16.6211; 11.891; 12.389
116.32; 98.878; 98.39
838.1Subha, Veerappan; Seethalakshmi, Thangaraj; Balakrishnan, Thangavelu; Judith Percino, M.; Venkatesan, Perumal
Crystal structure and Hirshfeld surface analysis of the hydrated 2:1 adduct of piperazine-1,4-diium 3,5-dinitro-2-oxidobenzoate and piperazine
Acta Crystallographica Section E, 2022, 78
2244004 CIF
HKL
C7 H16 Cl N3 O SP b c a11.0924; 10.1898; 19.6434
90; 90; 90
2220.28Kayukova, Lyudmila A.; Yergaliyeva, Elmira M.; Vologzhanina, Anna V.
Redetermination of the structure of 2-amino-8-thia-1,5-diazaspiro[4,5]dec-1-en-5-ium chloride monohydrate
Acta Crystallographica Section E, 2022, 78
2244003 CIF
HKL
Paper
C7 H16 Cl N3 O SP b c a11.036; 10.1005; 19.291
90; 90; 90
2150.4Kayukova, Lyudmila A.; Yergaliyeva, Elmira M.; Vologzhanina, Anna V.
Redetermination of the structure of 2-amino-8-thia-1,5-diazaspiro[4,5]dec-1-en-5-ium chloride monohydrate
Acta Crystallographica Section E, 2022, 78
2244002 CIF
HKL
C8 H8 Cl3 N3 O4 S2P -18.4389; 8.8929; 9.7293
91.315; 106.113; 97.158
694.73Toro, Robert A.; Dugarte-Dugarte, Analio; van de Streek, Jacco; Henao, José Antonio; Delgado, José Miguel; Díaz de Delgado, Graciela
Crystal structure from X-ray powder diffraction data, DFT-D calculation, Hirshfeld surface analysis, and energy frameworks of (<i>RS</i>)-trichlormethiazide
Acta Crystallographica Section E, 2022, 78
2244001 CIF
Paper
C9 H14 Cl NP 21 21 216.7723; 7.1806; 20.542
90; 90; 90
998.94Kirchhoff, Jan-Lukas; Brieger, Lukas; Strohmann, Carsten
Crystal structure and Hirshfeld surface analysis of (<i>S</i>)-<i>N</i>-methyl-1-phenylethan-1-aminium chloride
Acta Crystallographica Section E, 2022, 78
2244000 CIF
HKL
Paper
C19 H35 N O4 S SiP 1 21 18.4627; 12.8187; 10.3926
90; 107.033; 90
1077.95Kirchhoff, Jan-Lukas; Koller, Stephan G.; Louven, Kathrin; Strohmann, Carsten
Crystal structure and Hirshfeld surface analysis of 1-[(benzyldimethylsilyl)methyl]-1-ethylpiperidin-1-ium ethanesulfonate
Acta Crystallographica Section E, 2022, 78
2243999 CIF
HKL
Paper
C21 H32 Fe O2C 1 2/c 147.641; 10.1522; 7.8747
90; 97.091; 90
3779.6McAdam, C. John; Simpson, Jim
Synthesis, crystal structure and Hirshfeld surface analysis of 1-ferrocenylundecane-1,11-diol
Acta Crystallographica Section E, 2022, 78
2243998 CIF
HKL
Paper
C18 H18 N2 O3 SP 21 21 215.9685; 11.058; 26.215
90; 90; 90
1730.2Simsek, Okan; Dincer, Muharrem; Dege, Necmi; Saif, Eiad; Yilmaz, Ibrahim; Cukurovali, Alaaddin
Crystal structure and Hirshfeld surface analysis of (<i>Z</i>)-4-{[4-(3-methyl-3-phenylcyclobutyl)thiazol-2-yl]amino}-4-oxobut-2-enoic acid
Acta Crystallographica Section E, 2022, 78
2243997 CIF
HKL
Paper
C17 H17 Br N2 O5P -18.8579; 10.5336; 11.0893
62.282; 75.437; 88.241
882.03El Ajlaoui, Rahhal; Hakmaoui, Yassine; Rakib, El Mostapha; Ketatni, El Mostafa; Saadi, Mohamed; El Ammari, Lahcen
Synthesis, crystal structure and Hirshfeld surface analysis of dimethyl 3-(3-bromophenyl)-6-methyl-7-oxo-3,5,6,7-tetrahydropyrazolo[1,2-<i>a</i>]pyrazole-1,2-dicarboxylate
Acta Crystallographica Section E, 2022, 78
2243996 CIF
HKL
Paper
C44.76 H43.05 F12 Mo2 O10.24P -17.7687; 12.099; 12.572
85.843; 81.208; 83.107
1157.6Aigeldinger, Elisabeth; Brandao, Lilliana; Powell, Troy; Hartnett, Alaina C.; Sun, Rui; Dogutan, Dilek K.; Zheng, Shao-Liang
Crystal structure of a trifluoromethyl benzoato quadruple-bonded dimolybdenum complex
Acta Crystallographica Section E, 2022, 78
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
2243967 CIF
HKL
Paper
C20 H17 Cl N2 O3P b c a7.3514; 11.5539; 41.397
90; 90; 90
3516.2Daoui, Said; Muwafaq, Israa; Çınar, Emine Berrin; Abudunia, Abdulmalik; Dege, Necmi; Benchat, Noureddine; Karrouchi, Khalid
Crystal structure and Hirshfeld surface analysis of 6-((<i>E</i>)-2-{4-[2-(4-chlorophenyl)-2-oxoethoxy]phenyl}ethenyl)-4,5-dihydropyridazin-3(2<i>H</i>)-one
Acta Crystallographica Section E, 2022, 78, 8-11
2243966 CIF
HKL
Paper
C33 H44 Cl2 F12 N2 P2 Pd2 S2 Sb2P b c a23.5167; 16.1492; 24.0414
90; 90; 90
9130.3Clerc, Arnaud; Saffon-Merceron, Nathalie; Monot, Julien; Martin Vaca, Blanca; Bourissou, Didier
Crystal structure of a dicationic Pd^II^ dimer containing a 2-[(diisopropylphosphanyl)methyl]quinoline-8-thiolate pincer ligand
Acta Crystallographica Section E, 2022, 78, 18-22
2243965 CIF
HKL
Paper
C10 H7 F3 N2 OP -15.4384; 8.8298; 10.0744
102.501; 96.764; 91.415
468.387Guseinov, Firudin I.; Kobrakov, Konstantin I.; Ugrak, Bogdan I.; Atioğlu, Zeliha; Akkurt, Mehmet; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of 2,2,2-trifluoro-1-(7-methylimidazo[1,2-<i>a</i>]pyridin-3-yl)ethan-1-one
Acta Crystallographica Section E, 2022, 78, 12-17
2243964 CIF
HKL
Paper
C37 H52 Cl2 O2P -18.2449; 9.1248; 12.1825
101.53; 102.729; 109.2
806.53Kurup, Sudheer S.; Nasser, Sandra; Ward, Cassandra L.; Groysman, Stanislav
Synthesis and structure of a new bulky bis(alkoxide) ligand on a terphenyl platform
Acta Crystallographica Section E, 2022, 78, 92-96
2243963 CIF
HKL
Paper
C22 H24 N2 O6P 21 21 218.1864; 9.2061; 27.7903
90; 90; 90
2094.4Daoui, Said; Kansiz, Sevgi; Aktas, Feyzi Alkim; Dege, Necmi; Saif, Eiad; Benchat, Noureddine; Karrouchi, Khalid
Crystal structure and molecular docking study of diethyl 2,2'-({[(1<i>E</i>,1'<i>E</i>)-(hydrazine-1,2-diylidene)bis(methanylylidene)]bis(4,1-phenylene)}bis(oxy))diacetate
Acta Crystallographica Section E, 2022, 78, 88-91
2243962 CIF
HKL
Paper
C24 H24 N2 O4P 1 21/n 14.7339; 18.406; 11.88
90; 98.47; 90
1023.8Kansiz, Sevgi; Yesilbag, Semanur; Dege, Necmi; Saif, Eiad; Agar, Erbil
Crystal structure and Hirshfeld surface analysis of 6,6'-((1<i>E</i>,1'<i>E</i>)-{[1,4-phenylenebis(methylene)]bis(azanylylidene)}bis(methaneylylidene))bis(2-methoxyphenol)
Acta Crystallographica Section E, 2022, 78
2243961 CIF
HKL
Paper
C28 H48 Co N6 S4C 1 2/c 124.0667; 8.8282; 18.891
90; 125.619; 90
3262.76Krebs, Christoph; Jess, Inke; Näther, Christian
Synthesis, crystal structure and thermal properties of bis(1,3-dicyclohexylthiourea-κ<i>S</i>)bis(isothiocyanato-κ<i>N</i>)cobalt(II)
Acta Crystallographica Section E, 2022, 78
2243960 CIF
HKL
Paper
B2 Rh3 SmP 6/m m m5.4438; 5.4438; 3.11901
90; 90; 120
80.048Tokuda, Makoto; Yubuta, Kunio; Shishido, Toetsu; Sugiyama, Kazumasa
Redetermination of the crystal structures of rare-earth trirhodium diboride <i>RE</i>Rh~3~B~2~ (<i>RE</i> = Pr, Nd and Sm) from single-crystal X-ray data
Acta Crystallographica Section E, 2022, 78
2243959 CIF
HKL
Paper
B2 Nd Rh3P 6/m m m5.4527; 5.4527; 3.11066
90; 90; 120
80.095Tokuda, Makoto; Yubuta, Kunio; Shishido, Toetsu; Sugiyama, Kazumasa
Redetermination of the crystal structures of rare-earth trirhodium diboride <i>RE</i>Rh~3~B~2~ (<i>RE</i> = Pr, Nd and Sm) from single-crystal X-ray data
Acta Crystallographica Section E, 2022, 78
2243958 CIF
HKL
Paper
B2 Pr Rh3P 6/m m m5.4676; 5.4676; 3.10837
90; 90; 120
80.474Tokuda, Makoto; Yubuta, Kunio; Shishido, Toetsu; Sugiyama, Kazumasa
Redetermination of the crystal structures of rare-earth trirhodium diboride <i>RE</i>Rh~3~B~2~ (<i>RE</i> = Pr, Nd and Sm) from single-crystal X-ray data
Acta Crystallographica Section E, 2022, 78
2243957 CIF
HKL
Paper
C8 H4 F5 N OP 1 21/c 114.4934; 5.8247; 9.7836
90; 90.87; 90
825.83Novikov, Anton P.; Bezdomnikov, Alexey A.; Grigoriev, Mikhail S.; German, Konstantin E.
Synthesis, crystal structure and Hirshfeld surface analysis of 2-(perfluorophenyl)acetamide in comparison with some related compounds
Acta Crystallographica Section E, 2022, 78, 80-83
2243956 CIF
HKL
C13 H13 N O4P 1 21/c 110.8649; 10.6185; 11.3616
90; 118.422; 90
1152.78Halz, Jan Henrik; Hentsch, Andreas; Wagner, Christoph; Merzweiler, Kurt
Synthesis and crystal structures of three Schiff bases derived from 3-formylacetylacetone and <i>o</i>-, <i>m</i>- and <i>p</i>-aminobenzoic acid
Acta Crystallographica Section E, 2022, 78
2243955 CIF
HKL
C13 H13 N O4P n m a11.488; 6.4726; 15.2012
90; 90; 90
1130.32Halz, Jan Henrik; Hentsch, Andreas; Wagner, Christoph; Merzweiler, Kurt
Synthesis and crystal structures of three Schiff bases derived from 3-formylacetylacetone and <i>o</i>-, <i>m</i>- and <i>p</i>-aminobenzoic acid
Acta Crystallographica Section E, 2022, 78
2243954 CIF
HKL
Paper
C13 H13 N O4C 1 2/c 110.6287; 12.374; 17.5419
90; 92.836; 90
2304.28Halz, Jan Henrik; Hentsch, Andreas; Wagner, Christoph; Merzweiler, Kurt
Synthesis and crystal structures of three Schiff bases derived from 3-formylacetylacetone and <i>o</i>-, <i>m</i>- and <i>p</i>-aminobenzoic acid
Acta Crystallographica Section E, 2022, 78
2243953 CIF
HKL
Paper
C21 H32 K N O6P 1 21/n 110.784; 9.754; 21.783
90; 91.864; 90
2290.1Brennessel, William W.; Ellis, John E.
Crystal structures of two novel iron isocyanides from the reaction of 2,6-dimethylphenyl isocyanide, CNXyl, with bis(anthracene)ferrate({-}1)
Acta Crystallographica Section E, 2022, 78
2243952 CIF
HKL
Paper
C89 H99 Fe N9 O2P -113.8912; 15.4941; 19.7902
85.342; 74.001; 70.884
3868.5Brennessel, William W.; Ellis, John E.
Crystal structures of two novel iron isocyanides from the reaction of 2,6-dimethylphenyl isocyanide, CNXyl, with bis(anthracene)ferrate({-}1)
Acta Crystallographica Section E, 2022, 78
2243951 CIF
HKL
Paper
C41 H37 Fe N3P 1 21/n 111.8528; 10.9022; 24.927
90; 93.057; 90
3216.5Brennessel, William W.; Ellis, John E.
Crystal structures of two novel iron isocyanides from the reaction of 2,6-dimethylphenyl isocyanide, CNXyl, with bis(anthracene)ferrate({-}1)
Acta Crystallographica Section E, 2022, 78
2243950 CIF
HKL
Paper
C6 H16 N2P 1 21/c 15.6987; 8.311; 8.453
90; 106.954; 90
382.95Schrimpf, Tobias; Otte, Felix; Strohmann, Carsten
Crystal structure of <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethanediamine
Acta Crystallographica Section E, 2022, 78
2243949 CIF
HKL
Paper
C19 H21 N O2P n a 2117.3298; 14.1856; 6.5857
90; 90; 90
1618.99Gümüş, Mustafa Kemal; Kansiz, Sevgi; Tulemisova, Gulzhamal Bagitovna; Dege, Necmi; Saif, Eiad
Crystal structure and Hirshfeld surface analysis of 3-(hydroxymethyl)-3-methyl-2,6-diphenylpiperidin-4-one
Acta Crystallographica Section E, 2022, 78
2243948 CIF
HKL
C17 H18 O SiP -18.7737; 9.1715; 9.813
102.219; 90.613; 110.28
720.85Schmidt, Annika; Krupp, Anna; Barth, Eva Rebecca; Strohmann, Carsten
Crystal structures and Hirshfeld surface analyses of bis(4,5-dihydrofuran-2-yl)dimethylsilane and (4,5-dihydrofuran-2-yl)(methyl)diphenylsilane
Acta Crystallographica Section E, 2022, 78
2243947 CIF
HKL
Paper
C10 H16 O2 SiP -18.2422; 8.3075; 8.294
94.149; 103.012; 104.909
529.55Schmidt, Annika; Krupp, Anna; Barth, Eva Rebecca; Strohmann, Carsten
Crystal structures and Hirshfeld surface analyses of bis(4,5-dihydrofuran-2-yl)dimethylsilane and (4,5-dihydrofuran-2-yl)(methyl)diphenylsilane
Acta Crystallographica Section E, 2022, 78
2243946 CIF
HKL
Paper
C16 H13 N3 O SP 1 21/n 111.7685; 16.3641; 16.3798
90; 110.646; 90
2951.85Pirnazarova, Nasiba; Yakubov, Ubaydullo; Allabergenova, Sevara; Tojiboev, Akmaljon; Turgunov, Kambarali; Elmuradov, Burkhon
Crystal structure and Hirshfeld surface analysis of 3-methyl-4-oxo-<i>N</i>-phenyl-3,4-dihydroquinazoline-2-carbothioamide
Acta Crystallographica Section E, 2022, 78, 47-50
2243945 CIF
HKL
Paper
C20 H19 I N2 SP -18.6382; 9.8182; 12.1922
77.2839; 85.1708; 74.7224
972.65Kang, Sungmin; Kim, Taek Hyeon; Kwak, Chee-Hun
Synthesis and crystal structure of (<i>E</i>)-2-benzyl-1,3-diphenylisothiouronium iodide
Acta Crystallographica Section E, 2022, 78, 51-53
2243944 CIF
HKL
Paper
C10 H12 Cl N O2P 21 21 216.8913; 7.6898; 19.7527
90; 90; 90
1046.75Belov, Feodor; Villinger, Alexander; von Langermann, Jan
(<i>R</i>)-Baclofen [(<i>R</i>)-4-amino-3-(4-chlorophenyl)butanoic acid]
Acta Crystallographica Section E, 2022, 78, 33-35
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
2243884 CIF
HKL
Paper
C18 H12 N2 O2P -19.266; 12.959; 13.101
96.2487; 109.181; 106.106
1392.39Singh, Neetu; Noh, Ga Hee; Park, Hyoung-Ryun; Lee, Junseong
Crystal structure, Hirshfeld surface and photophysical analysis of 2-nitro-3-phenyl-9<i>H</i>-carbazole
Acta Crystallographica Section E, 2021, 77
2243883 CIF
HKL
Paper
C16 H13 N3 O2 SP 14.71248; 6.96463; 11.5455
105.617; 95.7876; 95.9993
359.638Azzam, Rasha A.; Elgemeie, Galal H.; Seif, Mona M.; Jones, Peter G.
Crystal structure of <i>N</i>'-[2-(benzo[<i>d</i>]thiazol-2-yl)acetyl]benzohydrazide, an achiral compound crystallizing in space group <i>P</i>1 with <i>Z</i> = 1
Acta Crystallographica Section E, 2021, 77
2243882 CIF
HKL
Paper
C26 H23 Fe O P SP 1 21/c 17.3643; 17.909; 16.71
90; 95.23; 90
2194.7Bandyopadhyay, Uchchhal; Sundararaju, Basker; Poli, Rinaldo; Manoury, Eric; Daran, Jean-Claude
Synthesis and crystallographic studies of 2-(diphenylphosphinothioyl)-2-(3-oxobut-1-en-yl)ferrocene
Acta Crystallographica Section E, 2021, 77, 853-856
2243881 CIF
HKL
Paper
C44 H34 N8 O4 S2 ZnP 1 21/n 113.4029; 15.831; 19.6257
90; 107.841; 90
3964Tan, Ming Yueh; Kwong, Huey Chong; Crouse, Karen A.; Ravoof, Thahira B. S. A.; Tiekink, Edward R. T.
Bis{<i>N</i>'-[3-(4-nitrophenyl)-1-phenylprop-2-en-1-ylidene]-<i>N</i>-phenylcarbamimidothioato}zinc(II): crystal structure, Hirshfeld surface analysis and computational study
Acta Crystallographica Section E, 2021, 77, 839-846
2243880 CIF
HKL
Paper
C19 H16 N2 O4P 1 21/c 17.0111; 11.0123; 20.493
90; 96.202; 90
1573El Hafi, Mohamed; Lahmidi, Sanae; El Ghayati, Lhoussaine; Hökelek, Tuncer; Mague, Joel T.; Amer, Bushra; Sebbar, Nada Kheira; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis and interaction energy calculation of 4-(furan-2-yl)-2-(6-methyl-2,4-dioxopyran-3-ylidene)-2,3,4,5-tetrahydro-1<i>H</i>-1,5-benzodiazepine
Acta Crystallographica Section E, 2021, 77, 834-838
2243879 CIF
HKL
Paper
C20 H15 N O3P 1 21/n 18.2284; 13.7693; 13.923
90; 96.155; 90
1568.37Bouzian, Younos; Chkirate, Karim; Mague, Joel T.; Al-Ostoot, Fares Hezam; Hammou Ahabchane, Noureddine; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis and density functional theory study of benzyl 2-oxo-1-(prop-2-yn-1-yl)-1,2-dihydroquinoline-4-carboxylate
Acta Crystallographica Section E, 2021, 77, 824-828
2243878 CIF
HKL
Paper
C16 H12 F5 N3 OC 1 2/c 119.0048; 11.5216; 17.2227
90; 116.526; 90
3374.2Atioğlu, Zeliha; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Askerova, Ulviyya F.; Niyazova, Aytan A.; Mlowe, Sixberth
Crystal structure and Hirshfeld surface analysis of (2<i>Z</i>)-<i>N</i>,<i>N</i>-dimethyl-2-(pentafluorophenyl)-2-(2-phenylhydrazin-1-ylidene)acetamide
Acta Crystallographica Section E, 2021, 77, 829-833
2243877 CIF
HKL
C48 H49.34 Cu2 F6 Hf N8 O0.67P -18.5737; 10.7967; 13.0183
103.273; 103.662; 98.785
1112.08Wang, Yiran; Nisbet, Matthew L.; Poeppelmeier, Kenneth R.
Crystal structures of two copper(I)‒6,6'-dimethyl-2,2'-bipyridyl (dmbpy) compounds, [Cu(dmbpy)~2~]~2~[<i>M</i>F~6~]·<i>x</i>H~2~O (<i>M</i> = Zr, Hf; <i>x</i> = 1.134, 0.671)
Acta Crystallographica Section E, 2021, 77, 819-823
2243876 CIF
HKL
Paper
C48 H50.27 Cu2 F6 N8 O1.13 ZrP -18.6219; 10.8064; 12.9992
103.078; 104.013; 98.863
1116.33Wang, Yiran; Nisbet, Matthew L.; Poeppelmeier, Kenneth R.
Crystal structures of two copper(I)‒6,6'-dimethyl-2,2'-bipyridyl (dmbpy) compounds, [Cu(dmbpy)~2~]~2~[<i>M</i>F~6~]·<i>x</i>H~2~O (<i>M</i> = Zr, Hf; <i>x</i> = 1.134, 0.671)
Acta Crystallographica Section E, 2021, 77, 819-823
2243875 CIF
HKL
C26 H38 O5 SP 21 21 216.0146; 19.2817; 20.9887
90; 90; 90
2434.1Rousselin, Yoann; Yolka, Sylvie; Clavel, Alexandre
Crystal structures of two polymorphs of tixocortol pivalate
Acta Crystallographica Section E, 2021, 77, 809-813
2243874 CIF
HKL
C26 H38 O5 SP 21 21 216.4201; 17.6239; 20.8997
90; 90; 90
2364.74Rousselin, Yoann; Yolka, Sylvie; Clavel, Alexandre
Crystal structures of two polymorphs of tixocortol pivalate
Acta Crystallographica Section E, 2021, 77, 809-813
2243873 CIF
HKL
Paper
C22 H14 Cl4 N4P 1 21/c 116.0289; 13.1213; 11.1286
90; 108.073; 90
2225.1Shikhaliyev, Namiq Q.; Atioğlu, Zeliha; Akkurt, Mehmet; Ahmadova, Nigar E.; Askerov, Rizvan K.; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of 1,3-bis{2,2-dichloro-1-[(<i>E</i>)-phenyldiazenyl]ethenyl}benzene
Acta Crystallographica Section E, 2021, 77, 814-818
2243872 CIF
HKL
C28 H40 O7P 16.2374; 9.5938; 11.351
112.81; 96.49; 93.13
618.5Okmanov, R. Ya.; Makhmudova, M. M.; Bobaev, I. D.; Tashkhodjaev, B.
Withanolides from <i>Physalis angulata</i> L.
Acta Crystallographica Section E, 2021, 77, 804-808
2243871 CIF
HKL
C29 H39 Cl3 O7P 1 21 17.3633; 15.952; 12.657
90; 94.14; 90
1482.8Okmanov, R. Ya.; Makhmudova, M. M.; Bobaev, I. D.; Tashkhodjaev, B.
Withanolides from <i>Physalis angulata</i> L.
Acta Crystallographica Section E, 2021, 77, 804-808
2243870 CIF
HKL
Paper
C14 H11 N O2P 1 21/c 128.29; 3.9052; 20.264
90; 105.817; 90
2154Thiruvalluvar, Aravazhi Amalan; Sridharan, M.; Rajendra Prasad, K. J.; Zeller, M.
Synthesis and crystal structure of 1-hydroxy-8-methyl-9<i>H</i>-carbazole-2-carbaldehyde
Acta Crystallographica Section E, 2021, 77
2243869 CIF
HKL
Paper
C17 H19 N3 O SP -18.0605; 9.5635; 11.4397
70.578; 82.671; 68.723
774.95Tan, Ming Yueh; Kwong, Huey Chong; Crouse, Karen A.; Ravoof, Thahira B. S. A.; Tiekink, Edward R. T.
1-{(<i>E</i>)-[4-(4-Hydroxyphenyl)butan-2-ylidene]amino}-3-phenylthiourea: crystal structure, Hirshfeld surface analysis and computational study
Acta Crystallographica Section E, 2021, 77, 788-794
2243868 CIF
HKL
Paper
C15 H21 N O3P 1 21/c 118.4574; 5.702; 14.8058
90; 113.468; 90
1429.33Martens, Viktor; Görls, Helmar; Imhof, Wolfgang
Crystal structure of 2-oxo-2-phenylethyl diisopropylcarbamate
Acta Crystallographica Section E, 2021, 77, 785-787
2243867 CIF
HKL
Paper
C32 H84 Ca2 N12 O20 P4P 1 21/n 110.6249; 15.5774; 17.0925
90; 96.707; 90
2809.6Micallef, Duncan; Baisch, Ulrich
Di-μ-nitrato-bis(μ-octaethyl pyrophosphoramide)bis[aquadinitratocalcium(II)]
Acta Crystallographica Section E, 2021, 77, 795-798
2243866 CIF
HKL
Paper
C24 H16 Cl12 N2 O4P 1 21/c 18.9549; 10.5908; 16.6043
90; 103.499; 90
1531.24Alikhanova, Aygun I.; Atioğlu, Zeliha; Akkurt, Mehmet; Mlowe, Sixberth
Crystal structure and Hirshfeld surface analysis of (3a<i>R</i>,4<i>S</i>,7<i>S</i>,7a<i>S</i>)-4,5,6,7,8,8-hexachloro-2-{6-[(3a<i>R</i>,4<i>R</i>,7<i>R</i>,7a<i>S</i>)-4,5,6,7,8,8-hexachloro-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2<i>H</i>-4,7-methanoisoindol-2-yl]hexyl}-3a,4,7,7a-tetrahydro-1<i>H</i>-4,7-methanoisoindole-1,3(2<i>H</i>)-dione
Acta Crystallographica Section E, 2021, 77, 775-779
2243865 CIF
HKL
Paper
C15 H13 Cl2 N3 O3 SP -16.7234; 10.281; 13.611
74.98; 87.11; 75.34
879Purandara, H.; Foro, Sabine; Thimme Gowda, B.
Crystal structures of three <i>N</i>-acylhydrazone isomers
Acta Crystallographica Section E, 2021, 77, 780-784
2243864 CIF
HKL
Paper
C15 H13 Cl2 N3 O3 SP -19.491; 9.976; 10.446
67.22; 66.8; 86.32
833.59Purandara, H.; Foro, Sabine; Thimme Gowda, B.
Crystal structures of three <i>N</i>-acylhydrazone isomers
Acta Crystallographica Section E, 2021, 77, 780-784
2243863 CIF
HKL
Paper
C15 H13 Cl2 N3 O3 SP -17.7426; 10.429; 10.934
85.51; 76.92; 81.04
848.64Purandara, H.; Foro, Sabine; Thimme Gowda, B.
Crystal structures of three <i>N</i>-acylhydrazone isomers
Acta Crystallographica Section E, 2021, 77, 780-784
2243862 CIF
HKL
Paper
C22 H28 N O6 S3P -110.6886; 11.4878; 11.8389
76.007; 65.584; 63.213
1178.87Sribala, R.; Srinivasan, N.; Rajalaksmi, P.; Indumathi, S.; Krishnakumar, R.V.
Crystal structure and Hirshfeld surface analysis of a pyrrolo-thiazine complex
Acta Crystallographica Section E, 2021, 77, 770-774
2243861 CIF
HKL
Paper
C73 H126 Br8 N28 O4 P8 Re2 Ru4P 1 21/c 112.6027; 17.7075; 23.0252
90; 101.914; 90
5027.7Pacheco, Mario; Alvarez, Natalia; Cuevas, Alicia; Romerosa, Antonio; Lloret, Francesc; Kremer, Carlos
Crystal structure and magnetic study of the complex salt [RuCp(PTA)~2~‒μ-CN-1κ<i>C</i>:2κ<i>N</i>‒RuCp(PTA)~2~][Re(NO)Br~4~(EtOH)~0.5~(MeOH)~0.5~]
Acta Crystallographica Section E, 2021, 77, 749-754
2243860 CIF
HKL
Paper
C14 H12.448 N4 O7.224C 1 2/c 124.2097; 12.6311; 10.4022
90; 113.133; 90
2925.2Atioğlu, Zeliha; Akkurt, Mehmet; Mammadova, Gunay Z.; Huseynov, Fatali E.; Hajiyeva, Sevinj R.; Shamilov, Nazim T.; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of dimethyl 5-[2-(2,4,6-trioxo-1,3-diazinan-5-ylidene)hydrazin-1-yl]benzene-1,3-dicarboxylate 0.224-hydrate
Acta Crystallographica Section E, 2021, 77, 759-764
2243859 CIF
HKL
Paper
C15 H12 N2 O2P 21 21 216.569; 12.7956; 14.1278
90; 90; 90
1187.5Ali, Arif; Muslim, Mohd; Kamaal, Saima; Ahmed, Adeeba; Ahmad, Musheer; Shahid, M.; Khan, Jamal A.; Dege, Necmi; Javed, Saleem; Mashrai, Ashraf
Crystal structure, Hirshfeld and electronic transition analysis of 2-[(1<i>H</i>-benzimidazol-1-yl)methyl]benzoic acid
Acta Crystallographica Section E, 2021, 77, 755-758
2243858 CIF
HKL
Paper
C12 H16 Cl4 Cu N2I 1 2/c 115.2354; 8.3683; 12.8372
90; 99.205; 90
1615.59Mehmood, Tahir; Bhosale, Rajesh S.; Reddy, J. Prakasha
Bis(2-methylpyridinium) tetrachloridocuprate(II): synthesis, structure and Hirshfeld surface analysis
Acta Crystallographica Section E, 2021, 77, 726-729
2243857 CIF
HKL
Paper
C21 H20 N2 O3 SP 1 21/n 110.7365; 9.759; 18.56
90; 90.066; 90
1944.67Al-Waleedy, Safiyyah A. H.; Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Abbady, Mohamed S.; Bakhite, Etify A.
Crystal structure and Hirshfeld surface analysis of ethyl 2-({5-acetyl-3-cyano-6-methyl-4-[(<i>E</i>)-2-phenylethenyl]pyridin-2-yl}sulfanyl)acetate
Acta Crystallographica Section E, 2021, 77, 730-733
2243856 CIF
HKL
Paper
C8 H16 Br2 Cu2 S2P -16.8076; 9.7078; 10.1579
75.804; 89.845; 89.594
650.79Knorr, Michael; Viau, Lydie; Rousselin, Yoann; Kubicki, Marek M.
Crystal structure of the two-dimensional coordination polymer poly[di-μ-bromido-bis(μ-tetrahydrothiophene)dicopper(I)]
Acta Crystallographica Section E, 2021, 77, 744-748
2243855 CIF
HKL
Paper
C17 H14 Cl N3 O4P -18.0218; 10.2278; 10.6714
98.8503; 108.005; 96.3852
810.92Naghiyev, Farid N.; Grishina, Maria M.; Khrustalev, Victor N.; Akkurt, Mehmet; Huseynova, Afet T.; Akobirshoeva, Anzurat A.; Mamedov, İbrahim G.
Crystal structure and Hirshfeld surface analysis of ethyl 6'-amino-2'-(chloromethyl)-5'-cyano-2-oxo-1,2-dihydrospiro[indoline-3,4'-pyran]-3'-carboxylate
Acta Crystallographica Section E, 2021, 77, 739-743
2243854 CIF
HKL
Paper
C11 H8 Co N6 O4P 1 21/c 113.3368; 6.8727; 13.6015
90; 103.478; 90
1212.38Zhao, Chen; Li, Yi; Xiao, Jin-Sheng; Zhang, Peng-Dan; Wu, Xue-Qian; Chen, Qiang
Synthesis and crystal structure of poly[(3-amino-1,2,4-triazole)(μ~3~-1<i>H</i>-benzimidazole-5,6-dicarboxylato)cobalt(II)]
Acta Crystallographica Section E, 2021, 77, 714-717
2243853 CIF
HKL
Paper
C13 H27 N O6 SrP 1 21/c 18.1516; 19.1921; 11.4288
90; 99.295; 90
1764.52Seiss, Maximilian; Schmitz, Sebastian; Börner, Martin; Monakhov, Kirill Yu.
Synthesis and crystal structure of a one-dimensional chain-like strontium(II) coordination polymer built of <i>N</i>-methyldiethanolamine and isobutyrate ligands
Acta Crystallographica Section E, 2021, 77, 703-707
2243852 CIF
HKL
Paper
C63 H80 Cu6 N8 O21P -113.6406; 14.0568; 18.5907
83.626; 86.186; 72.288
3372.7Kébé, Momath; Thiam, Ibrahima Elhadji; Sow, Mouhamadou Moustapha; Diouf, Ousmane; Barry, Aliou Hamady; Sall, Abdou Salam; Retailleau, Pascal; Gaye, Mohamed
Hexanuclear copper(II) complex of 2-hydroxy-<i>N</i>,<i>N</i>'-bis[1-(2-hydroxyphenyl)ethylidene]propane-1,3-diamine incorporating an open-cubane core
Acta Crystallographica Section E, 2021, 77, 708-713
2243851 CIF
HKL
Paper
C H5 I3 N2P -16.0767; 6.1886; 11.727
97.512; 100.345; 99.437
422.1Ordinartsev, Artem A.; Petrov, Andrey A.; Lyssenko, Konstantin A.; Petrov, Andrey V.; Goodilin, Eugene A.; Tarasov, Alexey B.
Crystal structure of new formamidinium triiodide jointly refined by single-crystal XRD, Raman scattering spectroscopy and DFT assessment of hydrogen-bond network features
Acta Crystallographica Section E, 2021, 77, 692-695
2243850 CIF
HKL
Paper
C18 H26 Cl6 N2 O4 SnP 1 21/n 16.9762; 22.806; 8.0394
90; 90.948; 90
1278.9Ndiolene, Adrienne; Diop, Tidiane; Boye, Mouhamadou Sembène; Diasse-Sarr, Aminata; Englert, Ulli
A new organic‒inorganic compound, ethylenediammonium hexachloridostannate(IV) <i>p</i>-anisaldehyde disolvate
Acta Crystallographica Section E, 2021, 77, 696-699
2243849 CIF
HKL
Paper
C14 H6 F4 O2P b c n7.0588; 7.4008; 21.5265
90; 90; 90
1124.56Brown, Loren C.; Balaich, Gary J.
Crystal structure of 1,2-bis(3,5-difluorophenyl)ethane-1,2-dione
Acta Crystallographica Section E, 2021, 77, 700-702
2243848 CIF
HKL
Paper
C21 H19 Cl N4 O2P 1 21/n 111.1095; 9.5126; 18.6747
90; 95.079; 90
1965.8Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Manju, Nagaraja; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher
The crystal structures of three disordered 2-substituted benzimidazole esters
Acta Crystallographica Section E, 2021, 77, 473-479
2243847 CIF
HKL
Paper
C29 H24 N2 O2P 1 21/c 118.467; 8.686; 14.242
90; 95.359; 90
2274.5Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Manju, Nagaraja; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher
The crystal structures of three disordered 2-substituted benzimidazole esters
Acta Crystallographica Section E, 2021, 77, 473-479
2243846 CIF
HKL
Paper
C20 H18 N2 O3C 1 2/c 117.947; 4.5907; 41.305
90; 91.016; 90
3402.6Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Manju, Nagaraja; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher
The crystal structures of three disordered 2-substituted benzimidazole esters
Acta Crystallographica Section E, 2021, 77, 473-479
2243845 CIF
HKL
Paper
C34 H58 O2P 1 21 112.0622; 9.2715; 13.814
90; 92.306; 90
1543.63Akduran, Nurcan; Karakurt, Tuncay; Hökelek, Tuncer
Crystal structure, Hirshfeld surface analysis, interaction energy, and DFT studies of cholesteryl heptanoate
Acta Crystallographica Section E, 2021, 77, 686-691
2243844 CIF
HKL
Paper
C22 H48 Br2 Cu N4 O2P -18.08; 10.38; 17.511
97.02; 92.91; 111.31
1350.8Moon, Dohyun; Jeon, Sunghwan; Lim, Woo Taik; Ryoo, Keon Sang; Choi, Jong-Ha
Crystal structure of diaqua(3,14-diethyl-2,6,13,17-tetraazatricyclo[16.4.0.0^7,12^]docosane)copper(II) (3,14-diethyl-2,6,13,17-tetraazatricyclo[16.4.0.0^7,12^]docosane)copper(II) tetrabromide dihydrate, [Cu(C~22~H~44~N~4~)(H~2~O)~2~][Cu(C~22~H~44~N~4~)]Br~4~·2H~2~O
Acta Crystallographica Section E, 2021, 77, 677-680
2243843 CIF
HKL
Paper
C32 H36 Cu8 F36 O8P 1 21/n 110.3302; 19.5926; 13.1516
90; 101.004; 90
2612.88Purdy, Andrew P.; Butcher, Ray J.
Tetrakis[μ~2~-1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-olato]tetrakis(μ~3~-2-methylpropan-2-olato)octacopper(I)
Acta Crystallographica Section E, 2021, 77, 668-671
2243842 CIF
HKL
Paper
C20 H23 N O2P 21 21 216.1313; 7.371; 38.1143
90; 90; 90
1722.53Miyamoto, Hisakazu; Takahashi, Hiroki
Crystal structure and photoreactive behaviour of <i>N</i>,<i>N</i>-diisopropyl(<i>p</i>-phenylphenyl)glyoxylamide
Acta Crystallographica Section E, 2021, 77, 653-657
2243841 CIF
HKL
Paper
C16 H11 Cl N2 O2C 1 c 132.83; 4.4049; 18.844
90; 90.13; 90
2725.1Bougueria, Hassiba; Chetioui, Souheyla; Bensegueni, Mohammed Abdellatif; Djukic, Jean-Pierre; Benarous, Nesrine
Crystal structure and Hirshfeld surface analysis of 1-[(<i>E</i>)-2-(5-chloro-2-hydroxyphenyl)hydrazin-1-ylidene]naphthalen-2(1<i>H</i>)-one
Acta Crystallographica Section E, 2021, 77, 672-676
2243840 CIF
HKL
Paper
C29 H29 N3 O4 SP 1 21/n 18.4506; 23.112; 13.601
90; 99.021; 90
2623.6Sayed, Eman M.; Hassanien, Reda; Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Farhan, Nasser; Bakhite, Etify A.; Al-Waleedy, Safiyyah A. H.
Crystal structure and Hirshfeld surface analysis of 2-{[7-acetyl-4-cyano-6-hydroxy-8-(4-methoxyphenyl)-1,6-dimethyl-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}-<i>N</i>-phenylacetamide
Acta Crystallographica Section E, 2021, 77, 663-667
2243839 CIF
HKL
Paper
C22 H18 N2 O2P 1 21/c 17.4089; 11.4544; 21.9491
90; 97.814; 90
1845.4Kansiz, Sevgi; Tatlidil, Digdem; Dege, Necmi; Aktas, Feyzi Alkim; Al-Asbahy, Samir Osman Mohammed; Alaman Agar, Aysen
Crystal structure and molecular docking study of (<i>E</i>)-2-{[(<i>E</i>)-2-hydroxy-5-methylbenzylidene]hydrazinylidene}-1,2-diphenylethan-1-one
Acta Crystallographica Section E, 2021, 77, 658-662
2243838 CIF
HKL
Paper
C18 H16 N2 O3P -15.3518; 11.6989; 13.3527
64.019; 80.323; 76.952
729.83Abad, Nadeem; El Ghayati, Lhoussaine; Kalonji Mubengayi, Camille; Essassi, El Mokhtar; Kaya, Savaş; Mague, Joel T.; Ramli, Youssef
Crystal structure and Hirshfeld surface analysis of 2-(2-oxo-3-phenyl-1,2,3,8a-tetrahydroquinoxalin-1-yl)ethyl acetate
Acta Crystallographica Section E, 2021, 77, 643-646
2243837 CIF
HKL
Paper
C9 H22 Al2 Br4 O2C 1 2/c 18.3872; 12.1039; 18.1504
90; 95.646; 90
1833.7Butcher, Ray J.; Purdy, Andrew P.
μ-Methylene-bis[dibromido(diethyl ether-κ<i>O</i>)aluminium(III)]: crystal structure and chemical exchange in solution
Acta Crystallographica Section E, 2021, 77, 647-652
2243836 CIF
HKL
Paper
C24 H30 Cl4 N4 ZnP 1 21/n 19.291; 15.682; 17.275
90; 95.642; 90
2504.8Tojiboev, Akmaljon; Okmanov, Rasul; Englert, Ulli; Wang, Ruimin; Pan, Fangfang; Turgunov, Kambarali; Tashkhodjaev, Bakhodir
Crystal structure and Hirshfeld surface analysis of bis(6,7,8,9-tetrahydro-11<i>H</i>-pyrido[2,1-<i>b</i>]quinazolin-5-ium) tetrachloridozincate
Acta Crystallographica Section E, 2021, 77, 629-633
2243835 CIF
HKL
C19 H22 N2 OP b c a9.3802; 9.4076; 37.235
90; 90; 90
3285.8Smirnov, Daniil E.; Tatarin, Sergei V.; Bezzubov, Stanislav I.
Synthesis and crystal structures of <i>N</i>-H, <i>N</i>-phenyl and <i>N</i>-benzyl-2-(4-hexyloxyphenyl)benzimidazoles
Acta Crystallographica Section E, 2021, 77, 618-622
2243834 CIF
HKL
C25 H26 N2 OP 1 21/n 19.0089; 16.6539; 13.84
90; 101.419; 90
2035.36Smirnov, Daniil E.; Tatarin, Sergei V.; Bezzubov, Stanislav I.
Synthesis and crystal structures of <i>N</i>-H, <i>N</i>-phenyl and <i>N</i>-benzyl-2-(4-hexyloxyphenyl)benzimidazoles
Acta Crystallographica Section E, 2021, 77, 618-622
2243833 CIF
HKL
Paper
C26 H28 N2 OP 1 21/n 114.3057; 9.6392; 16.3024
90; 108.977; 90
2125.8Smirnov, Daniil E.; Tatarin, Sergei V.; Bezzubov, Stanislav I.
Synthesis and crystal structures of <i>N</i>-H, <i>N</i>-phenyl and <i>N</i>-benzyl-2-(4-hexyloxyphenyl)benzimidazoles
Acta Crystallographica Section E, 2021, 77, 618-622
2243832 CIF
HKL
Paper
C6 H5 N O4A e m 210.2045; 6.1282; 9.7293
90; 90; 90
608.42Behrman, Edward J.; Parkin, Sean
Synthesis and crystal structures of 3,6-dihydroxypicolinic acid and its labile intermediate dipotassium 3-hydroxy-6-(sulfonatooxy)pyridine-2-carboxylate monohydrate
Acta Crystallographica Section E, 2021, 77, 623-628
2243831 CIF
HKL
Paper
C6 H5 K2 N O8 SP 1 21/c 113.3366; 11.5467; 7.3078
90; 103.553; 90
1094.02Behrman, Edward J.; Parkin, Sean
Synthesis and crystal structures of 3,6-dihydroxypicolinic acid and its labile intermediate dipotassium 3-hydroxy-6-(sulfonatooxy)pyridine-2-carboxylate monohydrate
Acta Crystallographica Section E, 2021, 77, 623-628
2243830 CIF
HKL
Paper
Ba5 I2 O12P n m a19.7568; 5.9003; 10.5869
90; 90; 90
1234.13Bi, David Wenhua; Baral, Priya Ranjan; Magrez, Arnaud
Ba~5~(IO~6~)~2~: crystal structure evolution from room temperature to 80K
Acta Crystallographica Section E, 2021, 77, 634-637
2243829 CIF
HKL
Ba5 I2 O12P n m a19.7361; 5.8779; 10.5749
90; 90; 90
1226.76Bi, David Wenhua; Baral, Priya Ranjan; Magrez, Arnaud
Ba~5~(IO~6~)~2~: crystal structure evolution from room temperature to 80K
Acta Crystallographica Section E, 2021, 77, 634-637
2243828 CIF
HKL
Paper
C14 H17 N3 O5 SP 1 21/c 19.1398; 11.1525; 16.3795
90; 97.081; 90
1656.85Metwally, Nadia H.; Elgemeie, Galal H.; Jones, Peter G.
Crystal structure of ethyl 2-(3-amino-5-oxo-2-tosyl-2,5-dihydro-1<i>H</i>-pyrazol-1-yl)acetate
Acta Crystallographica Section E, 2021, 77, 615-617
2243827 CIF
HKL
Paper
C13 H16 N4 OP 1 21/c 17.1271; 8.9295; 19.2508
90; 94.683; 90
1221.06Al Ati, Gamal; Chkirate, Karim; Mague, Joel T.; Abad, Nadeem; Achour, Redouane; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis and DFT study of <i>N</i>-(2-amino-5-methylphenyl)-2-(5-methyl-1<i>H</i>-pyrazol-3-yl)acetamide
Acta Crystallographica Section E, 2021, 77, 638-642
2243826 CIF
HKL
Paper
C23 H21 N5 OP 1 21/n 18.5517; 18.781; 13.1925
90; 99.757; 90
2088.2Naghiyev, Farid N.; Mammadova, Gunay Z.; Khalilov, Ali N.; Atioğlu, Zeliha; Akkurt, Mehmet; Akobirshoeva, Anzurat A.; Mamedov, İbrahim G.
Crystal structure and Hirshfeld surface analysis of 5,7-diphenyl-1,2,3,5,6,7-hexahydroimidazo[1,2-<i>a</i>]pyridine-6,6,8-tricarbonitrile methanol monosolvate
Acta Crystallographica Section E, 2021, 77, 600-604
2243825 CIF
HKL
Paper
C13 H11 N O2P 1 c 15.5391; 5.7873; 16.0859
90; 99.067; 90
509.21Mohamed, Shaaban K.; Said, Awad I.; Mague, Joel T.; Aly, Moustafa F.; Akkurt, Mehmet; Elgarhy, Sahar M. I.
Crystal structure and Hirshfeld surface analysis of <i>N</i>-[(<i>Z</i>)-(2-hydroxyphenyl)methylidene]aniline <i>N</i>-oxide
Acta Crystallographica Section E, 2021, 77, 596-599
2243824 CIF
HKL
Paper
C30 H23 K O8 S2P -16.0036; 9.6432; 25.0966
92.412; 90.548; 105.808
1396.42Vu Quoc, Trung; Phan Thuy, Linh; Do Ba, Dai; Tran Thi Thuy, Duong; Nguyen Ngoc, Linh; Nguyen Thuy, Chinh; Duong Khanh, Linh; Ha Manh, Hung; Thai, Hoang; Le Van, Khoe; Van Meervelt, Luc
Crystal structure of potassium hydrogen bis((<i>E</i>)-2-{4-[3-(thiophen-3-yl)acryloyl]phenoxy}acetate)
Acta Crystallographica Section E, 2021, 77, 609-614
2243823 CIF
Paper
C19 H13 NC 1 2/c 16.0777; 20.9211; 10.2574
90; 102.476; 90
1273.45Zhao, Meng; Zhang, Gang; Zhang, Jingmiao; Huang, Shan; Liu, Xiuxia; Li, Fei
Crystal structure of 4-(anthracen-9-yl)pyridine
Acta Crystallographica Section E, 2021, 77, 605-608
2243822 CIF
HKL
Paper
C6 H16 B KP 21 21 217.4758; 7.6682; 14.801
90; 90; 90
848.48Fecker, Ann Christin; Freytag, Matthias; Walter, Marc D.; Jones, Peter G.
Crystal structure of potassium triethylhydridoborate (`superhydride')
Acta Crystallographica Section E, 2021, 77, 592-595
2243821 CIF
HKL
C30 H28 N5 O13 SmC 1 2 118.9105; 15.7993; 21.5738
90; 98.727; 90
6371Okumura, Yuta; Takiguchi, Yuji; Nakane, Daisuke; Akitsu, Takashiro
Crystal structure and Hirshfeld surface analysis of ((<i>S</i>,<i>S</i>)-2,2'-{[(1,2-diphenylethane-1,2-diyl)bis[(azaniumylylidene)methanylylidene]}bis(6-methoxyphenolato))trinitratosamarium(III)
Acta Crystallographica Section E, 2021, 77, 579-582
2243820 CIF
HKL
Paper
C22 H56 Cl2 Cu N4 O6P -18.022; 10.02; 10.354
81.36; 72.84; 69.71
744.8Moon, Dohyun; Choi, Jong-Ha
Crystal structure of diaqua(3,14-diethyl-2,6,13,17-tetraazatricyclo[16.4.0.0^7,12^]docosane)copper(II) dichloride tetrahydrate
Acta Crystallographica Section E, 2021, 77, 569-572
2243819 CIF
HKL
Paper
C9 H18 Mo O6 S3P -18.2027; 8.4059; 13.465
78.58; 75.69; 63.94
803.9Elvers, Benedict J.; Fischer, Christian; Schulzke, Carola
Molecular structure of <i>fac</i>-[Mo(CO)~3~(DMSO)~3~]
Acta Crystallographica Section E, 2021, 77, 583-587
2243818 CIF
HKL
Paper
As H O7 Te Zn2C 1 m 16.904; 7.7212; 5.726
90; 101.196; 90
299.43Eder, Felix; Weil, Matthias
Crystal structure of Zn~2~(HTeO~3~)(AsO~4~)
Acta Crystallographica Section E, 2021, 77, 555-558
2243817 CIF
HKL
Paper
C17 H26 N2 OP 1 21/c 117.3256; 5.5662; 16.7244
90; 97.433; 90
1599.31Ait Elmachkouri, Younesse; Saber, Asmaa; Irrou, Ezaddine; Amer, Bushra; Mague, Joel T.; Hökelek, Tuncer; Labd Taha, Mohamed; Sebbar, Nada Kheira; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis and interaction energy calculation of 1-decyl-2,3-dihydro-1<i>H</i>-benzimidazol-2-one
Acta Crystallographica Section E, 2021, 77, 559-563
2243816 CIF
HKL
Paper
C17 H13 N O3C 1 2/c 120.3883; 7.5925; 17.9858
90; 95.791; 90
2769.96Benouatas, Assia; Laroum, Rima; Hamdouni, Noudjoud; Zemamouche, Wissame; Debache, Abdelmadjid; Boudjada, Ali
Structural study and Hirshfeld surface analysis of (<i>Z</i>)-4-(2-methoxybenzylidene)-3-phenylisoxazol-5(4<i>H</i>)-one
Acta Crystallographica Section E, 2021, 77, 564-568
2243815 CIF
HKL
C23 H31 N3 O5 ZnP n a 2114.5937; 11.4425; 13.5794
90; 90; 90
2267.6Noor, Shabana; Suda, Shintaro; Haraguchi, Tomoyuki; Khatoon, Fehmeeda; Akitsu, Takashiro
Chiral crystallization of a zinc(II) complex
Acta Crystallographica Section E, 2021, 77, 542-546
2243814 CIF
HKL
Paper
C13 H12 N6 O SP 1 21/n 113.4774; 7.6797; 14.2755
90; 112.401; 90
1366.05Mohamed-Ezzat, Reham A.; Elgemeie, Galal H.; Jones, Peter G.
Crystal structures of (<i>E</i>)-2-amino-4-methylsulfanyl-6-oxo-1-(1-phenylethylideneamino)-1,6-dihydropyrimidine-5-carbonitrile and (<i>E</i>)-2-amino-4-methylsulfanyl-6-oxo-1-[1-(pyridin-2-yl)ethylideneamino]-1,6-dihydropyrimidine-5-carbonitrile
Acta Crystallographica Section E, 2021, 77, 547-550
2243813 CIF
HKL
Paper
C14 H13 N5 O SP 1 21/c 112.15369; 14.9466; 7.68691
90; 91.7607; 90
1395.72Mohamed-Ezzat, Reham A.; Elgemeie, Galal H.; Jones, Peter G.
Crystal structures of (<i>E</i>)-2-amino-4-methylsulfanyl-6-oxo-1-(1-phenylethylideneamino)-1,6-dihydropyrimidine-5-carbonitrile and (<i>E</i>)-2-amino-4-methylsulfanyl-6-oxo-1-[1-(pyridin-2-yl)ethylideneamino]-1,6-dihydropyrimidine-5-carbonitrile
Acta Crystallographica Section E, 2021, 77, 547-550
2243812 CIF
HKL
Paper
C20 H42 Cl2 N4 O8P 1 21/n 110.689; 8.445; 14.02
90; 92.9; 90
1263.9Moon, Dohyun; Jeon, Sunghwan; Choi, Jong-Ha
Crystal structure of 3,14-dimethyl-2,13-diaza-6,17-diazoniatricyclo[16.4.0.0^7,12^]docosane bis(perchlorate) from synchrotron X-ray data
Acta Crystallographica Section E, 2021, 77, 551-554
2243811 CIF
HKL
Paper
C82 H105 Au3 F6 N O11 P3 S2P 1 21/n 124.0018; 12.4867; 28.4299
90; 103.767; 90
8275.76Hartgerink, Colin T.; Staples, Richard J.; Anderson, Carolyn E.
Crystal structure of tris(2-dicyclohexylphosphino-2',6'-dimethoxy-1,1'-biphenyl-κ<i>P</i>)-μ-oxoethenylidene-<i>triangulo</i>-trigold(I) bis(trifluoromethanesulfonyl)imide
Acta Crystallographica Section E, 2021, 77, 537-541
2243810 CIF
HKL
Paper
C15 H15 Br2 N O3P 1 21/c 112.0238; 6.4316; 19.463
90; 96.618; 90
1495.1Mertsalov, Dmitriy F.; Surina, Nataliya S.; Sorokina, Elena A.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Grigoriev, Mikhail S.; Mlowe, Sixberth
Crystal structure and Hirshfeld surface analysis of 4,5-dibromo-2-(4-methoxyphenyl)-2,3,4,4a,5,6,7,7a-octahydro-1<i>H</i>-4,6-epoxy-1<i>H</i>-cyclopenta[<i>c</i>]pyridin-1-one
Acta Crystallographica Section E, 2021, 77, 532-536
2243809 CIF
HKL
Paper
C28 H25 Cl2 N3 O3 SP 1 21/c 118.2076; 14.2859; 10.2713
90; 98.245; 90
2644.1Akkurt, Mehmet; Marae, Islam S.; Mague, Joel T.; Mohamed, Shaaban K.; Bakhite, Etify A.; Al-Waleedy, Safiyyah A. H.
Crystal structure and Hirshfeld surface analysis of 2-{[7-acetyl-8-(4-chlorophenyl)-4-cyano-6-hydroxy-1,6-dimethyl-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}-<i>N</i>-(4-chlorophenyl)acetamide
Acta Crystallographica Section E, 2021, 77, 527-531
2243808 CIF
HKL
C19 H28 N2 O3P -19.2956; 9.4443; 12.7427
78.552; 75.929; 60.806
943.06Pham, Duyen N. K.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
5-Methoxy-<i>N</i>,<i>N</i>-di-<i>n</i>-propyltryptamine (5-MeO-DPT): freebase and fumarate
Acta Crystallographica Section E, 2021, 77, 522-526
2243807 CIF
HKL
Paper
C17 H26 N2 OP 1 21/n 16.2223; 13.0931; 19.7791
90; 91.825; 90
1610.57Pham, Duyen N. K.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
5-Methoxy-<i>N</i>,<i>N</i>-di-<i>n</i>-propyltryptamine (5-MeO-DPT): freebase and fumarate
Acta Crystallographica Section E, 2021, 77, 522-526
2243806 CIF
HKL
Paper
C15 H13 N3 O3 SC 1 2/c 118.72; 11.5255; 14.7905
90; 115.52; 90
2879.8Mahesha, Ninganayaka; Yathirajan, Hemmige S.; Nagma Banu, Holalagudu A.; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher
Different patterns of supramolecular aggregation in three amides containing <i>N</i>-(benzo[<i>d</i>]thiazolyl) substituents
Acta Crystallographica Section E, 2021, 77, 504-511
2243805 CIF
HKL
Paper
C15 H11 N3 O4 SP n a 2120.085; 20.165; 7.322
90; 90; 90
2965.5Mahesha, Ninganayaka; Yathirajan, Hemmige S.; Nagma Banu, Holalagudu A.; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher
Different patterns of supramolecular aggregation in three amides containing <i>N</i>-(benzo[<i>d</i>]thiazolyl) substituents
Acta Crystallographica Section E, 2021, 77, 504-511
2243804 CIF
HKL
Paper
C14 H9 Br N2 O SP 1 21/c 124.221; 4.9481; 10.9981
90; 95.371; 90
1312.31Mahesha, Ninganayaka; Yathirajan, Hemmige S.; Nagma Banu, Holalagudu A.; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher
Different patterns of supramolecular aggregation in three amides containing <i>N</i>-(benzo[<i>d</i>]thiazolyl) substituents
Acta Crystallographica Section E, 2021, 77, 504-511
2243803 CIF
HKL
C20 H26 K2 N2 O8 S4C 1 2/c 127.908; 8.2916; 11.3035
90; 94.753; 90
2606.7Pacifico, Jessica; Stoeckli-Evans, Helen
A new tetrakis-substituted pyrazine carboxylic acid, 3,3',3'',3'''-{[pyrazine-2,3,5,6-tetrayltetrakis(methylene)]tetrakis(sulfanediyl)}tetrapropionic acid: crystal structures of two triclinic polymorphs and of two potassium‒organic frameworks
Acta Crystallographica Section E, 2021, 77, 480-490
2243802 CIF
HKL
C20 H27 K N2 O8 S4C 1 2/c 130.08; 8.4716; 9.5908
90; 94.717; 90
2435.7Pacifico, Jessica; Stoeckli-Evans, Helen
A new tetrakis-substituted pyrazine carboxylic acid, 3,3',3'',3'''-{[pyrazine-2,3,5,6-tetrayltetrakis(methylene)]tetrakis(sulfanediyl)}tetrapropionic acid: crystal structures of two triclinic polymorphs and of two potassium‒organic frameworks
Acta Crystallographica Section E, 2021, 77, 480-490
2243801 CIF
HKL
C20 H28 N2 O8 S4P -14.9424; 8.993; 14.19
96.96; 97.14; 100.72
608.1Pacifico, Jessica; Stoeckli-Evans, Helen
A new tetrakis-substituted pyrazine carboxylic acid, 3,3',3'',3'''-{[pyrazine-2,3,5,6-tetrayltetrakis(methylene)]tetrakis(sulfanediyl)}tetrapropionic acid: crystal structures of two triclinic polymorphs and of two potassium‒organic frameworks
Acta Crystallographica Section E, 2021, 77, 480-490
2243800 CIF
HKL
C20 H28 N2 O8 S4P -15.5843; 9.0061; 12.739
101.537; 94.313; 103.701
604.8Pacifico, Jessica; Stoeckli-Evans, Helen
A new tetrakis-substituted pyrazine carboxylic acid, 3,3',3'',3'''-{[pyrazine-2,3,5,6-tetrayltetrakis(methylene)]tetrakis(sulfanediyl)}tetrapropionic acid: crystal structures of two triclinic polymorphs and of two potassium‒organic frameworks
Acta Crystallographica Section E, 2021, 77, 480-490
2243799 CIF
HKL
Paper
C15 H12 Br2 F3 N O2P 1 21/c 16.6543; 18.9031; 25.1995
90; 97.132; 90
3145.24Mertsalov, Dmitriy F.; Alekseeva, Kseniia A.; Daria, Magrycheva S.; Cheshigin, Maxim E.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Grigoriev, Mikhail S.; Mlowe, Sixberth
(3a<i>S</i>,4<i>R</i>,5<i>R</i>,6<i>S</i>,7a<i>R</i>)-4,5-Dibromo-2-[4-(trifluoromethyl)phenyl]-2,3,3a,4,5,6,7,7a-octahydro-3a,6-epoxy-1<i>H</i>-isoindol-1-one: crystal structure and Hirshfeld surface analysis
Acta Crystallographica Section E, 2021, 77, 466-472
2243798 CIF
HKL
Paper
C16 H13 Cl2 N5C 1 c 18.6598; 16.0275; 11.659
90; 90.7364; 90
1618.08Naghiyev, Farid N.; Tereshina, Tatiana A.; Khrustalev, Victor N.; Akkurt, Mehmet; Rzayev, Rovnag M.; Akobirshoeva, Anzurat A.; Mamedov, İbrahim G.
Crystal structure and Hirshfeld surface analysis of 6-amino-8-(2,6-dichlorophenyl)-1,3,4,8-tetrahydro-2<i>H</i>-pyrido[1,2-<i>a</i>]pyrimidine-7,9-dicarbonitrile
Acta Crystallographica Section E, 2021, 77, 516-521
2243797 CIF
HKL
Paper
C16 H15 N5P 1 21/c 18.2521; 10.2774; 16.2102
90; 92.07; 90
1373.89Naghiyev, Farid N.; Tereshina, Tatiana A.; Khrustalev, Victor N.; Akkurt, Mehmet; Khalilov, Ali N.; Akobirshoeva, Anzurat A.; Mamedov, İbrahim G.
Crystal structure and Hirshfeld surface analysis of 6-amino-8-phenyl-1,3,4,8-tetrahydro-2<i>H</i>-pyrido[1,2-<i>a</i>]pyrimidine-7,9-dicarbonitrile
Acta Crystallographica Section E, 2021, 77, 512-515
2243796 CIF
HKL
Paper
C12 H16 Cl2 Cu N8P 1 21/n 18.8662; 13.3199; 13.919
90; 90.042; 90
1643.79Li, Ting Bin; Hu, Ya Li; Li, Ji Kun; He, Guo Fang
Chloridotetrakis(imidazole)copper(II) chloride. Corrigendum
Acta Crystallographica Section E, 2021, 77, 450-451
2243795 CIF
HKL
Paper
C14 H16 Co N6 S2P 1 21/n 18.2442; 11.9186; 8.9204
90; 100.807; 90
860.97Krebs, Christoph; Jess, Inke; Näther, Christian
Synthesis, crystal structure and thermal properties of poly[bis[μ~2~-3-(aminomethyl)pyridine]bis(thiocyanato)cobalt(II)]
Acta Crystallographica Section E, 2021, 77, 428-432
2243794 CIF
HKL
Paper
C36 H35 Br N2 O6C 1 2 115.7494; 13.3568; 17.8634
90; 106.5; 90
3603Zeller, Matthias; Bogdanowich-Knipp, Susan; Smith, Pamela; Purcell, Dale K.; Okezue, Mercy; Smith, Daniel T.; Byrn, Stephen R.; Clase, Kari L.
Maleate salts of bedaquiline
Acta Crystallographica Section E, 2021, 77, 433-445
2243793 CIF
HKL
Paper
C36 H35 Br N2 O6C 1 2 115.7494; 13.3568; 17.8634
90; 106.5; 90
3603Zeller, Matthias; Bogdanowich-Knipp, Susan; Smith, Pamela; Purcell, Dale K.; Okezue, Mercy; Smith, Daniel T.; Byrn, Stephen R.; Clase, Kari L.
Maleate salts of bedaquiline
Acta Crystallographica Section E, 2021, 77, 433-445
2243792 CIF
HKL
Paper
C81 H89 Br2 N4 O14C 1 2 116.0678; 13.644; 17.872
90; 107.635; 90
3733.9Zeller, Matthias; Bogdanowich-Knipp, Susan; Smith, Pamela; Purcell, Dale K.; Okezue, Mercy; Smith, Daniel T.; Byrn, Stephen R.; Clase, Kari L.
Maleate salts of bedaquiline
Acta Crystallographica Section E, 2021, 77, 433-445
2243791 CIF
HKL
Paper
C39.28 H41.57 Br N2 O7.64P 1 21 116.1525; 13.5353; 17.8572
90; 107.359; 90
3726.3Zeller, Matthias; Bogdanowich-Knipp, Susan; Smith, Pamela; Purcell, Dale K.; Okezue, Mercy; Smith, Daniel T.; Byrn, Stephen R.; Clase, Kari L.
Maleate salts of bedaquiline
Acta Crystallographica Section E, 2021, 77, 433-445
2243790 CIF
HKL
Paper
C84 H94 Br2 N4 O15C 1 2 116.4119; 13.5643; 17.8475
90; 107.318; 90
3793Zeller, Matthias; Bogdanowich-Knipp, Susan; Smith, Pamela; Purcell, Dale K.; Okezue, Mercy; Smith, Daniel T.; Byrn, Stephen R.; Clase, Kari L.
Maleate salts of bedaquiline
Acta Crystallographica Section E, 2021, 77, 433-445
2243789 CIF
HKL
Paper
C36 H35.96 Br N2 O6.48C 1 2 115.7469; 13.2627; 17.8602
90; 106.376; 90
3578.7Zeller, Matthias; Bogdanowich-Knipp, Susan; Smith, Pamela; Purcell, Dale K.; Okezue, Mercy; Smith, Daniel T.; Byrn, Stephen R.; Clase, Kari L.
Maleate salts of bedaquiline
Acta Crystallographica Section E, 2021, 77, 433-445
2243788 CIF
Paper
C6 H16 Cl4 Co N2C 1 2/c 17.6431; 11.9347; 14.0058
90; 95.519; 90
1271.66Landolsi, Meriem; Abid, Sonia
Crystal structure and Hirshfeld surface analysis of <i>trans</i>-2,5-dimethylpiperazine-1,4-diium tetrachloridocobaltate(II)
Acta Crystallographica Section E, 2021, 77, 424-427
2243787 CIF
HKL
Paper
C26 H24 Br N3 SC 1 c 114.5474; 17.8777; 9.0803
90; 108.773; 90
2235.92Mohamed, Shaaban K.; Elgarhy, Sahar M. I.; Hassan, Alaa A.; Demirtaş, Güneş; Mague, Joel. T.; Ramli, Youssef
Crystal structure of (<i>E</i>)-1-(3-benzyl-5-phenyl-1,3-thiazol-2-ylidene)-2-[(<i>E</i>)-1,2,3,4-tetrahydronaphthalen-1-ylidene]hydrazin-1-ium bromide
Acta Crystallographica Section E, 2021, 77, 420-423
2243786 CIF
HKL
Paper
C19 H24 N2 O3P -17.8791; 9.2908; 13.5352
108.081; 104.365; 95.903
894.87Pham, Duyen N. K.; Sammeta, Vamshikrishna Reddy; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
`Foxtrot' fumarate: a water-soluble salt of <i>N</i>,<i>N</i>-diallyl-5-methoxytryptamine (5-MeO-DALT)
Acta Crystallographica Section E, 2021, 77, 416-419
2243785 CIF
HKL
Paper
C20 H24 Cu N4 O8C 1 2/c 112.7286; 7.4918; 22.8967
90; 98.395; 90
2160.04Kansiz, Sevgi; Qadir, Adnan M.; Dege, Necmi; Yongxin, Li; Saif, Eiad
Crystal structure and Hirshfeld surface analysis of a copper(II) complex containing 2-nitrobenzoate and tetramethylethylenediamine ligands
Acta Crystallographica Section E, 2021, 77, 412-415
2243784 CIF
HKL
Paper
C20 H20 Cl N2 Na O8 S2P -15.7347; 10.9336; 18.4692
104.844; 97.478; 95.404
1100Tapmeyer, Lukas; Eisenbeil, Daniel; Bolte, Michael; Schmidt, Martin U.
First crystal structure of a Pigment Red 52 compound: DMSO solvate hydrate of the monosodium salt
Acta Crystallographica Section E, 2021, 77, 402-405
2243783 CIF
HKL
Paper
C13 H13 N3 OP b c a9.6545; 11.2437; 22.9108
90; 90; 90
2487Idrissi, Ahlam; Chkirate, Karim; Abad, Nadeem; Djerrari, Bahia; Achour, Redouane; Essassi, El Mokhtar; Van Meervelt, Luc
Crystal structure, Hirshfeld surface analysis and density functional theory study of 6-methyl-2-[(5-methylisoxazol-3-yl)methyl]-1<i>H</i>-benzimidazole
Acta Crystallographica Section E, 2021, 77, 396-401
2243782 CIF
HKL
Paper
C24 H43 B Si3 UP -18.753; 12.217; 13.657
94.159; 96.016; 103.256
1406.6Windorff, Cory J.; Cross, Justin N.; Scott, Brian L.; Kozimor, Stosh A.; Evans, William J.
Crystallographic characterization of (C~5~H~4~SiMe~3~)~3~U(BH~4~)
Acta Crystallographica Section E, 2021, 77, 383-389
2243781 CIF
HKL
Paper
C9 H7 N O2 SP 1 21/c 110.466; 12.1614; 14.7636
90; 110.362; 90
1761.71Laroum, Rima; Benouatas, Assia; Hamdouni, Noudjoud; Zemamouche, Wissame; Boudjada, Ali; Debache, Abdelmadjid
Crystal structure and Hirshfeld surface analysis of (<i>Z</i>)-3-methyl-4-(thiophen-2-ylmethylidene)isoxazol-5(4<i>H</i>)-one
Acta Crystallographica Section E, 2021, 77, 378-382
2243780 CIF
HKL
C26 H29 N3 OP -17.9142; 10.9051; 12.8896
87.271; 79.29; 82.206
1082.7Ullah, Nisar; Stoeckli-Evans, Helen
The crystal structures, Hirshfeld surface analyses and energy frameworks of 8-{1-[3-(cyclopent-1-en-1-yl)benzyl]piperidin-4-yl}-2-methoxyquinoline and 8-{4-[3-(cyclopent-1-en-1-yl)benzyl]piperazin-1-yl}-2-methoxyquinoline
Acta Crystallographica Section E, 2021, 77, 372-377
2243779 CIF
HKL
C27 H30 N2 OP -17.7099; 11.2838; 12.9539
89.413; 79.094; 82.27
1096.41Ullah, Nisar; Stoeckli-Evans, Helen
The crystal structures, Hirshfeld surface analyses and energy frameworks of 8-{1-[3-(cyclopent-1-en-1-yl)benzyl]piperidin-4-yl}-2-methoxyquinoline and 8-{4-[3-(cyclopent-1-en-1-yl)benzyl]piperazin-1-yl}-2-methoxyquinoline
Acta Crystallographica Section E, 2021, 77, 372-377
2243778 CIF
HKL
Paper
C100 H88.32 N8 O12.16 S4P 1 21/c 112.049; 20.223; 9.1743
90; 100.91; 90
2195.1Naghiyev, Farid N.; Khrustalev, Victor N.; Akkurt, Mehmet; Huseynov, Elnur Z.; Khalilov, Ali N.; Akobirshoeva, Anzurat A.; Mamedov, İbrahim G.
Crystal structure and Hirshfeld surface analysis of 3-cyano-4-hydroxy-2-(4-methylphenyl)-6-oxo-<i>N</i>-phenyl-4-(thiophen-2-yl)cyclohexane-1-carboxamide 0.04-hydrate
Acta Crystallographica Section E, 2021, 77, 366-371
2243777 CIF
HKL
Paper
C33 H26 N4 O4P -111.5014; 11.534; 11.7878
73.567; 74.613; 64.218
1332.1Mohamed, Shaaban K.; Said, Awad I.; Mague, Joel T.; El-Emary, Talaat I.; Akkurt, Mehmet; Elgarhy, Sahar M. I.
Crystal structure and Hirshfeld surface analysis of (3<i>S</i>,3a<i>R</i>,6a<i>S</i>)-3-(1,3-diphenyl-1<i>H</i>-pyrazol-4-yl)-5-(4-methoxyphenyl)-2-phenyl-3,3a,4,5,6,6a-hexahydro-2<i>H</i>-pyrrolo[3,4-<i>d</i>][1,2]oxazole-4,6-dione
Acta Crystallographica Section E, 2021, 77, 356-359
2243776 CIF
HKL
C19 H23 Br N2 O5 SP 1 21/c 17.7375; 15.9728; 16.7621
90; 93.055; 90
2068.68Kingsbury, Christopher J.; Sample, Harry C.; Senge, Mathias O.
Crystal structures of 4-bromo-2-formyl-1-tosyl-1<i>H</i>-pyrrole, (<i>E</i>)-4-bromo-2-(2-nitrovinyl)-1-tosyl-1<i>H</i>-pyrrole and 6-(4-bromo-1-tosylpyrrol-2-yl)-4,4-dimethyl-5-nitrohexan-2-one
Acta Crystallographica Section E, 2021, 77, 341-345
2243775 CIF
HKL
C13 H11 Br N2 O4 SP -16.8904; 8.3224; 12.8763
83.423; 80.393; 85.693
722.06Kingsbury, Christopher J.; Sample, Harry C.; Senge, Mathias O.
Crystal structures of 4-bromo-2-formyl-1-tosyl-1<i>H</i>-pyrrole, (<i>E</i>)-4-bromo-2-(2-nitrovinyl)-1-tosyl-1<i>H</i>-pyrrole and 6-(4-bromo-1-tosylpyrrol-2-yl)-4,4-dimethyl-5-nitrohexan-2-one
Acta Crystallographica Section E, 2021, 77, 341-345
2243774 CIF
HKL
Paper
C12 H10 Br N O3 SP 21 21 214.8436; 13.9149; 18.5479
90; 90; 90
1250.1Kingsbury, Christopher J.; Sample, Harry C.; Senge, Mathias O.
Crystal structures of 4-bromo-2-formyl-1-tosyl-1<i>H</i>-pyrrole, (<i>E</i>)-4-bromo-2-(2-nitrovinyl)-1-tosyl-1<i>H</i>-pyrrole and 6-(4-bromo-1-tosylpyrrol-2-yl)-4,4-dimethyl-5-nitrohexan-2-one
Acta Crystallographica Section E, 2021, 77, 341-345
2243773 CIF
HKL
Paper
C20 H27 F N2 O2P 1 21 110.2576; 9.5127; 10.5318
90; 104.691; 90
994.07Gumireddy, Ashwini; DeBoyace, Kevin; Rupprecht, Alexander; Gupta, Mohit; Patel, Saloni; Flaherty, Patrick T.; Wildfong, Peter L. D.
Crystal structure of <i>tert</i>-butyl 4-[4-(4-fluorophenyl)-2-methylbut-3-yn-2-yl]piperazine-1-carboxylate
Acta Crystallographica Section E, 2021, 77, 360-365
2243772 CIF
HKL
Paper
C24 H20 Cl N O2P 1 21/c 110.5733; 22.848; 8.7151
90; 101.477; 90
2063.3Aydin, Abdullah; Akkurt, Mehmet; Turanli, Sumeyye; Lengerli, Deniz; Banoglu, Erden; Ozcelik, Nefise Dilek
Crystal structure and Hirshfeld surface analysis of 4-(4-chlorophenyl)-5-methyl-3-{4-[(2-methylphenyl)methoxy]phenyl}-1,2-oxazole
Acta Crystallographica Section E, 2021, 77, 346-350
2243771 CIF
HKL
Paper
C32 H22 Br Cl2 N5 O S2P -112.32; 12.57; 12.7742
117.202; 102.879; 105.727
1548.4Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Manju, Nagaraja; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher
Reduced 3,4'-bipyrazoles carrying thiophene and thiazole substituents: structures of two intermediates and two products
Acta Crystallographica Section E, 2021, 77, 335-340
2243770 CIF
HKL
Paper
C31 H27 N5 O4 S2P -110.783; 11.683; 13.577
93.54; 105.17; 113.2
1490.9Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Manju, Nagaraja; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher
Reduced 3,4'-bipyrazoles carrying thiophene and thiazole substituents: structures of two intermediates and two products
Acta Crystallographica Section E, 2021, 77, 335-340
2243769 CIF
HKL
Paper
C48 H40 Cl4 N10 O3 S4P 1 2/c 115.037; 8.4266; 19.471
90; 96.246; 90
2452.5Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Manju, Nagaraja; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher
Reduced 3,4'-bipyrazoles carrying thiophene and thiazole substituents: structures of two intermediates and two products
Acta Crystallographica Section E, 2021, 77, 335-340
2243768 CIF
HKL
Paper
C25 H23 N5 O S2P -18.6269; 9.8418; 14.9
90.588; 106.162; 101.441
1188.05Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Manju, Nagaraja; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher
Reduced 3,4'-bipyrazoles carrying thiophene and thiazole substituents: structures of two intermediates and two products
Acta Crystallographica Section E, 2021, 77, 335-340
2243767 CIF
HKL
Paper
C24 H22 N2 O3P 1 21/c 110.3486; 13.9969; 27.5353
90; 93.797; 90
3979.69Allah, Omyma A. Abd; Kaur, Manpreet; Akkurt, Mehmet; Mohamed, Shaaban K.; Tamam, Asmaa H. A.; Elgarhy, Sahar M. I.; Jasinski, Jerry P.
Crystal structures of 1-(4-chlorophenyl)-4-(4-methylphenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxylic acid and 4-(4-methoxyphenyl)-1-(4-methylphenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Acta Crystallographica Section E, 2021, 77, 351-355
2243766 CIF
HKL
Paper
C23 H21 Cl N2 O3P b c a27.9446; 8.4311; 35.0101
90; 90; 90
8248.51Allah, Omyma A. Abd; Kaur, Manpreet; Akkurt, Mehmet; Mohamed, Shaaban K.; Tamam, Asmaa H. A.; Elgarhy, Sahar M. I.; Jasinski, Jerry P.
Crystal structures of 1-(4-chlorophenyl)-4-(4-methylphenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxylic acid and 4-(4-methoxyphenyl)-1-(4-methylphenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Acta Crystallographica Section E, 2021, 77, 351-355
2243765 CIF
HKL
Paper
C17 H19 N O4P 1 21/c 113.72487; 13.05333; 8.5597
90; 95.522; 90
1526.4Nowatschin, Vanessa; Näther, Christian; Lüning, Ulrich
Synthesis and crystal structure of allyl 7-(diethylamino)-2-oxo-2<i>H</i>-chromene-3-carboxylate
Acta Crystallographica Section E, 2021, 77, 331-334
2243764 CIF
HKL
Paper
C23 H19 Br N4 O2P 1 21/c 110.7812; 12.7877; 15.4575
90; 109.635; 90
2007.2Temesgen, Ayalew; Tskhovrebov, Alexander G.; Vologzhanina, Anna V.; Le, Tuan A.; Khrustalev, Victor N.
Crystal structure of 2-[(<i>E</i>)-2-(4-bromophenyl)diazen-1-yl]-4,5-bis(4-methoxyphenyl)-1<i>H</i>-imidazole: the first example of a structurally characterized triarylazoimidazole
Acta Crystallographica Section E, 2021, 77, 305-308
2243763 CIF
HKL
Paper
C24 H22 Cu3 N4 O16P -17.8669; 9.71; 10.424
97.016; 110.701; 109.049
678.2Mirzaei, Masoud; Bazargan, Maryam; Ebtehaj, Pouria; Mague, Joel T.
A redetermination of the structure and Hirshfeld surface analysis of poly[diaquadi-μ-hydroxido-tetrakis(μ-nicotinato <i>N</i>-oxide)tricopper(II)]
Acta Crystallographica Section E, 2021, 77, 309-313
2243762 CIF
HKL
Paper
C19 H24 Cl N O5P 1 21/c 114.6986; 10.6309; 25.131
90; 90.1851; 90
3926.9Anderson, Alan J.; Butcher, Ray J.; Ollie, Edward
Syntheses and structures of two benzoyl amides: 2-chloro-4-ethoxy-3,5-dimethoxy-<i>N</i>-(3-oxocyclohex-1-en-1-yl)benzamide and 2-chloro-<i>N</i>-(5,5-dimethyl-3-oxocyclohex-1-en-1-yl)-4-ethoxy-3,5-dimethoxybenzamide
Acta Crystallographica Section E, 2021, 77, 314-318
2243761 CIF
HKL
Paper
C17 H20 Cl N O5P 1 21/c 114.654; 8.9148; 13.045
90; 102.581; 90
1663.2Anderson, Alan J.; Butcher, Ray J.; Ollie, Edward
Syntheses and structures of two benzoyl amides: 2-chloro-4-ethoxy-3,5-dimethoxy-<i>N</i>-(3-oxocyclohex-1-en-1-yl)benzamide and 2-chloro-<i>N</i>-(5,5-dimethyl-3-oxocyclohex-1-en-1-yl)-4-ethoxy-3,5-dimethoxybenzamide
Acta Crystallographica Section E, 2021, 77, 314-318
2243760 CIF
HKL
Paper
C14 H21.61 K4 N8 Ni2 O18.81P b c a15.0694; 16.9659; 22.192
90; 90; 90
5673.74Plutenko, Maksym O.; Haukka, Matti; Husak, Alina O.; Iskenderov, Turganbay S.; Mulloev, Nurullo U.
Crystal structure and Hirshfeld surface analysis of poly[[bis[μ~4~-<i>N</i>,<i>N</i>'-(1,3,5-oxadiazinane-3,5-diyl)bis(carbamoylmethanoato)]nickel(II)tetrapotassium] 4.8-hydrate]
Acta Crystallographica Section E, 2021, 77, 298-304
2243759 CIF
HKL
Paper
C22 H22 Cl N3 O4 SP -18.6739; 10.549; 12.4021
91.351; 101.065; 97.235
1103.51Shyshkina, Mariia O.; Lega, Dmitry A.; Goryachiy, Volodymyr D.; Shemchuk, Ludmila M.; Levashov, Dmitriy V.; Shemchuk, Leonid A.
2-Amino-4-(4-chloro-1-ethyl-2,2-dioxo-1<i>H</i>-benzo[<i>c</i>][1,2]thiazin-3-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4<i>H</i>-chromene-3-carbonitrile: single-crystal X-ray diffraction study and Hirshfeld surface analysis
Acta Crystallographica Section E, 2021, 77, 294-297
2243758 CIF
HKL
Paper
C23 H31 N3 O2 S SnP 1 21/n 111.272; 16.1954; 14.2778
90; 111.18; 90
2430.41Yusof, Enis Nadia Md; Kwong, Huey Chong; Karunakaran, Thiruventhan; Ravoof, Thahira B. S. A.; Tiekink, Edward R. T.
Di-<i>n</i>-butyl[<i>N</i>'-(3-methoxy-2-oxidobenzylidene)-<i>N</i>-phenylcarbamohydrazonothioato]tin(IV): crystal structure, Hirshfeld surface analysis and computational study
Acta Crystallographica Section E, 2021, 77, 286-293
2243757 CIF
HKL
C22 H18 F N3 O4 SC 1 2/c 147.298; 4.8054; 18.4939
90; 100.429; 90
4134Dey, Dhananjay; Shruti, I.; Chopra, Deepak; Mohan, T. P.
Structural investigation of <i>N</i>-[2-(4-fluoro-3-phenoxybenzoyl)hydrazinecarbothioyl]benzamide and <i>N</i>-[2-(4-fluoro-3-phenoxybenzoyl)hydrazinecarbothioyl]-4-methoxybenzamide
Acta Crystallographica Section E, 2021, 77, 277-281
2243756 CIF
HKL
Paper
C21 H16 F N3 O3 SP 1 21/c 118.3849; 7.7063; 13.9216
90; 100.136; 90
1941.6Dey, Dhananjay; Shruti, I.; Chopra, Deepak; Mohan, T. P.
Structural investigation of <i>N</i>-[2-(4-fluoro-3-phenoxybenzoyl)hydrazinecarbothioyl]benzamide and <i>N</i>-[2-(4-fluoro-3-phenoxybenzoyl)hydrazinecarbothioyl]-4-methoxybenzamide
Acta Crystallographica Section E, 2021, 77, 277-281
2243755 CIF
HKL
Paper
C26 H20 N2 O3C 1 2/c 126.8396; 5.1174; 17.2574
90; 121.764; 90
2015.27Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Hawaiz, Farouq E.; Elgarhy, Sahar M. I.; Al-Taifi, Elham A.
Crystal structure and Hirshfeld surface analysis of 3-[(1<i>E</i>)-(4-{4-[(<i>E</i>)-(3-hydroxybenzylidene)amino]phenoxy}phenylimino)methyl]phenol
Acta Crystallographica Section E, 2021, 77, 266-269
2243754 CIF
HKL
Paper
C8 H14 O2P 1 21/n 16.2758; 23.6912; 7.776
90; 91.21; 90
1155.9Chan, Isa Y. H.; Bhadbhade, Mohan M.; Bishop, Roger
Threefold helical assembly <i>via</i> hydroxy hydrogen bonds: the 2:1 co-crystal of bicyclo[3.3.0]octane-<i>endo</i>-3,<i>endo</i>-7-diol and bicyclo[3.3.0]octane-<i>endo</i>-3,<i>exo</i>-7-diol
Acta Crystallographica Section E, 2021, 77, 270-276
2243753 CIF
HKL
Paper
C14 H12 Cu N2 O6P -17.6516; 9.9272; 10.0722
95.204; 107.729; 111.462
660.34Gao, Sen; Fronczek, Frank R.; Maverick, Andrew W.
A copper complex of an unusual hydroxy‒carboxylate ligand: [Cu(bpy)(C~4~H~4~O~6~)]
Acta Crystallographica Section E, 2021, 77, 282-285
2243752 CIF
HKL
Paper
C24 H24 N2 O5 SP -111.821; 11.8395; 16.7336
77.949; 79.555; 77.511
2213.3Mertsalov, Dmitriy F.; Nadirova, Maryana A.; Sorokina, Elena A.; Vinokurova, Marina A.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Kolesnik, Irina A.; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of (<i>RS</i>)-3-hydroxy-2-{[(3a<i>RS</i>,6<i>RS</i>,7a<i>RS</i>)-2-(4-methylphenylsulfonyl)-2,3,3a,6,7,7a-hexahydro-3a,6-epoxy-1<i>H</i>-isoindol-6-yl]methyl}isoindolin-1-one
Acta Crystallographica Section E, 2021, 77, 260-265
2243751 CIF
HKL
Paper
C15 H15 Br2 N O2P 1 21/n 117.4839; 8.2993; 21.512
90; 106.115; 90
2998.83Mertsalov, Dmitriy F.; Zaytsev, Vladimir P.; Pokazeev, Kuzma M.; Grigoriev, Mikhail S.; Bachinsky, Alexander V.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Mlowe, Sixberth
Crystal structure and Hirshfeld surface analysis of 2-benzyl-4,5-dibromo-2,3,3a,4,5,6,7,7a-octahydro-3a,6-epoxy-1<i>H</i>-isoindol-1-one
Acta Crystallographica Section E, 2021, 77, 255-259
2243750 CIF
HKL
Paper
C27 H33 N O5P 1 21/n 19.5289; 18.6653; 13.8046
90; 96.41; 90
2439.93Allah, Omyma A. A. Abd; Kaur, Manpreet; Akkurt, Mehmet; Mohamed, Shaaban K.; Jasinski, Jerry P.; Elgarhy, Sahar M. I.
Crystal structure and Hirshfeld surface analysis of ethyl 2-[9-(2-hydroxyphenyl)-3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,4a,5,6,7,8a,9,9a,10,10a-dodecahydroacridin-10-yl]acetate
Acta Crystallographica Section E, 2021, 77, 247-250
2243749 CIF
HKL
Paper
C22 H21 N3 OP 1 21/c 114.3493; 15.7501; 8.3737
90; 106.285; 90
1816.55Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Albayati, Mustafa R.; Elgarhy, Sahar M. I.; Al-Taifi, Elham A.
Crystal structures of two hydrazide derivatives of mefenamic acid, 3-(2,3-dimethylanilino)-<i>N</i>'-[(<i>E</i>)-(furan-2-yl)methylidene]benzohydrazide and <i>N</i>'-[(<i>E</i>)-benzylidene]-2-(2,3-dimethylanilino)benzohydrazide
Acta Crystallographica Section E, 2021, 77, 242-246
2243748 CIF
HKL
Paper
C20 H19 N3 O2P 1 21/c 113.8467; 15.8409; 8.0225
90; 104.814; 90
1701.2Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Albayati, Mustafa R.; Elgarhy, Sahar M. I.; Al-Taifi, Elham A.
Crystal structures of two hydrazide derivatives of mefenamic acid, 3-(2,3-dimethylanilino)-<i>N</i>'-[(<i>E</i>)-(furan-2-yl)methylidene]benzohydrazide and <i>N</i>'-[(<i>E</i>)-benzylidene]-2-(2,3-dimethylanilino)benzohydrazide
Acta Crystallographica Section E, 2021, 77, 242-246
2243747 CIF
HKL
Paper
C15 H15 Br2 N O2P -16.8064; 9.5045; 11.9482
79.551; 87.82; 77.083
740.89Mertsalov, Dmitriy F.; Nadirova, Maryana A.; Chervyakova, Lala V.; Grigoriev, Mikhail S.; Shelukho, Evgeniya R.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Mlowe, Sixberth
Crystal structure and Hirshfeld surface analysis of 4,5-dibromo-6-methyl-2-phenyl-2,3,3a,4,5,6,7,7a-octahydro-3a,6-epoxy-1<i>H</i>-isoindol-1-one
Acta Crystallographica Section E, 2021, 77, 237-241
2243746 CIF
HKL
Paper
C54 H80 N8 O6P 1 21/c 113.8395; 20.0443; 9.6347
90; 102.8; 90
2606.3Amrhein, Felix; Schwarzer, Anke; Mazik, Monika
Crystal structure of a methanol solvate of a macrocycle bearing two flexible side-arms
Acta Crystallographica Section E, 2021, 77, 233-236
2243745 CIF
HKL
Paper
C20 H27 NP 21 21 2110.05103; 10.62943; 15.64759
90; 90; 90
1671.74Acelas, Mauricio; Dugarte-Dugarte, Analio; Romero Bohórquez, Arnold R.; Henao, José Antonio; Delgado, José Miguel; Díaz de Delgado, Graciela
Synthesis, crystal structure, Hirshfeld surface analysis and energy framework calculations of <i>trans</i>-3,7,9,9-tetramethyl-10-(prop-2-yn-1-yl)-1,2,3,4,4a,9,9a,10-octahydroacridine
Acta Crystallographica Section E, 2021, 77, 226-232
2243744 CIF
HKL
Paper
C4 H8 O4 S2P 1 n 14.9472; 9.9021; 7.1002
90; 91.464; 90
347.71Harlow, Richard L.; Oliver, Allen G.; Sammes, Michael P.
C—H···O contacts in the crystal structure of 1,3-dithiane 1,1,3,3-tetraoxide
Acta Crystallographica Section E, 2021, 77, 204-207
2243743 CIF
HKL
Paper
C20 H19 N3 O4C 1 2/c 133.888; 14.9497; 8.2021
90; 94.447; 90
4142.8Arderne, Charmaine; Fotsing, Marthe Carine Djuide; Ndinteh, Derek Tantoh
Synthesis and structure of 4-{[(<i>E</i>)-(7-methoxy-1,3-benzodioxol-5-yl)methylidene]amino}-1,5-dimethyl-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-3-one
Acta Crystallographica Section E, 2021, 77, 200-203
2243742 CIF
HKL
Paper
C22 H56 Cl4 N4 O4P 1 21/n 17.655; 23.533; 8.313
90; 102.45; 90
1462.3Moon, Dohyun; Choi, Jong-Ha
Crystal structure of 3,14-diethyl-2,6,13,17-tetraazoniatricyclo[16.4.0.0^7,12^]docosane tetrachloride tetrahydrate from synchrotron X-ray data
Acta Crystallographica Section E, 2021, 77, 213-216
2243741 CIF
HKL
C25 H27 Cl N4 OP -18.4791; 10.4091; 13.6862
90.138; 94.833; 113.745
1100.9Ullah, Nisar; Stoeckli-Evans, Helen
Crystal structure and Hirshfeld surface analysis of the hydrochloride salt of 8-{4-[(6-phenylpyridin-3-yl)methyl]piperazin-1-yl}-3,4-dihydroquinolin-2(1<i>H</i>)-one
Acta Crystallographica Section E, 2021, 77, 208-212
2243740 CIF
HKL
Paper
C28 H21 N3 OP 21 21 2110.7038; 11.6096; 17.5182
90; 90; 90
2176.93Naghiyev, Farid N.; Grishina, Maria M.; Khrustalev, Victor N.; Khalilov, Ali N.; Akkurt, Mehmet; Akobirshoeva, Anzurat A.; Mamedov, İbrahim G.
Crystal structure and Hirshfeld surface analysis of 3-amino-1-oxo-2,6,8-triphenyl-1,2,7,8-tetrahydroisoquinoline-4-carbonitrile
Acta Crystallographica Section E, 2021, 77, 195-199
2243739 CIF
HKL
C15 H25 I N2 O2P 1 21/c 110.9091; 14.091; 11.4029
90; 100.338; 90
1724.4Pham, Duyen N. K.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
2,5-Dimethylbufotenine and 2,5-dimethylbufotenidine: novel derivatives of natural tryptamines found in <i>Bufo alvarius</i> toads
Acta Crystallographica Section E, 2021, 77, 190-194
2243738 CIF
HKL
C15 H23 I N2 OP 1 21/n 17.5067; 22.657; 10.0894
90; 97.225; 90
1702.4Pham, Duyen N. K.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
2,5-Dimethylbufotenine and 2,5-dimethylbufotenidine: novel derivatives of natural tryptamines found in <i>Bufo alvarius</i> toads
Acta Crystallographica Section E, 2021, 77, 190-194
2243737 CIF
HKL
Paper
C16 H22 N2 O3P 1 21/n 17.7368; 12.1233; 17.5528
90; 102.154; 90
1609.47Pham, Duyen N. K.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
2,5-Dimethylbufotenine and 2,5-dimethylbufotenidine: novel derivatives of natural tryptamines found in <i>Bufo alvarius</i> toads
Acta Crystallographica Section E, 2021, 77, 190-194
2243736 CIF
HKL
Paper
C24 H21 N O4C 1 c 120.3693; 10.0956; 39.1991
90; 98.443; 90
7973.6Nguyen Tien, Cong; Vu Quoc, Trung; Nguyen Dang, Dat; Le Duc, Giang; Van Meervelt, Luc
Synthesis and structure of (<i>E</i>)-<i>N</i>-(4-methoxyphenyl)-2-[4-(3-oxo-3-phenylprop-1-en-1-yl)phenoxy]acetamide
Acta Crystallographica Section E, 2021, 77, 184-189
2243735 CIF
HKL
Paper
C27 H22 F2 O4P -110.14886; 11.1827; 11.6411
66.724; 77.693; 63.613
1086.06Iitsuka, Hiroaki; Li, Kun; Kobayashi, Miyuki; Iida, Kikuko; Yonezawa, Noriyuki; Okamoto, Akiko
Crystal structure of 1,2-bis(4-fluorophenyl)-1-hydroxy-2,3,8-trimethoxyacenaphthene: formation of a five-membered intramolecular O—H···O hydrogen-bonded ring
Acta Crystallographica Section E, 2021, 77, 175-179
2243734 CIF
HKL
Paper
C30 H43 O2 PP -19.616; 15.8209; 19.0324
71.2052; 85.1144; 87.9801
2731Carsch, Kurtis M.; Ho, William; Lui, Kai Hin; Valtierra, Gregory; Dogutan, Dilek K.; Nocera, Daniel G.; Zheng, Shao-Liang
Crystal structure of the RuPhos ligand
Acta Crystallographica Section E, 2021, 77, 171-174
2243733 CIF
HKL
Paper
C18 H25 B O2 SnC 1 2/c 130.1386; 11.2948; 16.4726
90; 139.457; 90
3644.9Breitwieser, Kevin; Chen, Peter
Crystal structure of a 1,1-dibutyl-1<i>H</i>,3<i>H</i>-naphtho[1,8-<i>cd</i>][1,2,6]oxastannaborinin-3-ol
Acta Crystallographica Section E, 2021, 77, 180-183
2243732 CIF
HKL
Paper
C24 H36 Cl2 F2 N6 Ni O8C 1 2/c 116.991; 15.5187; 13.8864
90; 126.189; 90
2955.1Kwak, Chee-Hun; Chang, Mee
Crystal structure of [3,10-bis(4-fluorophenethyl)-1,3,5,8,10,12-hexaazacyclotetradecane]nickel(II) diperchlorate
Acta Crystallographica Section E, 2021, 77, 148-152
2243731 CIF
HKL
Paper
C26 H22 Cd N8 O4A e a 212.6654; 17.6394; 10.888
90; 90; 90
2432.49Yang, Ping; Xie, Xiao-Bao; Shi, Qing-Shan
Crystal structure of bis{2-hydroxy-<i>N</i>'-[1-(pyrazin-2-yl)ethylidene]benzohydrazidato}cadmium(II)
Acta Crystallographica Section E, 2021, 77, 153-157
2243730 CIF
HKL
Paper
C12 H9 N3 O4 SP 21 21 217.1335; 11.7297; 15.4593
90; 90; 90
1293.54Kansiz, Sevgi; Dege, Necmi; Ozturk, Seyhan; Akdemir, Nesuhi; Tarcan, Erdoğan; Arslanhan, Ali; Saif, Eiad
Crystal structure and Hirshfeld surface analysis of 2-methyl-3-nitro-<i>N</i>-[(<i>E</i>)-(5-nitrothiophen-2-yl)methylidene]aniline
Acta Crystallographica Section E, 2021, 77, 138-141
2243729 CIF
HKL
Paper
C30 H36 N2 Na2 O10P -18.5404; 9.0144; 21.6217
92.922; 98.873; 113.038
1502.1Konovalova, Irina S.; Kovalenko, Sergiy M.; Kravchenko, Dmitry V.; Chuev, Vladimir P.
Crystal structure of the non-steroidal anti-inflammatory drug (NSAID) tolmetin sodium
Acta Crystallographica Section E, 2021, 77, 134-137
2243728 CIF
HKL
Paper
C8 H4 Cl F3 N2 O3P 1 21/c 18.3012; 28.23; 9.1522
90; 110.424; 90
2009.9Richter, Adrian; Goddard, Richard; Schlegel, Tom; Imming, Peter; Seidel, Rüdiger W.
2-Chloro-3-nitro-5-(trifluoromethyl)benzoic acid and -benzamide: structural characterization of two precursors for antitubercular benzothiazinones
Acta Crystallographica Section E, 2021, 77, 142-147
2243727 CIF
HKL
Paper
C8 H3 Cl F3 N O4P -14.7297; 7.8993; 13.044
91.57; 96.51; 104.79
467.35Richter, Adrian; Goddard, Richard; Schlegel, Tom; Imming, Peter; Seidel, Rüdiger W.
2-Chloro-3-nitro-5-(trifluoromethyl)benzoic acid and -benzamide: structural characterization of two precursors for antitubercular benzothiazinones
Acta Crystallographica Section E, 2021, 77, 142-147
2243726 CIF
HKL
Paper
C11 H12 N6 O2C 1 2/c 127.7311; 7.1747; 11.7849
90; 94.101; 90
2338.7Heras Martinez, Hector Mario; Chavez Flores, David; Hillesheim, Patrick C.; Patil, Siddappa; Bugarin, Alejandro
Crystal structure and spectroscopic properties of (<i>E</i>)-1,3-dimethyl-2-[3-(4-nitrophenyl)triaz-2-enylidene]-2,3-dihydro-1<i>H</i>-imidazole
Acta Crystallographica Section E, 2021, 77, 130-133
2243725 CIF
HKL
Paper
C28 H27 N3 O3 SP 1 21/n 112.0487; 13.9821; 15.0239
90; 106.606; 90
2425.46Al-Taifi, Elham A.; Maraei, Islam S.; Bakhite, Etify A.; Demirtas, Güneş; Mague, Joel. T.; Mohamed, Shaaban K.; Ramli, Youssef
Crystallographic and spectroscopic characterization of 2-[(7-acetyl-4-cyano-6-hydroxy-1,6-dimethyl-8-phenyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-<i>N</i>-phenylacetamide
Acta Crystallographica Section E, 2021, 77, 121-125
2243724 CIF
HKL
Paper
C20 H20 B2 F4 N4P n m a20.2495; 6.8046; 13.4969
90; 90; 90
1859.73Liu, Xiaoxue; Li, Tuo; Yin, Zhenming
Crystal structure and fluorescence study of (μ-<i>N</i>-[(3,5-dimethyl-1<i>H</i>-pyrrol-2-yl)methylidene]-<i>N</i>-{4-[(3,5-dimethyl-1<i>H</i>-pyrrol-2-yl)methylideneazaniumyl]phenyl}azanium)bis[difluoridoboron(IV)]
Acta Crystallographica Section E, 2021, 77, 126-129
2243723 CIF
HKL
Paper
C44 H52 N4 O12C 1 2/c 123.6642; 8.4204; 23.4002
90; 111.614; 90
4334.9Pham, Duyen N. K.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
Psilacetin derivatives: fumarate salts of the methyl‒ethyl, methyl‒allyl and diallyl variants of the psilocin prodrug
Acta Crystallographica Section E, 2021, 77, 101-106
2243722 CIF
HKL
Paper
C20 H24 N2 O6P 1 21 17.9702; 14.1788; 9.8035
90; 113.394; 90
1016.8Pham, Duyen N. K.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
Psilacetin derivatives: fumarate salts of the methyl‒ethyl, methyl‒allyl and diallyl variants of the psilocin prodrug
Acta Crystallographica Section E, 2021, 77, 101-106
2243721 CIF
HKL
Paper
C19 H24 N2 O6P 1 21 17.9555; 13.3696; 9.9708
90; 112.874; 90
977.12Pham, Duyen N. K.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R.
Psilacetin derivatives: fumarate salts of the methyl‒ethyl, methyl‒allyl and diallyl variants of the psilocin prodrug
Acta Crystallographica Section E, 2021, 77, 101-106
2243720 CIF
HKL
Paper
C20 H19 N O5P -18.81; 9.9182; 11.165
81.205; 70.657; 72.642
877Zaytsev, Vladimir P.; Chervyakova, Lala V.; Sorokina, Elena A.; Vasilyev, Kirill A.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of ethyl (4<i>R</i>,4a<i>S</i>)-2-methyl-5,8-dioxo-6-phenyl-4a,5,6,7,7a,8-hexahydro-4<i>H</i>-furo[2,3-<i>f</i>]isoindole-4-carboxylate
Acta Crystallographica Section E, 2021, 77, 86-90
2243719 CIF
HKL
C18 H16 I N3P 1 21/n 19.8821; 9.7125; 17.9839
90; 103.676; 90
1677.16Kalle, Paulina; Tatarin, Sergei V.; Zakharov, Alexander Yu.; Kiseleva, Marina A.; Bezzubov, Stanislav I.
Synthesis and comparative structural study of 2-(pyridin-2-yl)-1<i>H</i>-perimidine and its mono- and di-<i>N</i>-methylated analogues
Acta Crystallographica Section E, 2021, 77, 96-100
2243718 CIF
HKL
C17 H13 N3P 1 21/c 17.5095; 12.1216; 13.5616
90; 92.547; 90
1233.25Kalle, Paulina; Tatarin, Sergei V.; Zakharov, Alexander Yu.; Kiseleva, Marina A.; Bezzubov, Stanislav I.
Synthesis and comparative structural study of 2-(pyridin-2-yl)-1<i>H</i>-perimidine and its mono- and di-<i>N</i>-methylated analogues
Acta Crystallographica Section E, 2021, 77, 96-100
2243717 CIF
HKL
Paper
C16 H11 N3P 1 21/c 113.5479; 5.0242; 17.3881
90; 101.382; 90
1160.29Kalle, Paulina; Tatarin, Sergei V.; Zakharov, Alexander Yu.; Kiseleva, Marina A.; Bezzubov, Stanislav I.
Synthesis and comparative structural study of 2-(pyridin-2-yl)-1<i>H</i>-perimidine and its mono- and di-<i>N</i>-methylated analogues
Acta Crystallographica Section E, 2021, 77, 96-100
2243716 CIF
HKL
C12 H14 Cl2 N2 O2 SnP b c n19.9848; 10.3723; 14.4644
90; 90; 90
2998.3Henkel, Felix; Reuter, Hans
Two coordination compounds of SnCl~2~ with 4-methylpyridine <i>N</i>-oxide
Acta Crystallographica Section E, 2021, 77, 91-95
2243715 CIF
HKL
Paper
C6 H7 Cl2 N O SnP 1 21/c 111.7934; 9.4895; 8.617
90; 106.455; 90
924.86Henkel, Felix; Reuter, Hans
Two coordination compounds of SnCl~2~ with 4-methylpyridine <i>N</i>-oxide
Acta Crystallographica Section E, 2021, 77, 91-95
2243714 CIF
Paper
C29 H26 N4 O6P -17.8576; 12.3468; 14.1147
94.295; 104.603; 101.042
1289.6Holmberg, Ryne; Franz, Vanessa; Moser, Kristen M.; Solano, Ricardo; Moore, Curtis; Rheingold, Arnold L.; Smith, Gary L. N.
Crystal structure of 2,2'-{[(2-nitrobenzyl)azanediyl]bis(propane-3,1-diyl)}bis[1<i>H</i>-isoindole-1,3(2<i>H</i>)-dione]
Acta Crystallographica Section E, 2021, 77, 83-85
2243713 CIF
HKL
Paper
C17 H14 O5I 1 2 118.9581; 6.6461; 22.4043
90; 94.163; 90
2815.4Suthiphasilp, Virayu; Meesakul, Pornphimol; Richardson, Christopher; Pyne, Stephen G.; Laphookhieo, Surat
Isolation and crystal structure of lawinal
Acta Crystallographica Section E, 2021, 77, 75-78
2243712 CIF
HKL
Paper
C30 H44 Ca N6 O6 S2P -18.6686; 10.519; 18.998
75.488; 76.847; 80.905
1623.7Butcher, Ray J.; Purdy, Andrew P.; Brown, Paul A.; Gunlycke, Daniel
Synthesis, structure, and theoretical studies of a calcium complex of a unique dianion derived from 1-methylpyrrolidin-2-one
Acta Crystallographica Section E, 2021, 77, 70-74
2243711 CIF
HKL
Paper
H6 K2 Mg3 O16 S3C m c 2117.8228; 7.4879; 9.7686
90; 90; 90
1303.7Weil, Matthias
Redetermination of K~2~Mg~3~(OH)~2~(SO~4~)~3~(H~2~O)~2~ from single-crystal X-ray data revealing the correct hydrogen-atom positions
Acta Crystallographica Section E, 2021, 77, 62-65
2243710 CIF
HKL
Paper
C14 H13 N O2C 1 2/c 124.3559; 10.7032; 8.9667
90; 93.22; 90
2333.8Akduran, Nurcan
Crystal structure of 2-hydroxy-2-phenylacetophenone oxime
Acta Crystallographica Section E, 2021, 77, 66-69
2243709 CIF
Paper
Al Cl H14 O11 SP 1 21/c 16.164; 22.933; 7.2876
90; 97.328; 90
1021.8Svensson, Fredric G.
Synthesis and crystal structures of [Al(H~2~O)~6~](SO~4~)NO~3~·2H~2~O and [Al(H~2~O)~6~](SO~4~)Cl·H~2~O
Acta Crystallographica Section E, 2021, 77, 58-61
2243708 CIF
Paper
Al H16 N O15 SP -16.088; 7.377; 13.721
77.34; 89.561; 82.712
596.3Svensson, Fredric G.
Synthesis and crystal structures of [Al(H~2~O)~6~](SO~4~)NO~3~·2H~2~O and [Al(H~2~O)~6~](SO~4~)Cl·H~2~O
Acta Crystallographica Section E, 2021, 77, 58-61
2243707 CIF
HKL
C27 H20 Cl2 N P PdP -19.6582; 9.8765; 13.0748
102.011; 90.426; 109.827
1143.4Mori, Masatoshi; Namioka, Atsushi; Suzuki, Takayoshi
Crystal and molecular structures of dichloridopalladium(II) containing 2-methyl- or 2-phenyl-8-(diphenyphosphanyl)quinoline
Acta Crystallographica Section E, 2021, 77, 52-57
2243706 CIF
HKL
Paper
C22 H18 Cl2 N P PdC 1 2/c 113.8153; 15.5676; 18.9683
90; 108.733; 90
3863.4Mori, Masatoshi; Namioka, Atsushi; Suzuki, Takayoshi
Crystal and molecular structures of dichloridopalladium(II) containing 2-methyl- or 2-phenyl-8-(diphenyphosphanyl)quinoline
Acta Crystallographica Section E, 2021, 77, 52-57
2243705 CIF
HKL
Paper
C13 H12 N2 O2P n a 218.284; 8.006; 31.637
90; 90; 90
2098.2Tojiboev, Akmal; Zhurakulov, Sherzod; Vinogradova, Valentina; Englert, Ulli; Wang, Ruimin
Crystal structure, Hirshfeld surface analysis and energy framework study of 6-formyl-7,8,9,11-tetrahydro-5<i>H</i>-pyrido[2,1-<i>b</i>]quinazolin-11-one
Acta Crystallographica Section E, 2021, 77, 47-51
2243704 CIF
HKL
Paper
C53 H38 Cl8 Cu4 N4 OP -112.7166; 14.4366; 16.4038
105.024; 105.935; 102.999
2650.82Al Balushi, Rayya A.; Khan, Muhammad S.; Faizi, Md. Serajul Haque; Haque, Ashanul; Molloy, Kieran; Raithby, Paul R.
Synthesis and structural characterization of hexa-μ~2~-chlorido-μ~4~-oxido-tetrakis{[4-(phenylethynyl)pyridine-κ<i>N</i>]copper(II)} dichloromethane monosolvate
Acta Crystallographica Section E, 2021, 77, 42-46
2243703 CIF
HKL
Paper
C20 H21 N3 O7P 1 21/c 16.0686; 19.2791; 16.3795
90; 94.185; 90
1911.2Bouzian, Younos; Baydere, Cemile; Dege, Necmi; Ahabchane, Noureddine Hamou; Mague, Joel T.; Abudunia, Abdulmalik; Karrouchi, Khalid; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis, DFT and molecular docking investigation of 2-(2-oxo-1,3-oxazolidin-3-yl)ethyl 2-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]quinoline-4-carboxylate
Acta Crystallographica Section E, 2021, 77, 28-33
2243702 CIF
HKL
Paper
C3 H6 N4 O3P n a 217.27; 9.907; 8.551
90; 90; 90
615.9Archana, Sreeramapura D.; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Two 3-amino-1<i>H</i>-pyrazol-2-ium salts containing organic anions, and an orthorhombic polymorph of 3-amino-1<i>H</i>-pyrazol-2-ium nitrate
Acta Crystallographica Section E, 2021, 77, 34-41
2243701 CIF
HKL
Paper
C14 H18 N6 O8P 1 21/c 18.541; 14.0507; 7.5137
90; 98.827; 90
891.02Archana, Sreeramapura D.; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Two 3-amino-1<i>H</i>-pyrazol-2-ium salts containing organic anions, and an orthorhombic polymorph of 3-amino-1<i>H</i>-pyrazol-2-ium nitrate
Acta Crystallographica Section E, 2021, 77, 34-41
2243700 CIF
HKL
Paper
C10 H11 N5 O7P -16.6864; 8.1857; 12.649
79.424; 85.583; 75.586
658.78Archana, Sreeramapura D.; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Two 3-amino-1<i>H</i>-pyrazol-2-ium salts containing organic anions, and an orthorhombic polymorph of 3-amino-1<i>H</i>-pyrazol-2-ium nitrate
Acta Crystallographica Section E, 2021, 77, 34-41
2243699 CIF
HKL
Paper
C19 H14 Cl2 N2 OP 1 21/n 110.1306; 10.7019; 15.7749
90; 97.715; 90
1694.78Daoui, Said; Cinar, Emine Berrin; Dege, Necmi; Chelfi, Tarik; El Kalai, Fouad; Abudunia, Abdulmalik; Karrouchi, Khalid; Benchat, Noureddine
Crystal structure and Hirshfeld surface analysis of 4-(2,6-dichlorobenzyl)-6-[(<i>E</i>)-2-phenylethenyl]pyridazin-3(2<i>H</i>)-one
Acta Crystallographica Section E, 2021, 77, 23-27
2243698 CIF
HKL
Paper
C16 H14 N2 OP 1 21/n 19.2572; 9.0531; 15.0557
90; 99.329; 90
1245.1Al Ati, Gamal; Chkirate, Karim; Mashrai, Ashraf; Mague, Joel T.; Ramli, Youssef; Achour, Redouane; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis and DFT study of 1-ethyl-3-phenyl-1,2-dihydroquinoxalin-2-one
Acta Crystallographica Section E, 2021, 77, 18-22
2243697 CIF
HKL
Paper
C18 H19 F N2 O2P 1 21/n 17.451; 11.199; 19.138
90; 99.59; 90
1574.6Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Six 1-halobenzoyl-4-(2-methoxyphenyl)piperazines having <i>Z</i>' values of one, two or four; disorder, pseudosymmetry, twinning and supramolecular assembly in one, two or three dimensions
Acta Crystallographica Section E, 2021, 77, 5-13
2243696 CIF
HKL
Paper
C18 H19 I N2 O2P 21 21 217.4528; 17.1306; 27.903
90; 90; 90
3562.4Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Six 1-halobenzoyl-4-(2-methoxyphenyl)piperazines having <i>Z</i>' values of one, two or four; disorder, pseudosymmetry, twinning and supramolecular assembly in one, two or three dimensions
Acta Crystallographica Section E, 2021, 77, 5-13
2243695 CIF
HKL
Paper
C18 H19 I N2 O2P 1 21/c 110.9626; 11.3258; 14.8234
90; 104.52; 90
1781.69Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Six 1-halobenzoyl-4-(2-methoxyphenyl)piperazines having <i>Z</i>' values of one, two or four; disorder, pseudosymmetry, twinning and supramolecular assembly in one, two or three dimensions
Acta Crystallographica Section E, 2021, 77, 5-13
2243694 CIF
HKL
Paper
C18 H19 Br N2 O2P c a 2115.0779; 11.2868; 20.5297
90; 90; 90
3493.8Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Six 1-halobenzoyl-4-(2-methoxyphenyl)piperazines having <i>Z</i>' values of one, two or four; disorder, pseudosymmetry, twinning and supramolecular assembly in one, two or three dimensions
Acta Crystallographica Section E, 2021, 77, 5-13
2243693 CIF
HKL
Paper
C18 H19 Cl N2 O2P c a 2129.769; 11.3173; 20.4028
90; 90; 90
6873.8Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Six 1-halobenzoyl-4-(2-methoxyphenyl)piperazines having <i>Z</i>' values of one, two or four; disorder, pseudosymmetry, twinning and supramolecular assembly in one, two or three dimensions
Acta Crystallographica Section E, 2021, 77, 5-13
2243692 CIF
HKL
Paper
C18 H19 F N2 O2P 21 21 217.3286; 11.3388; 20.304
90; 90; 90
1687.21Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Six 1-halobenzoyl-4-(2-methoxyphenyl)piperazines having <i>Z</i>' values of one, two or four; disorder, pseudosymmetry, twinning and supramolecular assembly in one, two or three dimensions
Acta Crystallographica Section E, 2021, 77, 5-13
2243691 CIF
HKL
Paper
K Lu Mo2 O8P b c n5.0292; 18.2519; 7.8174
90; 90; 90
717.58Chong, Saehwa; Perry, Samuel; Riley, Brian J.; Nelson, Zayne J.
Crystal structures and comparisons of potassium rare-earth molybdates K<i>RE</i>(MoO~4~)~2~ (<i>RE</i> = Tb, Dy, Ho, Er, Yb, and Lu)
Acta Crystallographica Section E, 2020, 76, 1871-1875
2243690 CIF
HKL
Paper
K Mo2 O8 YbP b c n5.0417; 18.3039; 7.8693
90; 90; 90
726.2Chong, Saehwa; Perry, Samuel; Riley, Brian J.; Nelson, Zayne J.
Crystal structures and comparisons of potassium rare-earth molybdates K<i>RE</i>(MoO~4~)~2~ (<i>RE</i> = Tb, Dy, Ho, Er, Yb, and Lu)
Acta Crystallographica Section E, 2020, 76, 1871-1875
2243689 CIF
HKL
Paper
Er K Mo2 O8P b c n5.0602; 18.1965; 7.892
90; 90; 90
726.68Chong, Saehwa; Perry, Samuel; Riley, Brian J.; Nelson, Zayne J.
Crystal structures and comparisons of potassium rare-earth molybdates K<i>RE</i>(MoO~4~)~2~ (<i>RE</i> = Tb, Dy, Ho, Er, Yb, and Lu)
Acta Crystallographica Section E, 2020, 76, 1871-1875
2243688 CIF
HKL
Paper
Ho K Mo2 O8P b c n5.077; 18.161; 7.934
90; 90; 90
731.5Chong, Saehwa; Perry, Samuel; Riley, Brian J.; Nelson, Zayne J.
Crystal structures and comparisons of potassium rare-earth molybdates K<i>RE</i>(MoO~4~)~2~ (<i>RE</i> = Tb, Dy, Ho, Er, Yb, and Lu)
Acta Crystallographica Section E, 2020, 76, 1871-1875
2243687 CIF
HKL
Paper
Dy K Mo2 O8P b c n5.0776; 18.1214; 7.9428
90; 90; 90
730.84Chong, Saehwa; Perry, Samuel; Riley, Brian J.; Nelson, Zayne J.
Crystal structures and comparisons of potassium rare-earth molybdates K<i>RE</i>(MoO~4~)~2~ (<i>RE</i> = Tb, Dy, Ho, Er, Yb, and Lu)
Acta Crystallographica Section E, 2020, 76, 1871-1875
2243686 CIF
HKL
Paper
K Mo2 O8 TbP b c n5.0826; 18.1273; 7.9875
90; 90; 90
735.92Chong, Saehwa; Perry, Samuel; Riley, Brian J.; Nelson, Zayne J.
Crystal structures and comparisons of potassium rare-earth molybdates K<i>RE</i>(MoO~4~)~2~ (<i>RE</i> = Tb, Dy, Ho, Er, Yb, and Lu)
Acta Crystallographica Section E, 2020, 76, 1871-1875
2243685 CIF
HKL
Paper
C23 H31 B N6 O5P 1 21/c 120.76; 9.5527; 12.045
90; 91.929; 90
2387.3Ayudhya, Theppawut; Raymond, Casey; Dingra, Nin
Synthesis and structure of a 1:1 co-crystal of hexamethylenetetramine carboxyborane and acetaminophen
Acta Crystallographica Section E, 2020, 76, 1854-1858
2243684 CIF
HKL
Paper
C12 H10 N2P 1 21/n 17.4591; 5.5045; 11.7803
90; 99.638; 90
476.86Quentin, Jay; Reinheimer, Eric W.; MacGillivray, Leonard R.
X-ray crystal structure of <i>trans</i>-bis(pyridin-3-yl)ethylene: comparing the supramolecular structural features among the symmetrical bis(<i>n</i>-pyridyl)ethylenes (<i>n</i> = 2, 3, or 4) constitutional isomers
Acta Crystallographica Section E, 2020, 76, 1859-1862
2243683 CIF
HKL
Paper
H12 N3 O15 TmP -16.705; 8.9733; 11.4915
70.924; 88.908; 68.923
605.9Klein, Wilhelm
Crystal structures of the penta- and hexahydrate of thulium nitrate
Acta Crystallographica Section E, 2020, 76, 1863-1867
2243682 CIF
HKL
Paper
H10 N3 O14 TmP -16.5782; 9.5213; 10.4848
63.696; 84.656; 76.146
571.51Klein, Wilhelm
Crystal structures of the penta- and hexahydrate of thulium nitrate
Acta Crystallographica Section E, 2020, 76, 1863-1867
2243681 CIF
HKL
Paper
C21 H23 N O4 SP -18.9428; 9.5089; 12.109
100.395; 91.739; 108.97
953.4Temesgen, Ayalew W.; Luong, Minh Duc; Truong, Hong Hieu; Nguyen, Van Tuyen; Dang, Thi Tuyet Anh; Le, Tuan Anh; Tskhovrebov, Alexander G.; Khrustalev, Victor N.
Unexpected synthesis and crystal structure of <i>N</i>-{2-[2-(2-acetylethenyl)phenoxy]ethyl}-<i>N</i>-ethenyl-4-methylbenzenesulfonamide
Acta Crystallographica Section E, 2020, 76, 1851-1853
2243680 CIF
HKL
Paper
C28 H34 Cl4 N2 Na2 O11P -19.437; 9.5675; 19.1526
90.331; 99.828; 90.436
1703.79Angel Nieto, Ismael; Bernès, Sylvain; Pérez-Benítez, Aarón
Crystal structure of a new hydrate form of the NSAID sodium diclofenac
Acta Crystallographica Section E, 2020, 76, 1846-1850
2243679 CIF
HKL
Paper
C12 H24 N6 Ni S4P 1 2/c 110.7245; 6.205; 15.1579
90; 103.14; 90
982.28Jochim, Aleksej; Radulovic, Rastko; Jess, Inke; Näther, Christian
Crystal structure of bis(tetramethylthiourea-κ<i>S</i>)bis(thiocyanato-κ<i>N</i>)nickel(II)
Acta Crystallographica Section E, 2020, 76, 1841-1845
2243678 CIF
HKL
Paper
C78 H65 B2 F4 N3 O2 P2P -110.3527; 13.5958; 23.4352
86.218; 78.916; 87.104
3227.6Budanow, Alexandra; Lerner, Hans-Wolfram; Bolte, Michael
Two salts of the 6,6-difluoro-6<i>H</i>-dibenzo[<i>c</i>,<i>e</i>][1,2]oxaborinin-6-ide anion with different cations
Acta Crystallographica Section E, 2020, 76, 1837-1840
2243677 CIF
HKL
Paper
C12 H8 B F2 K OP 1 21/c 113.2962; 6.23; 12.9294
90; 97.226; 90
1062.5Budanow, Alexandra; Lerner, Hans-Wolfram; Bolte, Michael
Two salts of the 6,6-difluoro-6<i>H</i>-dibenzo[<i>c</i>,<i>e</i>][1,2]oxaborinin-6-ide anion with different cations
Acta Crystallographica Section E, 2020, 76, 1837-1840
2243676 CIF
HKL
Paper
C14 H8 N2 O S2P 1 21/n 115.768; 4.7583; 17.316
90; 101.572; 90
1272.8Khaldi, Hafsa; Djafri, Ahmed; Megrouss, Youcef; Khelloul, Nawel; Chouaih, Abdelkader; Djafri, Ayada
Molecular and crystal structure, Hirshfeld analysis and DFT investigation of 3-(furan-2-ylmethylidene)thiazolo[3,4-<i>a</i>]benzimidazole-1-thione
Acta Crystallographica Section E, 2020, 76, 1832-1836
2243675 CIF
HKL
Paper
C22 H33 N3 O4P -19.6579; 11.798; 12.216
100.95; 109.41; 111.12
1146.3Kvyatkovskaya, Elizaveta A.; Atioğlu, Zeliha; Akkurt, Mehmet; Epifanova, Polina P.; Valchuk, Karina S.; Khrustalev, Victor N.; Bhattarai, Ajaya
Crystal structure and Hirshfeld analysis of di-<i>tert</i>-butyl 2,2'-[(ethylazanediyl)bis(methylene)]bis(1<i>H</i>-pyrrole-1-carboxylate)
Acta Crystallographica Section E, 2020, 76, 1827-1831
2243674 CIF
HKL
Paper
C26 H20 N2 O5P 1 21/c 119.0586; 13.9627; 8.1459
90; 101.78; 90
2122.05Weaver, Matthew J.; Campbell, Michael J.; Li, Chun; Natale, Nicholas R.
Ethyl 5-methyl-3-[11-(pyridin-2-yl)-6,11-dihydro-6,11-epoxydibenzo[<i>b</i>,<i>e</i>]oxepin-6-yl]isoxazole-4-carboxylate: a bicyclic acetal from the rearrangement of an anthracenyl isoxazole
Acta Crystallographica Section E, 2020, 76, 1818-1822
2243673 CIF
HKL
Paper
C24 H27 B2 F8 N3 P2 PtP 1 21/n 17.9102; 21.0833; 16.7519
90; 95.3931; 90
2781.4Mori, Masatoshi; Suzuki, Takayoshi
Comparison of molecular structures of <i>cis</i>-bis[8-(dimethylphosphanyl)quinoline]nickel(II) and -platinum(II) complex cations
Acta Crystallographica Section E, 2020, 76, 1813-1817
2243672 CIF
HKL
Paper
C23 H27 Cl2 N3 Ni O10 P2P 1 21/c 117.8114; 8.9398; 18.0245
90; 100.524; 90
2821.8Mori, Masatoshi; Suzuki, Takayoshi
Comparison of molecular structures of <i>cis</i>-bis[8-(dimethylphosphanyl)quinoline]nickel(II) and -platinum(II) complex cations
Acta Crystallographica Section E, 2020, 76, 1813-1817
2243671 CIF
HKL
Paper
C9 H10 O4P 1 21/c 17.7574; 8.4763; 14.3322
90; 97.526; 90
934.3Portalone, Gustavo
Crystal structure and Hirshfeld surface analysis of a third polymorph of 2,6-dimethoxybenzoic acid
Acta Crystallographica Section E, 2020, 76, 1823-1826
2243670 CIF
HKL
Paper
C24 H25 Cl N2 O5P 1 21/n 113.5609; 20.28; 17.728
90; 95.363; 90
4854.1Shreekanth, Tharangini K.; Yathirajan, Hemmige S.; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher
Order <i>versus</i> disorder in two isomorphous pyrazolone-substituted diethyl propanedioates prepared using a three-component one-pot reaction under solvent-free conditions
Acta Crystallographica Section E, 2020, 76, 1605-1610
2243669 CIF
HKL
Paper
C24 H25 Br N2 O5P 1 21/n 113.5644; 20.3405; 17.4818
90; 94.858; 90
4806Shreekanth, Tharangini K.; Yathirajan, Hemmige S.; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher
Order <i>versus</i> disorder in two isomorphous pyrazolone-substituted diethyl propanedioates prepared using a three-component one-pot reaction under solvent-free conditions
Acta Crystallographica Section E, 2020, 76, 1605-1610
2243668 CIF
HKL
Paper
C18 H22 O4P n a 2111.2952; 20.9595; 6.684
90; 90; 90
1582.4Rutledge, Kelli M.; Griesbach, Caleb; Mercado, Brandon Q.; Peczuh, Mark W.
Structures of three disubstituted [13]-macrodilactones reveal effects of substitution on macrocycle conformation
Acta Crystallographica Section E, 2020, 76, 1617-1623
2243667 CIF
HKL
Paper
C18 H21 Br O4P 1 21/n 115.3128; 5.55594; 20.5689
90; 95.7658; 90
1741.09Rutledge, Kelli M.; Griesbach, Caleb; Mercado, Brandon Q.; Peczuh, Mark W.
Structures of three disubstituted [13]-macrodilactones reveal effects of substitution on macrocycle conformation
Acta Crystallographica Section E, 2020, 76, 1617-1623
2243666 CIF
HKL
Paper
C13 H20 O4P 1 21/c 18.0547; 18.7875; 8.966
90; 102.53; 90
1324.49Rutledge, Kelli M.; Griesbach, Caleb; Mercado, Brandon Q.; Peczuh, Mark W.
Structures of three disubstituted [13]-macrodilactones reveal effects of substitution on macrocycle conformation
Acta Crystallographica Section E, 2020, 76, 1617-1623
2243665 CIF
HKL
Co12 P7P -68.253; 8.253; 3.2902
90; 90; 120
194.1Zurkowski, Claire; Lavina, Barbara; Chariton, Stella; Tkachev, Sergey; Prakapenka, Vitali; Campbell, Andrew
The novel high-pressure/high-temperature compound Co~12~P~7~ determined from synchrotron data
Acta Crystallographica Section E, 2020, 76, 1665-1668
2243664 CIF
HKL
Paper
Co12 P7P -67.97; 7.97; 3.2034
90; 90; 120
176.22Zurkowski, Claire; Lavina, Barbara; Chariton, Stella; Tkachev, Sergey; Prakapenka, Vitali; Campbell, Andrew
The novel high-pressure/high-temperature compound Co~12~P~7~ determined from synchrotron data
Acta Crystallographica Section E, 2020, 76, 1665-1668
2243663 CIF
HKL
Paper
C12 H16 Cl6 N4 SnP 1 21/n 19.3953; 11.7817; 9.8243
90; 106.547; 90
1042.44Ferjani, Hela
Crystal structure, optical property and Hirshfeld surface analysis of bis[1-(prop-2-en-1-yl)-1<i>H</i>-imidazol-3-ium] hexachloridostannate(IV)
Acta Crystallographica Section E, 2020, 76, 1624-1628
2243662 CIF
HKL
C9 H12 N2 O4P 1 21/n 18.2431; 4.8088; 26.754
90; 90.1; 90
1060.5Sapayev, F. A.; Okmanov, R. Ya.; Kholikov, T. S.; Tadjimukhamedov, Kh. S.; Tashkhodjaev, B.
Crystal structures of 2-amino-2-oxoethyl 4-bromobenzoate, 2-amino-2-oxoethyl 4-nitrobenzoate and 2-amino-2-oxoethyl 4-aminobenzoate monohydrate
Acta Crystallographica Section E, 2020, 76, 1805-1809
2243661 CIF
HKL
C9 H8 N2 O5P -17.1238; 7.3683; 10.063
107.82; 94.95; 96.32
495.8Sapayev, F. A.; Okmanov, R. Ya.; Kholikov, T. S.; Tadjimukhamedov, Kh. S.; Tashkhodjaev, B.
Crystal structures of 2-amino-2-oxoethyl 4-bromobenzoate, 2-amino-2-oxoethyl 4-nitrobenzoate and 2-amino-2-oxoethyl 4-aminobenzoate monohydrate
Acta Crystallographica Section E, 2020, 76, 1805-1809
2243660 CIF
HKL
C9 H8 Br N O3P 1 21/n 118.623; 4.8255; 23.195
90; 112.96; 90
1919.3Sapayev, F. A.; Okmanov, R. Ya.; Kholikov, T. S.; Tadjimukhamedov, Kh. S.; Tashkhodjaev, B.
Crystal structures of 2-amino-2-oxoethyl 4-bromobenzoate, 2-amino-2-oxoethyl 4-nitrobenzoate and 2-amino-2-oxoethyl 4-aminobenzoate monohydrate
Acta Crystallographica Section E, 2020, 76, 1805-1809
2243659 CIF
HKL
Paper
C7 H4 Cl F O2P n a 2114.273; 12.7102; 3.7154
90; 90; 90
674.02Triggs, Christopher T.; Tanski, Joseph M.
Crystallographic and spectroscopic characterization of 3-chloro-5-fluorosalicylaldehyde
Acta Crystallographica Section E, 2020, 76, 1810-1812
2243658 CIF
HKL
Paper
C15 H25.4 N2 O8.7P 1 21 17.479; 7.065; 17.788
90; 101.58; 90
920.8Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher
Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 1779-1793
2243657 CIF
HKL
Paper
C15 H20 N2 O5P -17.8546; 8.9626; 11.2056
79.043; 87.715; 85.84
772.15Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher
Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 1779-1793
2243656 CIF
HKL
Paper
C15 H20 N2 O5P -111.1076; 11.1164; 13.7649
80.353; 78.353; 74.406
1591.76Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher
Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 1779-1793
2243655 CIF
HKL
Paper
C17 H19 N5 O8P -19.4151; 9.8721; 10.9572
77.524; 81.36; 81.002
974.97Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher
Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 1779-1793
2243654 CIF
HKL
Paper
C18 H24 N4 O9P -17.8448; 11.4635; 12.0747
94.406; 105.075; 93.717
1041.33Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher
Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 1779-1793
2243653 CIF
HKL
Paper
C18 H21 N3 O5P 1 21/c 17.5174; 7.9761; 29.86
90; 97.322; 90
1775.8Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher
Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 1779-1793
2243652 CIF
HKL
Paper
C18 H23 N3 O3P 1 21/c 114.922; 7.6951; 15.56
90; 106.911; 90
1709.4Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher
Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 1779-1793
2243651 CIF
HKL
Paper
C19 H24 N2 O3P -17.826; 10.32; 12.055
78.37; 78.27; 73.83
904.6Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher
Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 1779-1793
2243650 CIF
HKL
Paper
C18 H21 I N2 O3P 21 21 217.0101; 13.3796; 19.5524
90; 90; 90
1833.87Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher
Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 1779-1793
2243649 CIF
HKL
Paper
C18 H21 Br N2 O3P 21 21 216.9824; 13.2292; 19.4903
90; 90; 90
1800.35Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher
Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 1779-1793
2243648 CIF
HKL
Paper
C18 H21 Cl N2 O3P 1 21/c 17.9974; 27.611; 8.5972
90; 106.4; 90
1821.2Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher
Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 1779-1793
2243647 CIF
HKL
Paper
C18 H21 F N2 O3C 1 c 119.94; 10.2705; 9.0148
90; 109.663; 90
1738.5Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher
Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 1779-1793
2243646 CIF
HKL
Paper
C18 H21 I N2 O3P -17.1129; 11.2722; 12.5923
69.852; 74.681; 79.121
908.82Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher
Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 1779-1793
2243645 CIF
HKL
Paper
C18 H21 Br N2 O3P -17.4313; 7.9163; 15.5212
101.565; 94.78; 92.691
889.54Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher
Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 1779-1793
2243644 CIF
HKL
Paper
C18 H21 Cl N2 O3P -17.401; 7.888; 15.41
100.28; 94.4; 94.14
879.2Harish Chinthal, Chayanna; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Rathore, Ravindranath S.; Glidewell, Christopher
Fifteen 4-(2-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in zero, one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 1779-1793
2243643 CIF
HKL
Paper
C24 H20 N10 NiP -17.1046; 9.1467; 9.3833
100.182; 98.729; 97.444
585.49Setifi, Zouaoui; Ferjani, Hela; Setifi, Fatima; Ezzine, Safa; Al-Douh, Mohammed Hadi
Synthesis, crystal structure and Hirshfeld surface analysis of bis{2-[(pyridin-2-yl)amino]pyridinium} tetracyanonickelate(II)
Acta Crystallographica Section E, 2020, 76, 1794-1798
2243642 CIF
HKL
Paper
C21 H17 N3 O5P 1 21 17.2948; 7.1242; 16.8297
90; 97.644; 90
866.86Moreno-Fuquen, Rodolfo; Hurtado-Angulo, Mario; Arango-Daraviña, Kevin; Bain, Gavin; Kennedy, Alan R.
Synthesis, crystal structure, Hirshfeld surface analysis, MEP study and molecular docking of <i>N</i>-{3-[(4-methoxyphenyl)carbamoyl]phenyl}-3-nitrobenzamide as a promising inhibitor of hfXa
Acta Crystallographica Section E, 2020, 76, 1762-1767
2243641 CIF
HKL
Paper
C26 H24 Au2 Br2 P2 S2C 1 2/c 121.4112; 11.9708; 13.7726
90; 128.316; 90
2769.7Taouss, Christina; Calvo, Marina; Jones, Peter G.
Crystal structure of the unusual coordination polymer <i>catena</i>-poly[[gold(I)-μ-1,2-bis(diphenylphosphinothioyl)ethane-κ^2^<i>S</i>:<i>S</i>'] dibromidoaurate(I)]
Acta Crystallographica Section E, 2020, 76, 1768-1770
2243640 CIF
HKL
Paper
C13 H18 Cl2 Cu N2 OC 1 2/c 114.4554; 8.5865; 24.8055
90; 99.209; 90
3039.21Reddy, J. Prakasha
Crystal structure and Hirshfeld surface analysis of dichlorido(methanol-κ<i>O</i>)bis(2-methylpyridine-κ<i>N</i>)copper(II)
Acta Crystallographica Section E, 2020, 76, 1771-1774
2243639 CIF
HKL
Paper
C25 H29 Br N2 Ni OP 1 21/c 19.7626; 10.9008; 22.0679
90; 98.0315; 90
2325.43O'Brien, Patrick; Zeller, Matthias; Lee, Wei-Tsung
Crystal structure of (2-{[(8-aminonaphthalen-1-yl)imino]methyl}-4,6-di-<i>tert</i>-butylphenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>)bromidonickel(II)
Acta Crystallographica Section E, 2018, 74, 469-473
2243638 CIF
HKL
Paper
C116 H200 Lu2 O24 P6P -114.8828; 19.983; 22.392
80.469; 87.417; 74.798
6337.7Minyaev, Mikhail E.; Tavtorkin, Alexander N.; Korchagina, Sof'ya A.; Nifant'ev, Ilya E.; Churakov, Andrei V.
Crystal structure and catalytic activity of tetrakis(μ~2~-ethyl 2,6-di-<i>tert</i>-butyl-4-methylphenyl phosphato-κ^2^<i>O</i>:<i>O</i>')bis(ethyl 2,6-di-<i>tert</i>-butyl-4-methylphenyl phosphato-κ^2^<i>O</i>,<i>O</i>')dilutetium <i>n</i>-heptane disolvate
Acta Crystallographica Section E, 2018, 74, 543-547
2243637 CIF
HKL
Paper
C16 H32 I2 N2 O8 SnP 1 21/c 19.8129; 18.3694; 14.7122
90; 99.769; 90
2613.5Sarr, Bougar; Diop, Cheikh Abdoul Khadir; Sidibé, Mamadou; Rousselin, Yoann
Crystal structure of bis(diisopropylammonium) <i>cis</i>-diiodidobis(oxolato-κ^2^<i>O</i>^1^,<i>O</i>^2^)stannate(IV)
Acta Crystallographica Section E, 2018, 74, 502-504
2243636 CIF
HKL
Paper
C26 H39 Cl3 Dy N5 O8P -18.9852; 12.6242; 14.3887
87.062; 88.81; 82.068
1614.2Kachi-Terajima, Chihiro; Kimura, Norihisa
Crystal structures of two isotypic lanthanide(III) complexes: triaqua[2,6-diacetylpyridine bis(benzoylhydrazone)]methanollanthanide(III) trichloride methanol disolvates (<i>Ln</i>^III^ = Tb and Dy)
Acta Crystallographica Section E, 2018, 74, 535-538
2243635 CIF
HKL
Paper
C26 H39 Cl3 N5 O8 TbP -18.9703; 12.6433; 14.4233
87.004; 88.752; 81.98
1617.4Kachi-Terajima, Chihiro; Kimura, Norihisa
Crystal structures of two isotypic lanthanide(III) complexes: triaqua[2,6-diacetylpyridine bis(benzoylhydrazone)]methanollanthanide(III) trichloride methanol disolvates (<i>Ln</i>^III^ = Tb and Dy)
Acta Crystallographica Section E, 2018, 74, 535-538
2243634 CIF
HKL
C41 H75 Al O2 Si2 ZrP 1 21/n 111.5404; 16.5073; 22.9519
90; 95.0206; 90
4355.58Burlakov, Vladimir V.; Bogdanov, Vyacheslav S.; Arndt, Perdita; Spannenberg, Anke; Rosenthal, Uwe; Beweries, Torsten; Shur, Vladimir B.
Synthesis and crystallographic characterization of [2,2-bis(η^5^-pentamethylcyclopentadienyl)-3,4-bis(trimethylsilyl)-2-zirconafuran-5-one-κ<i>O</i>^5^]triisobutylaluminium
Acta Crystallographica Section E, 2018, 74, 566-568
2243633 CIF
HKL
Paper
C11 H12 Cl Mn N5 O4P -16.9698; 10.6055; 10.8476
98.784; 97.636; 108.308
738.21Sarr, Mamour; Diop, Mayoro; Thiam, Elhadj Ibrahima; Barry, Aliou Hamady; Gaye, Mohamed; Retailleau, Pascal
Crystal structure of aquachlorido(nitrato-κ^2^<i>O</i>,<i>O</i>')[1-(pyridin-2-yl-κ<i>N</i>)-2-(pyridin-2-ylmethylidene-κ<i>N</i>)hydrazine-κ<i>N</i>^2^]manganase(II)
Acta Crystallographica Section E, 2018, 74, 450-453
2243632 CIF
HKL
Paper
C10 H8 Hg I2 N2 O2 S2P 1 21/n 17.4207; 18.7599; 11.6463
90; 100.887; 90
1592.12Seidel, Rüdiger W.; Oppel, Iris M.
Crystal structure of <i>catena</i>-poly[[diiodidomercury(II)]-μ-2,2'-dithiobis(pyridine <i>N</i>-oxide)-κ^2^<i>O</i>:<i>O</i>']
Acta Crystallographica Section E, 2018, 74, 433-435
2243631 CIF
HKL
Paper
C24 H46 Ag N8 O8P -18.346; 9.2874; 10.171
104.32; 90.28; 109.6
716.3Moon, Dohyun; Choi, Jong-Ha
Crystal structure of [2,13-bis(acetamido)-5,16-dimethyl-2,6,13,17-tetraazatricyclo[16.4.0.0^7,12^]docosane-κ^4^<i>N</i>]silver(II) dinitrate from synchrotron X-ray data
Acta Crystallographica Section E, 2018, 74, 461-464
2243630 CIF
HKL
C26 H18 Cu F2 N6 O4C 1 2/c 119.9709; 7.2155; 17.1989
90; 98.579; 90
2450.6de Melo, Ana Paula Lopes; Bresolin, Leandro; Martins, Bianca Barreto; Gervini, Vanessa Carratu; de Oliveira, Adriano Bof
Crystal structure and Hirshfeld analysis of <i>trans</i>-bis(5-fluoroindoline-2,3-dione 3-oximato-κ^2^<i>O</i>^2^,<i>N</i>^3^)-<i>trans</i>-bis(pyridine-κ<i>N</i>)copper(II)
Acta Crystallographica Section E, 2018, 74, 428-432
2243629 CIF
HKL
Paper
C7 H6 F3 N O3P 1 21/c 18.9213; 10.0759; 9.101
90; 99.983; 90
805.7Ye, Naike; Tanski, Joseph M.
The crystal structure of 5-(trifluoromethyl)picolinic acid monohydrate reveals a water-bridged hydrogen-bonding network
Acta Crystallographica Section E, 2020, 76, 1752-1756
2243628 CIF
HKL
Paper
C19 H29 Cl2 Co N7 O S2C 1 2/c 126.3412; 11.427; 8.6226
90; 90.465; 90
2595.32Miecznikowski, John R.; Jasinski, Jerry P.; Ostrowski, Tyler J.; Landy, Kendra R.; Bonitatibus, Sheila C.; Smolinsky, Allison N.; Bertolotti, Natalia R.
Crystal structure and spectroscopic properties of aquadichlorido{1,1'-[(pyridine-2,6-diyl-κ<i>N</i>)bis(methylene)]bis(4-butyl-4,5-dihydro-1<i>H</i>-1,2,4-triazole-5-thione-κ<i>N</i>^2^)}cobalt(II)
Acta Crystallographica Section E, 2020, 76, 1757-1761
2243627 CIF
HKL
Paper
C19 H18 O7P -15.0789; 8.0801; 20.8682
92.481; 91.984; 94.253
852.62Aisa, Haji Akber; Izotova, Lidiya; Karimov, Abdurashid; Botirov, Erkin; Mamadrahimov, Azimjon; Ibragimov, Bahtiyar
Crystal, molecular structure and Hirshheld surface analysis of 5-hydroxy-3,6,7,8-tetramethoxyflavone
Acta Crystallographica Section E, 2020, 76, 1748-1751
2243626 CIF
HKL
C49 H50 N4 NiP -111.2735; 14.1802; 14.688
67.162; 68.881; 80.665
2017.9Dias, H. V. Rasika; Pramanik, Abhijit
Nickel(II) carbonyl, ammonia, and acetonitrile complexes supported by a pyridine dipyrrolide pincer ligand
Acta Crystallographica Section E, 2020, 76, 1741-1747
2243625 CIF
HKL
C41 H36 N4 NiP 1 21/c 115.9773; 14.9441; 14.3238
90; 107.814; 90
3256.1Dias, H. V. Rasika; Pramanik, Abhijit
Nickel(II) carbonyl, ammonia, and acetonitrile complexes supported by a pyridine dipyrrolide pincer ligand
Acta Crystallographica Section E, 2020, 76, 1741-1747
2243624 CIF
HKL
C42 H33 N3 Ni OP 1 21/m 16.6482; 27.1709; 9.1322
90; 101.07; 90
1618.92Dias, H. V. Rasika; Pramanik, Abhijit
Nickel(II) carbonyl, ammonia, and acetonitrile complexes supported by a pyridine dipyrrolide pincer ligand
Acta Crystallographica Section E, 2020, 76, 1741-1747
2243623 CIF
HKL
Paper
C41 H35 N3P 1 21/c 114.894; 35.155; 5.9513
90; 100.987; 90
3059Dias, H. V. Rasika; Pramanik, Abhijit
Nickel(II) carbonyl, ammonia, and acetonitrile complexes supported by a pyridine dipyrrolide pincer ligand
Acta Crystallographica Section E, 2020, 76, 1741-1747
2243622 CIF
HKL
Paper
C24 H57.53 Cr2 N26 Ni2 O42.76P 1 21/n 19.8065; 16.6719; 37.2296
90; 95.562; 90
6058.1Mbiangué, Yves Alain; Bijvédé, Alfred; Kenfack Tsobnang, Patrice; Wenger, Emmanuel; Lecomte, Claude
Crystal structure of diammonium bis[tris(oxamide dioxime-κ^2^<i>N</i>,<i>N</i>')nickel(II)] bis[tris(oxalato-κ^2^<i>O</i>,<i>O</i>')chromate(III)] 6.76-hydrate
Acta Crystallographica Section E, 2020, 76, 1732-1736
2243621 CIF
Paper
C13 H11 Cl O3P 1 21/n 18.79348; 27.8665; 10.2288
90; 112.393; 90
2317.49Meesakul, Pornphimol; Richardson, Christopher; Laphookhieo, Surat; Pyne, Stephen G.
Synthesis and crystal structure of (±)-Goniotamirenone C
Acta Crystallographica Section E, 2020, 76, 1728-1731
2243620 CIF
HKL
Paper
C17 H16 Au N7 O4P 1 21/c 17.0788; 24.6279; 10.584
90; 91.059; 90
1844.9Levchenko, Volodymyr; Øien-Ødegaard, Sigurd; Wragg, David; Tilset, Mats
Crystal structure of (N^C) cyclometalated Au^III^ diazide at 100K
Acta Crystallographica Section E, 2020, 76, 1725-1727
2243619 CIF
HKL
Paper
C15 H19 N O3F d d 231.9834; 27.7358; 6.661
90; 90; 90
5908.9Koizumi, Take-aki; Takata, Toshikazu
Crystal structure of 2,6-bis(3-hydroxy-3-methylbut-1-yn-1-yl)pyridine monohydrate
Acta Crystallographica Section E, 2020, 76, 1737-1740
2243618 CIF
HKL
Paper
Cl3 Mg TlP 63/m m c7.0228; 7.0228; 17.4934
90; 90; 120
747.18Onken, Drew R.; Perrodin, Didier; Vogel, Sven C.; Bourret, Edith D.; Moretti, Federico
The crystal structure of TlMgCl~3~ from 290K to 725K
Acta Crystallographica Section E, 2020, 76, 1716-1719
2243617 CIF
HKL
Paper
C20 H32 Cu2 N6 S4P 1 21/c 113.9881; 9.822; 9.7446
90; 91.391; 90
1338.43Tanaka, Takeshi; Kashiwagi, Yukiyasu; Nakagawa, Masami
Crystal structure of bis[μ-<i>N</i>-(η^2^-prop-2-en-1-yl)piperidine-1-carbothioamide-κ^2^<i>S</i>:<i>S</i>]bis[(thiocyanato-κ<i>N</i>)copper(I)]
Acta Crystallographica Section E, 2020, 76, 1712-1715
2243616 CIF
HKL
Paper
Al0.4 Ba1.8 Ce0.2 Lu2 N13.8 O0.2 Si7.6P 63 m c6.0378; 6.0378; 9.8133
90; 90; 120
309.82Simura, Rayko; Yamane, Hisanori
Lu-atom-ordered oxonitridoaluminosilicate Ba~0.9~Ce~0.1~LuAl~0.2~Si~3.8~N~6.9~O~0.1~
Acta Crystallographica Section E, 2020, 76, 1708-1711
2243615 CIF
HKL
Paper
C40 H56 Mn4 N4 Ni O25P -110.3647; 10.7781; 11.8303
85.318; 86.231; 77.583
1284.79Hall, Abigail J.; Zeller, Matthias; Zaleski, Curtis M.
Synthesis and crystal structure of a heterobimetallic nickel‒manganese 12-metallacrown-4 methanol disolvate monohydrate compound
Acta Crystallographica Section E, 2020, 76, 1720-1724
2243614 CIF
HKL
Paper
C20 H25 Br N4 O SP 1 21/c 18.4326; 31.778; 8.468
90; 110.052; 90
2131.6Duruskari, Gulnara Sh.; Khalilov, Ali N.; Mammadova, Gunay Z.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Akobirshoeva, Anzurat A.; Maharramov, Abel M.
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-3-[(4-methylbenzylidene)amino]-5-phenylthiazolidin-2-iminium bromide <i>N</i>,<i>N</i>-dimethylformamide monosolvate
Acta Crystallographica Section E, 2020, 76, 1694-1698
2243613 CIF
HKL
C17 H24 N4 O5 Pt S2P -16.5264; 8.9024; 18.9261
82.228; 87.074; 74.739
1050.96Arafath, Md. Azharul; Kwong, Huey Chong; Adam, Farook
The crystal structure of ((cyclohexylamino){(<i>Z</i>)-2-[(<i>E</i>)-5-methoxy-3-nitro-2-oxidobenzylidene-κ<i>O</i>]hydrazin-1-ylidene-κ<i>N</i>^2^}methanethiolato-κ<i>S</i>)(dimethyl sulfoxide-κ<i>S</i>)platinum(II): a supramolecular two-dimensional network
Acta Crystallographica Section E, 2019, 75, 1486-1489
2243612 CIF
HKL
Paper
F6 H10 N4 SiP 1 21/n 15.9496; 5.2484; 11.0029
90; 100.245; 90
338.1Ouasri, Ali; Lambarki, Fatima; Rhandour, Ali; Saadi, Mohamed; El Ammari, Lahcen
Crystal structure and Hirshfeld surface analysis of bis[hydrazinium(1+)] hexafluoridosilicate: (N~2~H~5~)~2~SiF~6~
Acta Crystallographica Section E, 2019, 75, 1507-1510
2243611 CIF
HKL
Paper
Ba Cu2.6 Zn2.4P n m a12.9858; 5.2162; 6.6804
90; 90; 90
452.507Simura, Rayko; Yamane, Hisanori
α-SrZn~5~-Type solid solution, BaZn~2.6~Cu~2.4~
Acta Crystallographica Section E, 2019, 75, 1490-1493
2243610 CIF
HKL
Paper
C67 H54 N4 O5 ZnP 1 21/c 127.2823; 19.7693; 9.9674
90; 94.614; 90
5358.5Kashiwagi, Yukiyasu; Kubono, Koji; Tamai, Toshiyuki
Crystal structure of <i>catena</i>-poly[[[bis(3-oxo-1,3-diphenylprop-1-enolato-κ^2^<i>O</i>,<i>O</i>')zinc(II)]-μ~2~-tris[4-(pyridin-3-yl)phenyl]amine-κ^2^<i>N</i>:<i>N</i>'] tetrahydrofuran monosolvate]
Acta Crystallographica Section E, 2019, 75, 1432-1435
2243609 CIF
HKL
Paper
C26 H22 Cd N8 O6C 1 2/c 114.6899; 15.025; 12.2269
90; 106.843; 90
2582.9Kim, Yongtae; Kang, Sung Kwon
Crystal structure of bis[2-(1<i>H</i>-benzimidazol-2-yl-κ<i>N</i>^3^)aniline-κ<i>N</i>]bis(nitrato-κ<i>O</i>)cadmium(II)
Acta Crystallographica Section E, 2019, 75, 1463-1466
2243608 CIF
HKL
Paper
C79 H14 S3P 1 21 110.0139; 17.4327; 13.0286
90; 108.816; 90
2152.8Qin, Qian; Mague, Joel T.; Gould, Haley E.; Vasquez, Samuel E.; Heyer, Anthony E.
Crystal structures of two charge‒transfer complexes of benzo[1,2-<i>c</i>:3,4-<i>c</i>':5,6-<i>c</i>'']trithiophene (<i>D</i>~3<i>h~</i>-BTT)
Acta Crystallographica Section E, 2019, 75, 1573-1577
2243607 CIF
HKL
Paper
C24 H10 N4 S3P 1 21/n 114.2567; 39.028; 15.2295
90; 100.136; 90
8341.6Qin, Qian; Mague, Joel T.; Gould, Haley E.; Vasquez, Samuel E.; Heyer, Anthony E.
Crystal structures of two charge‒transfer complexes of benzo[1,2-<i>c</i>:3,4-<i>c</i>':5,6-<i>c</i>'']trithiophene (<i>D</i>~3<i>h~</i>-BTT)
Acta Crystallographica Section E, 2019, 75, 1573-1577
2243606 CIF
HKL
Paper
C10 H20 N2 O8 P2 ZnP 1 21/n 18.8455; 16.4492; 11.2721
90; 97.338; 90
1626.67Soriano, Josemaria S.; Galeas, Bryan E.; Garrett, Paul; Flores, Ryan A.; Pinedo, Juan L.; Kohlgruber, Tsuyoshi A.; Felton, Daniel; Adelani, Pius O.
<i>In situ</i> decarbonylation of <i>N</i>,<i>N</i>-dimethylformamide to form dimethylammonium cations in the hybrid framework compound {[(CH~3~)~2~NH~2~]~2~[Zn{O~3~PC~6~H~2~(OH)~2~PO~3~}]}~<i>n~</i>
Acta Crystallographica Section E, 2019, 75, 1540-1543
2243605 CIF
HKL
Paper
C36 H55 N5 O2P -112.1169; 13.238; 13.6258
68.373; 79.379; 67.392
1873.32Stapf, Manuel; Seichter, Wilhelm; Mazik, Monika
Crystal structures of monohydrate and methanol solvate compounds of {1-[(3,5-bis{[(4,6-dimethylpyridin-2-yl)amino]methyl}-2,4,6-triethylbenzyl)amino]cyclopentyl}methanol
Acta Crystallographica Section E, 2020, 76, 1679-1683
2243604 CIF
HKL
Paper
C35 H53 N5 O2P 1 21/c 113.2239; 15.3576; 17.1061
90; 107.029; 90
3321.7Stapf, Manuel; Seichter, Wilhelm; Mazik, Monika
Crystal structures of monohydrate and methanol solvate compounds of {1-[(3,5-bis{[(4,6-dimethylpyridin-2-yl)amino]methyl}-2,4,6-triethylbenzyl)amino]cyclopentyl}methanol
Acta Crystallographica Section E, 2020, 76, 1679-1683
2243603 CIF
Paper
C52 H60.5 N6 O10.25C 1 2 127.505; 12.3814; 14.6346
90; 99.999; 90
4908.1Nguyen, Xuan Tu; Le, Thuy Quynh; Bui Thi, Tra My; Mac, Dinh Hung; Bui, Thai Thanh Thu
Synthesis and crystal structure of peptide dimethyl biphenyl hybrid C~52~H~60~N~6~O~10~·0.25H~2~O
Acta Crystallographica Section E, 2020, 76, 1675-1678
2243602 CIF
HKL
Paper
C8 H24 Ca0.794 O9 Sr0.206P b c a6.7153; 19.6061; 23.3498
90; 90; 90
3074.3Samolová, Erika; Fábry, Jan
Crystal structures of <i>catena</i>-poly[[μ-aqua-diaqua(μ~3~-2-methylpropanoato-κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>')calcium] 2-methylpropanoate dihydrate], <i>catena</i>-poly[[μ-aqua-diaqua(μ~3~-2-methylpropanoato-κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>')strontium] 2-methylpropanoate dihydrate] and <i>catena</i>-poly[[μ-aqua-diaqua(μ~3~-2-methylpropanoato-κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>')(calcium/strontium)] 2-methylpropanoate dihydrate]
Acta Crystallographica Section E, 2020, 76, 1684-1688
2243601 CIF
HKL
Paper
C8 H24 O9 SrC m c e6.8801; 19.752; 23.2734
90; 90; 90
3162.8Samolová, Erika; Fábry, Jan
Crystal structures of <i>catena</i>-poly[[μ-aqua-diaqua(μ~3~-2-methylpropanoato-κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>')calcium] 2-methylpropanoate dihydrate], <i>catena</i>-poly[[μ-aqua-diaqua(μ~3~-2-methylpropanoato-κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>')strontium] 2-methylpropanoate dihydrate] and <i>catena</i>-poly[[μ-aqua-diaqua(μ~3~-2-methylpropanoato-κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>')(calcium/strontium)] 2-methylpropanoate dihydrate]
Acta Crystallographica Section E, 2020, 76, 1684-1688
2243600 CIF
HKL
Paper
C8 H24 Ca O9P b c a6.6662; 19.5903; 23.4286
90; 90; 90
3059.61Samolová, Erika; Fábry, Jan
Crystal structures of <i>catena</i>-poly[[μ-aqua-diaqua(μ~3~-2-methylpropanoato-κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>')calcium] 2-methylpropanoate dihydrate], <i>catena</i>-poly[[μ-aqua-diaqua(μ~3~-2-methylpropanoato-κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>')strontium] 2-methylpropanoate dihydrate] and <i>catena</i>-poly[[μ-aqua-diaqua(μ~3~-2-methylpropanoato-κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>')(calcium/strontium)] 2-methylpropanoate dihydrate]
Acta Crystallographica Section E, 2020, 76, 1684-1688
2243599 CIF
HKL
Paper
C27 H28 Fe N10 S2P -18.9656; 12.506; 14.2311
67.552; 85.106; 84.087
1465.06Znovjyak, Kateryna; Seredyuk, Maksym; Malinkin, Sergey O.; Shova, Sergiu; Soliev, Lutfullo
Crystal structure of {<i>N</i>^1^,<i>N</i>^3^-bis[(1-benzyl-1<i>H</i>-1,2,3-triazol-4-yl)methylidene]-2,2-dimethylpropane-1,3-diamine}bis(thiocyanato-κ<i>N</i>)iron(II)
Acta Crystallographica Section E, 2020, 76, 1661-1664
2243598 CIF
HKL
Paper
C8 H16 K2 O5C 1 2/c 111.919; 4.5454; 24.3172
90; 97.517; 90
1306.1Fábry, Jan; Samolová, Erika
Crystal structure of poly[μ-aqua-bis(μ~3~-2-methylpropanoato-κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>')dipotassium]
Acta Crystallographica Section E, 2020, 76, 1669-1674
2243597 CIF
HKL
Paper
C9 H15 N3 O5P 1 21 15.7615; 9.7752; 10.6833
90; 101.255; 90
590.11Wood, Adam; Bernhardt, Paul V.; van Altena, Ian; Simone, Michela I.
Crystal structure of 6-azido-6-deoxy-1,2-<i>O</i>-isopropylidene-α-<small>D</small>-glucofuranose
Acta Crystallographica Section E, 2020, 76, 1653-1656
2243596 CIF
HKL
Paper
C10 H8 Cl N O5 SP 1 21/n 111.153; 6.8926; 14.6
90; 97.528; 90
1112.7Shishkina, Svitlana V.; Petrushova, Lidiya A.; Burian, Kateryna O.; Fedosov, Andrii I.; Ukrainets, Igor V.
Methyl 5-chloro-4-hydroxy-2,2-dioxo-1<i>H</i>-2λ^6^,1-benzothiazine-3-carboxylate: structure and Hirshfeld surface analysis
Acta Crystallographica Section E, 2020, 76, 1657-1660
2243595 CIF
HKL
Paper
C48 H33 NP -110.0952; 13.0135; 13.5643
74.429; 75.671; 78.309
1645.39Yano, Masafumi; Kashiwagi, Yukiyasu; Inada, Yoshinori; Hayashi, Yuki; Mitsudo, Koichi; Kubono, Koji
Crystal structure of tris[4-(naphthalen-1-yl)phenyl]amine
Acta Crystallographica Section E, 2020, 76, 1649-1652
2243594 CIF
HKL
Paper
C32 H27 Cl N8 O12P 1 21/n 17.4102; 24.629; 18.446
90; 98.478; 90
3329.7Shaibah, Mohammed A. E.; Kavitha, Channappa N.; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
A very short O—H···O hydrogen bond in the structure of clozapinium hydrogen bis(3,5-dinitrobenzoate)
Acta Crystallographica Section E, 2020, 76, 1629-1633
2243593 CIF
HKL
Paper
Hf1.5 K2 Ni0.5 O12 P3P 21 310.12201; 10.12201; 10.12201
90; 90; 90
1037.05Zhou, Liang; Butenko, Denys S.; Ogorodnyk, Ivan V.; Klyui, Nickolai I.; Zatovsky, Igor V.
Rietveld refinement of the langbeinite-type phosphate K~2~Ni~0.5~Hf~1.5~(PO~4~)~3~
Acta Crystallographica Section E, 2020, 76, 1634-1637
2243592 CIF
HKL
Paper
C22 H45 Br2 Cu3 N6 O7.5I 1 2/a 114.493; 8.8855; 26.6017
90; 103.998; 90
3324Vynohradov, Oleksandr S.; Pavlenko, Vadim A.; Naumova, Dina D.; Partsevska, Sofiia V.; Shova, Sergiu; Safarmamadov, Safarmamad M.
Crystal structure of bis{μ-2-[bis(2-hydroxyethyl)amino]ethanolato}bis(μ-3,5-dimethylpyrazolato)tricopper(II) dibromide sesquihydrate
Acta Crystallographica Section E, 2020, 76, 1641-1644
2243591 CIF
HKL
C6 H11 N7 O3P 1 21/c 14.6928; 9.3881; 22.918
90; 91.646; 90
1009.3Sigdel Regmi, Bhawani; Apblett, Allen; Powell, Douglas
Crystal structure of melaminium cyanoacetate monohydrate
Acta Crystallographica Section E, 2020, 76, 1645-1648
2243590 CIF
HKL
Paper
I O Tl3P 63/m m c7.1512; 7.1512; 6.3639
90; 90; 120
281.85Albrecht, Ralf; Menning, Heinrich; Doert, Thomas; Ruck, Michael
Hydroflux synthesis and crystal structure of Tl~3~IO
Acta Crystallographica Section E, 2020, 76, 1638-1640
2243589 CIF
HKL
Paper
C20 H26 Cl2 O4 TiC 1 2/c 129.3802; 10.8106; 13.6002
90; 91.214; 90
4318.7McCarthy, Jackson S.; McMillen, Colin D.; Pienkos, Jared A.; Wagenknecht, Paul S.
Synthesis and characterization of a <i>tert-</i>butyl ester-substituted titanocene dichloride: ^<i>t^-BuOOC</i>Cp~2~TiCl~2~
Acta Crystallographica Section E, 2020, 76, 1562-1565
2243588 CIF
HKL
Paper
C4 H4 Cl2 N2 O3C 1 2/c 119.9042; 6.6243; 10.5636
90; 90.819; 90
1392.68Novikov, Anton P.; Ryagin, Sergey N.; Grigoriev, Mikhail S.; Safonov, Alexey V.; German, Konstantin E.
5,5-Dichloro-6-hydroxydihydropyrimidine-2,4(1<i>H</i>,3<i>H</i>)-dione: molecular and crystal structure, Hirshfeld surface analysis and the new route for synthesis with Mg(ReO~4~)~2~ as a new catalyst
Acta Crystallographica Section E, 2020, 76, 1557-1561
2243587 CIFC6 H7 K O8 Rb2P 1 21/n 17.350692; 11.846841; 13.227549
90; 98.1091; 90
1140.37Cigler, Andrew J.; Kaduk, James A.
Structures of dipotassium rubidium citrate monohydrate, K~2~RbC~6~H~5~O~7~(H~2~O), and potassium dirubidium citrate monohydrate, KRb~2~C~6~H~5~O~7~(H~2~O), from laboratory X-ray powder diffraction data and DFT calculations
Acta Crystallographica Section E, 2020, 76, 1566-1571
2243586 CIFC6 H7 K O8 Rb2P 1 21/n 17.350692; 11.846841; 13.227549
90; 98.1091; 90
1140.37Cigler, Andrew J.; Kaduk, James A.
Structures of dipotassium rubidium citrate monohydrate, K~2~RbC~6~H~5~O~7~(H~2~O), and potassium dirubidium citrate monohydrate, KRb~2~C~6~H~5~O~7~(H~2~O), from laboratory X-ray powder diffraction data and DFT calculations
Acta Crystallographica Section E, 2020, 76, 1566-1571
2243585 CIFC6 H7 K O8 Rb2P 1 21/n 17.350692; 11.846841; 13.227547
90; 98.1091; 90
1140.37Cigler, Andrew J.; Kaduk, James A.
Structures of dipotassium rubidium citrate monohydrate, K~2~RbC~6~H~5~O~7~(H~2~O), and potassium dirubidium citrate monohydrate, KRb~2~C~6~H~5~O~7~(H~2~O), from laboratory X-ray powder diffraction data and DFT calculations
Acta Crystallographica Section E, 2020, 76, 1566-1571
2243584 CIFC6 H7 K1.37 O8 Rb1.63P 1 21/n 17.3507; 11.8468; 13.2275
90; 98.109; 90
1140.36Cigler, Andrew J.; Kaduk, James A.
Structures of dipotassium rubidium citrate monohydrate, K~2~RbC~6~H~5~O~7~(H~2~O), and potassium dirubidium citrate monohydrate, KRb~2~C~6~H~5~O~7~(H~2~O), from laboratory X-ray powder diffraction data and DFT calculations
Acta Crystallographica Section E, 2020, 76, 1566-1571
2243583 CIFC6 H7 K2 O8 RbP 1 21/n 17.2407; 11.81851; 13.06177
90; 98.334; 90
1105.95Cigler, Andrew J.; Kaduk, James A.
Structures of dipotassium rubidium citrate monohydrate, K~2~RbC~6~H~5~O~7~(H~2~O), and potassium dirubidium citrate monohydrate, KRb~2~C~6~H~5~O~7~(H~2~O), from laboratory X-ray powder diffraction data and DFT calculations
Acta Crystallographica Section E, 2020, 76, 1566-1571
2243582 CIFC6 H7 K2 O8 RbP 1 21/n 17.2407; 11.81851; 13.06177
90; 98.334; 90
1105.95Cigler, Andrew J.; Kaduk, James A.
Structures of dipotassium rubidium citrate monohydrate, K~2~RbC~6~H~5~O~7~(H~2~O), and potassium dirubidium citrate monohydrate, KRb~2~C~6~H~5~O~7~(H~2~O), from laboratory X-ray powder diffraction data and DFT calculations
Acta Crystallographica Section E, 2020, 76, 1566-1571
2243581 CIFC6 H7 K2 O8 RbP 1 21/n 17.2407; 11.8185; 13.0617
90; 98.334; 90
1105.94Cigler, Andrew J.; Kaduk, James A.
Structures of dipotassium rubidium citrate monohydrate, K~2~RbC~6~H~5~O~7~(H~2~O), and potassium dirubidium citrate monohydrate, KRb~2~C~6~H~5~O~7~(H~2~O), from laboratory X-ray powder diffraction data and DFT calculations
Acta Crystallographica Section E, 2020, 76, 1566-1571
2243580 CIF
Paper
C6 H7 K2.108 O8 Rb0.892P 1 21/n 17.2407; 11.8145; 13.062
90; 98.334; 90
1105.6Cigler, Andrew J.; Kaduk, James A.
Structures of dipotassium rubidium citrate monohydrate, K~2~RbC~6~H~5~O~7~(H~2~O), and potassium dirubidium citrate monohydrate, KRb~2~C~6~H~5~O~7~(H~2~O), from laboratory X-ray powder diffraction data and DFT calculations
Acta Crystallographica Section E, 2020, 76, 1566-1571
2243579 CIF
HKL
C53 H36 Cl2 N2 O2P 1 21/c 113.307; 9.1782; 32.2298
90; 100.251; 90
3873.5Wodajo, Ayalew; Tskhovrebov, Alexander G.; Le, Tuan Anh; Kubasov, Alexey S.; Grishina, Maria M.; Krutius, Oleg N.; Khrustalev, Victor N.
Crystal structure of 1,1'-{(1<i>E</i>,1'<i>E</i>)-[4,4'-(9<i>H</i>-fluorene-9,9-diyl)bis(4,1-phenylene)]bis(azanylylidene)bis(methanylylidene)}bis(naphthalen-2-ol) dichlorobenzene monosolvate
Acta Crystallographica Section E, 2020, 76, 1579-1581
2243578 CIF
Paper
C13 H34 Br6 Cl2 N2 UP 1 21/n 110.7318; 17.4541; 15.0082
90; 92.055; 90
2809.44Deubner, Holger Lars; Koester, Marcel; von Haenisch, Carsten; Kraus, Florian
Synthesis and crystal structure of triethylammonium hexabromidouranate(IV) dichloromethane monosolvate
Acta Crystallographica Section E, 2020, 76, 1587-1590
2243577 CIF
HKL
Paper
C34 H30 N2 O3P 1 21/c 19.5632; 17.8067; 16.1958
90; 103.463; 90
2682.18Selvaraj, Janet Priyavathani; Mary, Stella; Dhruba, Jyoti Boruah; Huidrom, Birkumar Singh; Panneerselvam, Yuvaraj; Piskala Subburaman, Kannan
Crystal structure of (1'<i>S</i>,2'<i>S</i>,3<i>S</i>)-1'-benzoyl-2'-(4-methoxyphenyl)-1-methyl-2',5',6',10b'-tetrahydro-1'<i>H</i>-spiro[indoline-3,3'-pyrrolo[2,1-<i>a</i>]isoquinolin]-2-one
Acta Crystallographica Section E, 2020, 76, 1548-1550
2243576 CIF
HKL
Paper
C17 H16 N2 O3P 1 21/n 17.7552; 15.6998; 12.0525
90; 100.668; 90
1442.09Hall, Charlie L.; Hamilton, Victoria; Potticary, Jason; Cremeens, Matthew E.; Pridmore, Natalie E.; Sparkes, Hazel A.; D'ambruoso, Gemma D.; Warren, Stephen D.; Matsumoto, Masaomi; Hall, Simon R.
Crystal structures of three functionalized chalcones: 4'-dimethylamino-3-nitrochalcone, 3-dimethylamino-3'-nitrochalcone and 3'-nitrochalcone
Acta Crystallographica Section E, 2020, 76, 1599-1604
2243575 CIF
HKL
Paper
C17 H16 N2 O3P 1 21/c 117.3171; 7.0708; 11.3487
90; 90.761; 90
1389.48Hall, Charlie L.; Hamilton, Victoria; Potticary, Jason; Cremeens, Matthew E.; Pridmore, Natalie E.; Sparkes, Hazel A.; D'ambruoso, Gemma D.; Warren, Stephen D.; Matsumoto, Masaomi; Hall, Simon R.
Crystal structures of three functionalized chalcones: 4'-dimethylamino-3-nitrochalcone, 3-dimethylamino-3'-nitrochalcone and 3'-nitrochalcone
Acta Crystallographica Section E, 2020, 76, 1599-1604
2243574 CIF
HKL
Paper
C15 H11 N O3P 1 21/c 114.7856; 15.9841; 10.3188
90; 99.21; 90
2407.2Hall, Charlie L.; Hamilton, Victoria; Potticary, Jason; Cremeens, Matthew E.; Pridmore, Natalie E.; Sparkes, Hazel A.; D'ambruoso, Gemma D.; Warren, Stephen D.; Matsumoto, Masaomi; Hall, Simon R.
Crystal structures of three functionalized chalcones: 4'-dimethylamino-3-nitrochalcone, 3-dimethylamino-3'-nitrochalcone and 3'-nitrochalcone
Acta Crystallographica Section E, 2020, 76, 1599-1604
2243573 CIF
HKL
Paper
C17 H16 N2 O SP 1 21/c 117.251; 5.6849; 17.3101
90; 116.958; 90
1513.14Sheakh Mohamad, Ropak A.; Hamad, Wali M.; Aziz, Hashim J.; Dege, Necmi
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-<i>N</i>-(4-propyloxybenzylidene)benzo[<i>d</i>]thiazol-2-amine
Acta Crystallographica Section E, 2020, 76, 1591-1594
2243572 CIF
HKL
Paper
C26 H22 Fe N8P -15.7905; 9.7461; 10.172
82.064; 84.754; 77.739
554.44Pokharel, Uttam R.; Naquin, Aaron P.; Brochon, Connor P.; Fronczek, Frank R.
Synthesis and crystal structure of 1,1'-bis{[4-(pyridin-2-yl)-1,2,3-triazol-1-yl]methyl}ferrocene, and its complexation with Cu^I^
Acta Crystallographica Section E, 2020, 76, 1582-1586
2243571 CIF
HKL
Paper
C14 H12 I N OP 21 21 218.173; 11.8143; 13.1721
90; 90; 90
1271.88Kansiz, Sevgi; Agar, Tuggan; Dege, Necmi; Dogan, Onur Erman; Ahmed, Ruby; Saif, Eiad
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-2-{[(2-iodophenyl)imino]methyl}-6-methylphenol
Acta Crystallographica Section E, 2020, 76, 1595-1598
2243570 CIF
HKL
Paper
C15 H14 N2 O3P b c a7.3925; 15.4082; 23.575
90; 90; 90
2685.31Cinar, Emine Berrin; Faizi, Md. Serajul Haque; Yagci, Nermin Kahveci; Dogan, Onur Erman; Aydin, Alev Sema; Agar, Erbil; Dege, Necmi; Mashrai, Ashraf
Crystal structure, Hirshfeld surface analysis and DFT studies of (<i>E</i>)-4-methyl-2-{[(2-methyl-3-nitrophenyl)imino]methyl}phenol
Acta Crystallographica Section E, 2020, 76, 1551-1556
2243569 CIF
HKL
Paper
C86 H60 Cl6 Fe O8 P4P 43 21 211.985; 11.985; 52.4508
90; 90; 90
7534Rennie, Benjamin E.; Lough, Alan J.; Morris, Robert H.
Crystal structure of bis[(<i>R</i>,<i>R</i>)-1,2-(binaphthylphosphonito)ethane]dichloridoiron(II) dichloromethane disolvate
Acta Crystallographica Section E, 2020, 76, 1525-1527
2243568 CIF
HKL
Paper
C24 H30 N2 O8P 21 21 219.8293; 10.4915; 22.9863
90; 90; 90
2370.44Ouiyangkul, Passaporn; Saithong, Saowanit; Tantishaiyakul, Vimon
Syntheses and crystal structures of hydrated and anhydrous 1:2 cocrystals of oxyresveratrol and zwitterionic proline
Acta Crystallographica Section E, 2020, 76, 1528-1534
2243567 CIF
HKL
Paper
C24 H32 N2 O9P 21 21 219.9759; 10.6052; 22.8535
90; 90; 90
2417.82Ouiyangkul, Passaporn; Saithong, Saowanit; Tantishaiyakul, Vimon
Syntheses and crystal structures of hydrated and anhydrous 1:2 cocrystals of oxyresveratrol and zwitterionic proline
Acta Crystallographica Section E, 2020, 76, 1528-1534
2243566 CIF
HKL
C18 H20 O3 SiP 1 21/c 19.4936; 8.6802; 19.747
90; 99.743; 90
1603.8Krupp, Anna; Barth, Eva Rebecca; Seymen, Rana; Strohmann, Carsten
Crystal structures, Hirshfeld atom refinements and Hirshfeld surface analyses of tris(4,5-dihydrofuran-2-yl)methylsilane and tris(4,5-dihydrofuran-2-yl)phenylsilane
Acta Crystallographica Section E, 2020, 76, 1514-1519
2243565 CIF
HKL
C18 H20 O3 SiP 1 21/c 19.4936; 8.6802; 19.747
90; 99.743; 90
1603.8Krupp, Anna; Barth, Eva Rebecca; Seymen, Rana; Strohmann, Carsten
Crystal structures, Hirshfeld atom refinements and Hirshfeld surface analyses of tris(4,5-dihydrofuran-2-yl)methylsilane and tris(4,5-dihydrofuran-2-yl)phenylsilane
Acta Crystallographica Section E, 2020, 76, 1514-1519
2243564 CIF
HKL
C13 H18 O3 SiP 1 21/n 17.9801; 12.2381; 13.3712
90; 90.134; 90
1305.84Krupp, Anna; Barth, Eva Rebecca; Seymen, Rana; Strohmann, Carsten
Crystal structures, Hirshfeld atom refinements and Hirshfeld surface analyses of tris(4,5-dihydrofuran-2-yl)methylsilane and tris(4,5-dihydrofuran-2-yl)phenylsilane
Acta Crystallographica Section E, 2020, 76, 1514-1519
2243563 CIF
HKL
Paper
C13 H18 O3 SiP 1 21/n 17.9801; 12.2381; 13.3712
90; 90.134; 90
1305.84Krupp, Anna; Barth, Eva Rebecca; Seymen, Rana; Strohmann, Carsten
Crystal structures, Hirshfeld atom refinements and Hirshfeld surface analyses of tris(4,5-dihydrofuran-2-yl)methylsilane and tris(4,5-dihydrofuran-2-yl)phenylsilane
Acta Crystallographica Section E, 2020, 76, 1514-1519
2243562 CIF
HKL
Paper
C11 H13 N5 SP 1 21/n 17.9047; 12.138; 13.959
90; 94.67; 90
1334.9Renugadevi, M.; Sinthiya, A.; Poomani, Kumaradhas; Suresh, Suganya
Crystal structure and Hirshfeld surface analysis of 4-aminopyridinium thiocyanate‒4-aminopyridine (1/1)
Acta Crystallographica Section E, 2020, 76, 1535-1538
2243561 CIF
HKL
Paper
C28 H50 Cl6 N4 O4 Pd2 S2 Te2P -19.6333; 12.77; 17.956
73.82; 83.55; 88.86
2107.8Gupta, Anand; Deka, Rajesh; Butcher, Ray J.; Singh, Harkesh B.
Structure of a diorganotelluroxonium(IV) cation, {[2,6-(CH~2~NMe~2~)~2~C~6~H~3~Te(μ-O)]~2~}^2+^, with the trichlorido(dimethyl sulfoxide)platinum(II) anion
Acta Crystallographica Section E, 2020, 76, 1520-1524
2243560 CIF
HKL
Paper
C3 H5 Cs O2P 21 21 214.4242; 6.2866; 21.4422
90; 90; 90
596.38Fábry, Jan; Samolová, Erika
Layered alkali propanoates <i>M</i>^+^(C~2~H~5~COO)^{-^}; <i>M</i>^+^ = Na^+^, K^+^, Rb^+^, Cs^+^
Acta Crystallographica Section E, 2020, 76, 1508-1513
2243559 CIF
HKL
Paper
C3 H5 O2 RbP -14.1538; 6.0008; 11.182
80.038; 81.465; 88.987
271.47Fábry, Jan; Samolová, Erika
Layered alkali propanoates <i>M</i>^+^(C~2~H~5~COO)^{-^}; <i>M</i>^+^ = Na^+^, K^+^, Rb^+^, Cs^+^
Acta Crystallographica Section E, 2020, 76, 1508-1513
2243558 CIF
HKL
Paper
C3 H5 K O2P 1 21/m 13.907; 5.7872; 11.317
90; 94.03; 90
255.25Fábry, Jan; Samolová, Erika
Layered alkali propanoates <i>M</i>^+^(C~2~H~5~COO)^{-^}; <i>M</i>^+^ = Na^+^, K^+^, Rb^+^, Cs^+^
Acta Crystallographica Section E, 2020, 76, 1508-1513
2243557 CIF
HKL
Paper
C3 H5 Na O2P 1 21/a 17.1048; 5.3003; 11.9035
90; 111.225; 90
417.85Fábry, Jan; Samolová, Erika
Layered alkali propanoates <i>M</i>^+^(C~2~H~5~COO)^{-^}; <i>M</i>^+^ = Na^+^, K^+^, Rb^+^, Cs^+^
Acta Crystallographica Section E, 2020, 76, 1508-1513
2243556 CIF
HKL
C12 H17 Cu N O6P 21 21 217.0614; 11.0738; 17.6541
90; 90; 90
1380.49Katsuumi, Natsuki; Onami, Yuika; Pradhan, Sayantan; Haraguchi, Tomoyuki; Akitsu, Takashiro
Crystal structure and Hirshfeld surface analysis of (aqua-κ<i>O</i>)(methanol-κ<i>O</i>)[<i>N</i>-(2-oxidobenzylidene)threoninato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']copper(II)
Acta Crystallographica Section E, 2020, 76, 1539-1542
2243555 CIF
HKL
Paper
C14 H25 Cl2 Cu2 N5 O2P -19.0732; 10.746; 11.5578
92.373; 102.383; 112.703
1005.71Vynohradov, Oleksandr S.; Pavlenko, Vadim A.; Safyanova, Inna S.; Znovjyak, Kateryna; Shova, Sergiu; Safarmamadov, Safarmamad M.
Crystal structure of dichlorido-1κ<i>Cl</i>,2κ<i>Cl</i>-(μ~2~-3,5-dimethyl-1<i>H</i>-pyrazolato-1κ<i>N</i>^2^:2κ<i>N</i>^1^)(3,5-dimethyl-1<i>H</i>-pyrazole-2κ<i>N</i>^2^){μ-2-[(2-hydroxyethyl)amino-1κ^2^<i>N</i>,<i>O</i>]ethanolato-1:2κ^2^<i>O</i>:<i>O</i>}dicopper(II)
Acta Crystallographica Section E, 2020, 76, 1503-1507
2243554 CIF
HKL
Paper
Ag1.64 Fe1.36 O12 P3 Zn1.64C 1 2/c 111.8151; 12.6367; 6.4056
90; 113.431; 90
877.52Khmiyas, Jamal; Assani, Abderrazzak; Saadi, Mohamed; El Ammari, Lahcen
Synthesis, crystal structure determination of a novel phosphate Ag~1.64~Zn~1.64~Fe~1.36~(PO~4~)~3~ with an alluaudite-like structure
Acta Crystallographica Section E, 2020, 76, 1491-1495
2243553 CIF
HKL
C16 H13 Br OP -15.9282; 7.3614; 14.6747
88.532; 82.199; 87.457
633.73Battaglia, Zachary O.; Kersten, Jordan T.; Nicol, Elise M.; Whitworth, Paloma; Wheeler, Kraig A.; Hall, Charlie L.; Potticary, Jason; Hamilton, Victoria; Hall, Simon R.; D'Ambruoso, Gemma D.; Matsumoto, Masaomi; Warren, Stephen D.; Cremeens, Matthew E.
Crystal structure and Hirshfeld analysis of 3'-bromo-4-methylchalcone and 3'-cyano-4-methylchalcone
Acta Crystallographica Section E, 2020, 76, 1496-1502
2243552 CIF
HKL
Paper
C17 H13 N OP 1 21/c 17.2986; 5.8504; 29.7783
90; 94.525; 90
1267.56Battaglia, Zachary O.; Kersten, Jordan T.; Nicol, Elise M.; Whitworth, Paloma; Wheeler, Kraig A.; Hall, Charlie L.; Potticary, Jason; Hamilton, Victoria; Hall, Simon R.; D'Ambruoso, Gemma D.; Matsumoto, Masaomi; Warren, Stephen D.; Cremeens, Matthew E.
Crystal structure and Hirshfeld analysis of 3'-bromo-4-methylchalcone and 3'-cyano-4-methylchalcone
Acta Crystallographica Section E, 2020, 76, 1496-1502
2243551 CIF
HKL
Paper
O3 P TlP 1 21/n 112.2315; 4.2432; 6.3039
90; 96.727; 90
324.92Weil, Matthias
TlPO~3~ and its comparison with isotypic RbPO~3~ and CsPO~3~
Acta Crystallographica Section E, 2020, 76, 1482-1485
2243550 CIF
HKL
Paper
C80 H106 Cl12 Cu9 N20 O6P -112.9974; 13.9305; 14.7162
106.143; 93.254; 99.819
2506.6Dodds, Christopher A.; Kennedy, Alan R.
Formation of a nonanuclear copper(II) cluster with 3,5-dimethylpyrazolate starting from an NHC complex of copper(I) chloride
Acta Crystallographica Section E, 2020, 76, 1486-1490
2243549 CIF
HKL
Paper
C16 H16 N2 O2C 1 2/c 124.798; 4.7133; 11.533
90; 106.751; 90
1290.8Çınar, Emine Berrin; Yeşilbağ, Semanur; Doğan, Onur Erman; Ağar, Erbil; Dege, Necmi; Saif, Eiad
Synthesis, crystal structure and Hirshfeld surface analysis of 1,7-dimethyl-5a,6,11a,12-tetrahydrobenzo[<i>b</i>]benzo[5,6][1,4]oxazino[2,3-<i>e</i>][1,4]oxazine
Acta Crystallographica Section E, 2020, 76, 1472-1475
2243548 CIF
HKL
Paper
C16 H22 Br2 N2 OP 1 21/n 17.6402; 13.7578; 16.7691
90; 101.162; 90
1729.3Behrman, Edward J.; Hansen, Alexandar L.; Yuan, Chunhua; Parkin, Sean
4,15-Dimethyl-7,12-diazoniatricyclo[10.4.0.0^2,7^]hexadeca-1(12),2,4,6,13,15-hexaene dibromide monohydrate
Acta Crystallographica Section E, 2020, 76, 1467-1471
2243547 CIF
HKL
Paper
C8 H16 Co N6 S4C 1 2/c 116.807; 14.4212; 15.5669
90; 118.744; 90
3308.1Jochim, Aleksej; Radulovic, Rastko; Jess, Inke; Näther, Christian
Crystal structure of bis(<i>N</i>,<i>N</i>'-dimethylthiourea-κ<i>S</i>)bis(thiocyanato-κ<i>N</i>)cobalt(II)
Acta Crystallographica Section E, 2020, 76, 1476-1481
2243546 CIF
HKL
Paper
C108 H92 Er4 N8 O2P -112.8857; 13.6846; 13.7411
61.3447; 82.7796; 83.0804
2104.4Palumbo, Chad T.; Kotyk, Christopher M.; Ziller, Joseph W.; Evans, William J.
Synthesis and crystallographic characterization of diphenylamide rare-earth metal complexes <i>Ln</i>(NPh~2~)~3~(THF)~2~ and [(Ph~2~N)~2~<i>Ln</i>(μ-NPh~2~)]~2~
Acta Crystallographica Section E, 2020, 76, 1447-1453
2243545 CIF
HKL
Paper
C72 H60 Dy2 N6P 1 21/c 19.3068; 22.475; 13.513
90; 91.266; 90
2825.8Palumbo, Chad T.; Kotyk, Christopher M.; Ziller, Joseph W.; Evans, William J.
Synthesis and crystallographic characterization of diphenylamide rare-earth metal complexes <i>Ln</i>(NPh~2~)~3~(THF)~2~ and [(Ph~2~N)~2~<i>Ln</i>(μ-NPh~2~)]~2~
Acta Crystallographica Section E, 2020, 76, 1447-1453
2243544 CIF
HKL
Paper
C72 H60 N6 Y2P 1 21/c 19.2776; 22.5591; 13.4791
90; 91.4966; 90
2820.1Palumbo, Chad T.; Kotyk, Christopher M.; Ziller, Joseph W.; Evans, William J.
Synthesis and crystallographic characterization of diphenylamide rare-earth metal complexes <i>Ln</i>(NPh~2~)~3~(THF)~2~ and [(Ph~2~N)~2~<i>Ln</i>(μ-NPh~2~)]~2~
Acta Crystallographica Section E, 2020, 76, 1447-1453
2243543 CIF
HKL
Paper
C44 H46 Er N3 O2P 1 21/n 112.0946; 19.1086; 16.3609
90; 91.3697; 90
3780.1Palumbo, Chad T.; Kotyk, Christopher M.; Ziller, Joseph W.; Evans, William J.
Synthesis and crystallographic characterization of diphenylamide rare-earth metal complexes <i>Ln</i>(NPh~2~)~3~(THF)~2~ and [(Ph~2~N)~2~<i>Ln</i>(μ-NPh~2~)]~2~
Acta Crystallographica Section E, 2020, 76, 1447-1453
2243542 CIF
HKL
Paper
C44 H46 N3 O2 YP 1 21/c 115.3539; 12.5259; 20.2511
90; 107.207; 90
3720.4Palumbo, Chad T.; Kotyk, Christopher M.; Ziller, Joseph W.; Evans, William J.
Synthesis and crystallographic characterization of diphenylamide rare-earth metal complexes <i>Ln</i>(NPh~2~)~3~(THF)~2~ and [(Ph~2~N)~2~<i>Ln</i>(μ-NPh~2~)]~2~
Acta Crystallographica Section E, 2020, 76, 1447-1453
2243541 CIF
HKL
Paper
C27 H24 N2 O5P 1 21/c 117.021; 16.519; 8.079
90; 97.552; 90
2251.9Wodajo, Ayalew T.; Tran, Thi Thanh Van; Truong, Hong Hieu; Tskhovrebov, Alexander G.; Le, The Duan; Khrustalev, Victor N.; Le, Tuan Anh
Synthesis by deamination reaction and crystal structure at 120K of (16<i>Z</i>,19<i>E</i>)-18-oxo-<i>N</i>-(pyridin-2-yl)-6,7,9,10-tetrahydro-18<i>H</i>-dibenzo[<i>h</i>,<i>o</i>][1,4,7]trioxacyclohexadecine-17-carboxamide
Acta Crystallographica Section E, 2020, 76, 1454-1457
2243540 CIF
HKL
C119.02 H104.02 Al6 N20.2 O30 YbP -113.7254; 16.0597; 28.2523
80.5334; 83.7992; 72.0307
5832.2Rheam, Rachel E.; Zeller, Matthias; Zaleski, Curtis M.
Crystal structures of three anionic lanthanide‒aluminium [3.3.1] metallacryptate complexes
Acta Crystallographica Section E, 2020, 76, 1458-1466
2243539 CIF
HKL
C119.6 H104.6 Al6 Dy N20.32 O30P -113.7232; 16.0871; 28.2946
80.632; 83.989; 71.66
5840.6Rheam, Rachel E.; Zeller, Matthias; Zaleski, Curtis M.
Crystal structures of three anionic lanthanide‒aluminium [3.3.1] metallacryptate complexes
Acta Crystallographica Section E, 2020, 76, 1458-1466
2243538 CIF
HKL
Paper
C119.25 H104.26 Al6 Gd N20.25 O30P -113.7267; 16.0458; 28.2591
80.675; 84.459; 71.757
5826.3Rheam, Rachel E.; Zeller, Matthias; Zaleski, Curtis M.
Crystal structures of three anionic lanthanide‒aluminium [3.3.1] metallacryptate complexes
Acta Crystallographica Section E, 2020, 76, 1458-1466
2243537 CIF
Paper
C14 H12 Cl N O2P 1 21/n 13.84618; 21.9502; 14.1764
90; 94.235; 90
1193.57Blade, Helen; Blundell, Charles D.; Vitorica-Yrezabal, Iñigo J.
Crystal structures of tolfenamic acid polymorphic forms I and II with precise hydrogen-atom positions for nuclear magnetic resonance studies
Acta Crystallographica Section E, 2020, 76, 1421-1426
2243536 CIF
Paper
C14 H12 Cl N O2P 1 21/c 14.8283; 32.0832; 8.0221
90; 104.936; 90
1200.7Blade, Helen; Blundell, Charles D.; Vitorica-Yrezabal, Iñigo J.
Crystal structures of tolfenamic acid polymorphic forms I and II with precise hydrogen-atom positions for nuclear magnetic resonance studies
Acta Crystallographica Section E, 2020, 76, 1421-1426
2243535 CIF
HKL
Paper
C28 H38 Fe2 N2 SiP 21 21 2112.0132; 14.0683; 15.7169
90; 90; 90
2656.2Krupp, Anna; Wegge, Jessica; Otte, Felix; Kleinheider, Johannes; Wall, Helene; Strohmann, Carsten
Crystal structures of [(<i>N</i>,<i>N</i>-dimethylamino)methyl]ferrocene and (<i>R</i>~p~,<i>R</i>~p~)-bis{2-[(dimethylamino)methyl]ferrocenyl}dimethylsilane
Acta Crystallographica Section E, 2020, 76, 1437-1441
2243534 CIF
HKL
Paper
C13 H17 Fe NP 1 21/n 15.6777; 23.0873; 8.7206
90; 90.59; 90
1143.06Krupp, Anna; Wegge, Jessica; Otte, Felix; Kleinheider, Johannes; Wall, Helene; Strohmann, Carsten
Crystal structures of [(<i>N</i>,<i>N</i>-dimethylamino)methyl]ferrocene and (<i>R</i>~p~,<i>R</i>~p~)-bis{2-[(dimethylamino)methyl]ferrocenyl}dimethylsilane
Acta Crystallographica Section E, 2020, 76, 1437-1441
2243533 CIF
HKL
Paper
C13 H12 Cl F3 N2 O3P b c a18.0904; 7.8971; 19.8043
90; 90; 90
2829.28Eckhardt, Tamira; Goddard, Richard; Rudolph, Ines; Richter, Adrian; Lehmann, Christoph; Imming, Peter; Seidel, Rüdiger W.
[2-Chloro-3-nitro-5-(trifluoromethyl)phenyl](piperidin-1-yl)methanone: structural characterization of a side product in benzothiazinone synthesis
Acta Crystallographica Section E, 2020, 76, 1442-1446
2243532 CIF
HKL
Paper
C27 H20 Br Mn N2 O7P 1 21/c 18.8953; 12.0086; 23.79
90; 95.794; 90
2528.3Kanno, Takatoshi; Takase, Tsugiko; Oyama, Dai
Synthesis and crystal structures of manganese(I) carbonyl complexes bearing ester-substituted α-diimine ligands
Acta Crystallographica Section E, 2020, 76, 1433-1436
2243531 CIF
HKL
Paper
C19 H16 Br Mn N2 O7P 1 21/a 111.7054; 13.9151; 13.3273
90; 110.347; 90
2035.3Kanno, Takatoshi; Takase, Tsugiko; Oyama, Dai
Synthesis and crystal structures of manganese(I) carbonyl complexes bearing ester-substituted α-diimine ligands
Acta Crystallographica Section E, 2020, 76, 1433-1436
2243530 CIF
HKL
Paper
C13 H14 O4 S5P -17.1843; 9.9198; 12.523
84.319; 83.574; 69.151
827.11Cordero Giménez, Keysha T.; Soto Díaz, Victoria Y.; González Espiet, Jean C.; Levín Flores, Alexis; Bas Concepción, Jesbaniris; Rivera Cruz, Kevin E.; Rodríguez Ayala, Dara L.; Piñero Cruz, Dalice M.
Crystal structure, Hirshfeld surface analysis and spectroscopic characterization of the di-enol tautomeric form of the compound 3,3'-[(2-sulfanylidene-1,3-dithiole-4,5-diyl)bis(sulfanediyl)]bis(pentane-2,4-dione)
Acta Crystallographica Section E, 2020, 76, 1427-1432
2243529 CIF
HKL
Paper
C15 H9 N O4P 1 21/c 18.079; 20.134; 7.915
90; 116.647; 90
1150.7Oskolkov, Evgenii; Kornilova, Tatiana; Chavez, Preciosa America; Tillotson, John P.; Timofeeva, Tatiana V.
Structural (at 100K) and DFT studies of 2'-nitroflavone
Acta Crystallographica Section E, 2020, 76, 1417-1420
2243528 CIF
HKL
Paper
C20 H17 F2 N4 O2 PP 1 21/n 17.3811; 14.9963; 16.9217
90; 102.138; 90
1831.2Weil, Matthias; Fürst, Markus
Crystal structure of (1,4-diphenyl-4<i>H</i>-1,2,4-triazol-3-yl)phenylamine difluorophosphate, and a survey of the difluorophosphate anion (PO~2~F~2~^{-^})
Acta Crystallographica Section E, 2020, 76, 1003-1006
2243527 CIF
HKL
Paper
C28 H47 Cs O Si3 YbP 1 21/n 19.4401; 16.8718; 21.0246
90; 92.0668; 90
3346.4Huh, Daniel N.; Ziller, Joseph W.; Evans, William J.
Crystal structure of the [(THF)Cs(μ-η^5^:η^5^-Cp')~3~Yb]~<i>n~</i> oligomer
Acta Crystallographica Section E, 2020, 76, 1131-1135
2243526 CIF
HKL
Paper
C64 H55 Fe O3 P3 Pt S2P 1 21/c 112.0071; 36.1737; 13.698
90; 111.97; 90
5517.5Mohamed, Ahmed Said; Jourdain, Isabelle; Knorr, Michael; Brieger, Lukas; Strohmann, Carsten
Crystal structure of {μ~2~-1,2-bis[(4-methylphenylsulfanyl]-3-oxoprop-1-ene-1,3-diyl-1:2κ^2^<i>C</i>^3^:<i>C</i>^1^}dicarbonyl-1κ^2^<i>C</i>-[μ~2~-methylenebis(diphenylphosphane)-1:2κ^2^<i>P</i>:<i>P</i>'](triphenylphosphane-2κ<i>P</i>)ironplatinum(<i>Fe</i>—<i>Pt</i>), [(OC)~2~Fe(μ-dppm){μ-C(=O)C(4-MeC~6~H~4~SCH~2~)=CCH~2~SC~6~H~4~Me-4}Pt(PPh~3~)]
Acta Crystallographica Section E, 2020, 76, 1087-1091
2243525 CIF
Paper
Co Cu4 Ge2 S7C 1 2 111.728; 5.33987; 8.33133
90; 98.668; 90
515.798Craig, Andrew J.; Stoyko, Stanislav S.; Bonnoni, Allyson; Aitken, Jennifer A.
Syntheses and crystal structures of the quaternary thiogermanates Cu~4~FeGe~2~S~7~ and Cu~4~CoGe~2~S~7~
Acta Crystallographica Section E, 2020, 76, 1117-1121
2243524 CIF
Paper
Cu4 Fe Ge2 S7C 1 2 111.7405; 5.3589; 8.342
90; 98.661; 90
518.86Craig, Andrew J.; Stoyko, Stanislav S.; Bonnoni, Allyson; Aitken, Jennifer A.
Syntheses and crystal structures of the quaternary thiogermanates Cu~4~FeGe~2~S~7~ and Cu~4~CoGe~2~S~7~
Acta Crystallographica Section E, 2020, 76, 1117-1121
2243523 CIF
HKL
Paper
C42 H88 Br4 N4 O10 Zn6P 1 21/n 112.1464; 21.0777; 12.5842
90; 115.277; 90
2913.3Scheel, Rebecca; Brieger, Lukas; Louven, Kathrin; Strohmann, Carsten
Synthesis and crystal structure of [Zn~6~Br~4~(C~9~H~18~NO)~4~(OH)~4~]·2C~3~H~6~O~2~
Acta Crystallographica Section E, 2020, 76, 998-1002
2243522 CIF
Paper
K O7 P2 ScP 1 21/c 17.4634; 10.3902; 8.3747
90; 106.49; 90
622.715Redhammer, Günther J.; Tippelt, Gerold
The crystal structure of KScP~2~O~7~
Acta Crystallographica Section E, 2020, 76, 1412-1416
2243521 CIF
HKL
Paper
C18 H13 Fe N O2P 1 21/n 15.9573; 29.381; 8.0664
90; 100.202; 90
1389.55Delgado Rivera, Sara M.; González Espiet, Jean C.; Dones, Jesús M.; Henríquez López, Sebastián A.; Guadalupe, Ana R.; Piñero Cruz, Dalice M.; Montes González, Ingrid
Crystal structure of 1-ferrocenyl-2-(4-nitrophenyl)ethyne
Acta Crystallographica Section E, 2020, 76, 1403-1406
2243520 CIF
HKL
Paper
C7 H5 Br3P 1 21/n 114.3484; 3.9955; 15.6975
90; 110.519; 90
842.83Medjroubi, Mohamed Larbi; Boudjada, Ali; Hamdouni, Noudjoud; Brihi, Ouarda; Jeannin, Olivier; Meinnel, Jean
Crystal structure and Hirshfeld surface analysis of 2,6-diiodo-4-nitrotoluene and 2,4,6-tribromotoluene
Acta Crystallographica Section E, 2020, 76, 1391-1397
2243519 CIF
HKL
Paper
C7 H5 I2 N O2P 1 21/c 14.3815; 15.3348; 14.5894
90; 96.588; 90
973.78Medjroubi, Mohamed Larbi; Boudjada, Ali; Hamdouni, Noudjoud; Brihi, Ouarda; Jeannin, Olivier; Meinnel, Jean
Crystal structure and Hirshfeld surface analysis of 2,6-diiodo-4-nitrotoluene and 2,4,6-tribromotoluene
Acta Crystallographica Section E, 2020, 76, 1391-1397
2243518 CIF
HKL
C200.01 H245.35 Al12 Dy2 N41.34 Na10 O81.34P 1 c 128.1847; 15.3683; 30.7354
90; 106.461; 90
12767.4Travis, Jordan R.; Van Trieste III, Gerard P.; Zeller, Matthias; Zaleski, Curtis M.
Crystal structures of two dysprosium‒aluminium‒sodium [3.3.1] metallacryptates that form two-dimensional sheets
Acta Crystallographica Section E, 2020, 76, 1378-1390
2243517 CIF
HKL
Paper
C101 H127 Al6 Dy N21 Na5 O42C 1 c 122.6809; 20.5788; 27.6206
90; 101.59; 90
12628.9Travis, Jordan R.; Van Trieste III, Gerard P.; Zeller, Matthias; Zaleski, Curtis M.
Crystal structures of two dysprosium‒aluminium‒sodium [3.3.1] metallacryptates that form two-dimensional sheets
Acta Crystallographica Section E, 2020, 76, 1378-1390
2243516 CIF
HKL
Paper
In1.68 Mn0.87 Na2.22 O12 P3C 1 2/c 112.412; 12.855; 6.599
90; 114.727; 90
956.4Badri, Abdessalem; Alvarez-Serrano, Inmaculada; Luisa López, María; Ben Amara, Mongi
Synthesis, crystal structure and charge-distribution validation of a new alluaudite-type phosphate, Na~2.22~Mn~0.87~In~1.68~(PO~4~)~3~
Acta Crystallographica Section E, 2020, 76, 1369-1372
2243515 CIF
HKL
Paper
C12 H24 Co N6 S4P 1 21/c 113.3288; 11.214; 13.8579
90; 97.667; 90
2052.8Jochim, Aleksej; Radulovic, Rastko; Jess, Inke; Näther, Christian
Crystal structure of bis(tetramethylthiourea-κ<i>S</i>)bis(thiocyanato-κ<i>N</i>)cobalt(II)
Acta Crystallographica Section E, 2020, 76, 1373-1377
2243514 CIF
HKL
Paper
C31 H31 B2 Br Fe N10P -110.5035; 15.2782; 20.9003
80.266; 86.443; 78.066
3233Ossinger, Sascha; Näther, Christian; Tuczek, Felix
Crystal structure of bis(5-bromo-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')bis[dihydrobis(pyrazol-1-yl)borato-κ^2^<i>N</i>^2^,<i>N</i>^2'^]iron(II) toluene disolvate
Acta Crystallographica Section E, 2020, 76, 1398-1402
2243513 CIF
HKL
Paper
C23 H20 N2 O2P 1 21/n 19.0844; 18.7227; 11.2708
90; 104.848; 90
1853Cinar, Emine Berrin; Zouitini, Ayman; Kandri Rodi, Youssef; Ouzidan, Younes; Marrot, Jérôme; Prim, Damien; Dege, Necmi; Saif, Eiad
Synthesis, crystal structures and Hirshfeld surface analysis of 1,4-dibenzyl-6-methyl-1,4-dihydroquinoxaline-2,3-dione
Acta Crystallographica Section E, 2020, 76, 1361-1364
2243512 CIF
HKL
Paper
C32 H28 N2 OP -18.7807; 11.9566; 12.9121
77.982; 78.711; 75.612
1269.4Naghiyev, Farid N.; Mammadova, Gunay Z.; Mamedov, Ibrahim G.; Huseynova, Afet T.; Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Akobirshoeva, Anzurat A.
Crystal structure and Hirshfeld surface analysis of phenyl(5,7,8a-triphenyl-1,2,3,7,8,8a-hexahydroimidazo[1,2-<i>a</i>]pyridin-6-yl)methanone with an unknown solvent
Acta Crystallographica Section E, 2020, 76, 1365-1368
2243511 CIF
HKL
Paper
C16 H30 N4 O8 S2P 1 21/c 15.6085; 18.1641; 10.6884
90; 97.86; 90
1078.63Udvardy, Antal; De, Sourav; Gál, Tamás Gyula; Papp, Gábor; Czégéni, Csilla Eniko; Joó, Ferenc
Crystal structure of zwitterionic 3,3'-[1,1'-(butane-1,4-diyl)bis(1<i>H</i>-imidazol-3-ium-3,1-diyl)]bis(propane-1-sulfonate) dihydrate
Acta Crystallographica Section E, 2020, 76, 1353-1356
2243510 CIF
HKL
Paper
C12 H9 F5 N2 O WP 1 21/n 17.1664; 15.5088; 11.6516
90; 101.202; 90
1270.31Turnbull, Douglas; Gerken, Michael
Crystal structure of an ordered [WOF~5~]^{-^} salt: (1,10-phen-H)[WOF~5~] (1,10-phen = 1,10-phenanthroline)
Acta Crystallographica Section E, 2020, 76, 1345-1348
2243509 CIF
HKL
C7.5 H10.5 I0.5 NP 1 21 17.3471; 9.9672; 10.9499
90; 94.671; 90
799.2Chadeayne, Andrew R.; Pham, Duyen N. K.; Golen, James A.; Manke, David R.
Quaternary tryptammonium salts: <i>N</i>,<i>N</i>-dimethyl-<i>N</i>-<i>n</i>-propyltryptammonium (DMPT) iodide and <i>N</i>-allyl-<i>N</i>,<i>N</i>-dimethyltryptammonium (DMALT) iodide
Acta Crystallographica Section E, 2020, 76, 1357-1360
2243508 CIF
HKL
Paper
C15 H23 I N2P 1 21/c 17.4471; 9.9016; 22.052
90; 94.184; 90
1621.7Chadeayne, Andrew R.; Pham, Duyen N. K.; Golen, James A.; Manke, David R.
Quaternary tryptammonium salts: <i>N</i>,<i>N</i>-dimethyl-<i>N</i>-<i>n</i>-propyltryptammonium (DMPT) iodide and <i>N</i>-allyl-<i>N</i>,<i>N</i>-dimethyltryptammonium (DMALT) iodide
Acta Crystallographica Section E, 2020, 76, 1357-1360
2243507 CIF
HKL
Paper
C26 H26 Cl6 N12 O4 Zn4P -19.2002; 9.4306; 11.7651
94.639; 110.091; 97.599
941.46Seck, Thierno Moussa; Gaye, Papa Aly; Ndoye, Cheikh; Thiam, Ibrahima Elhadji; Diouf, Ousmane; Retailleau, Pascal; Gaye, Mohamed
Diaquabis{μ-1,5-bis[(pyridin-2-yl)methylidene]carbonohydrazide(1‒)}di-μ-chlorido-tetrachloridotetrazinc(II)
Acta Crystallographica Section E, 2020, 76, 1349-1352
2243506 CIF
HKL
C8 H5 Cu I N S2C 1 c 115.174; 4.1188; 15.785
90; 92.98; 90
985.2Wheaton, Amelia M.; Guzei, Ilia A.; Berry, John F.
Structural diversity in copper(I) iodide complexes with 6-thioxopiperidin-2-one, piperidine-2,6-dithione and isoindoline-1,3-dithione ligands
Acta Crystallographica Section E, 2020, 76, 1336-1344
2243505 CIF
HKL
Paper
C10 H14 Cu2 I2 N2 S4P 1 21/c 113.2866; 11.6974; 14.8089
90; 96.998; 90
2284.4Wheaton, Amelia M.; Guzei, Ilia A.; Berry, John F.
Structural diversity in copper(I) iodide complexes with 6-thioxopiperidin-2-one, piperidine-2,6-dithione and isoindoline-1,3-dithione ligands
Acta Crystallographica Section E, 2020, 76, 1336-1344
2243504 CIF
HKL
Paper
C5 H7 Cu I N O SP b c n26.982; 8.195; 7.351
90; 90; 90
1625.4Wheaton, Amelia M.; Guzei, Ilia A.; Berry, John F.
Structural diversity in copper(I) iodide complexes with 6-thioxopiperidin-2-one, piperidine-2,6-dithione and isoindoline-1,3-dithione ligands
Acta Crystallographica Section E, 2020, 76, 1336-1344
2243503 CIF
HKL
Paper
C14 H20 Cu4 I4 N4 O2 S2C 1 2/c 114.4669; 12.2157; 16.9969
90; 112.562; 90
2773.9Wheaton, Amelia M.; Guzei, Ilia A.; Berry, John F.
Structural diversity in copper(I) iodide complexes with 6-thioxopiperidin-2-one, piperidine-2,6-dithione and isoindoline-1,3-dithione ligands
Acta Crystallographica Section E, 2020, 76, 1336-1344
2243502 CIF
HKL
Paper
C14 H20 Cu2 I2 N4 O2 S2P -18.121; 8.433; 9.154
68.918; 80.523; 71.27
553.1Wheaton, Amelia M.; Guzei, Ilia A.; Berry, John F.
Structural diversity in copper(I) iodide complexes with 6-thioxopiperidin-2-one, piperidine-2,6-dithione and isoindoline-1,3-dithione ligands
Acta Crystallographica Section E, 2020, 76, 1336-1344
2243501 CIF
HKL
Paper
C15 H14 Cl N OP 1 21/c 18.0534; 6.3764; 25.3657
90; 96.392; 90
1294.47Faizi, Md. Serajul Haque; Cinar, Emine Berrin; Aydin, Alev Sema; Agar, Erbil; Dege, Necmi; Mashrai, Ashraf
Crystal structure, Hirshfeld surface analysis and DFT studies of (<i>E</i>)-2-{[(3-chloro-4-methylphenyl)imino]methyl}-4-methylphenol
Acta Crystallographica Section E, 2020, 76, 1320-1324
2243500 CIF
HKL
Paper
C15 H12 F3 N OP c a 216.2592; 7.2229; 28.551
90; 90; 90
1290.8Faizi, Md. Serajul Haque; Cinar, Emine Berrin; Dogan, Onur Erman; Aydin, Alev Sema; Agar, Erbil; Dege, Necmi; Mashrai, Ashraf
Crystal structure, Hirshfeld surface analysis and DFT studies of 4-methyl-2-({[4-(trifluoromethyl)phenyl]imino}methyl)phenol
Acta Crystallographica Section E, 2020, 76, 1325-1330
2243499 CIF
HKL
Paper
C6 H15 N O6P 1 21/c 16.5739; 22.9278; 6.0647
90; 93.77; 90
912.12Navasardyan, Mger A.; Grishanov, Dmitry A.; Prikhodchenko, Petr V.; Churakov, Andrei V.
<small>DL</small>-Piperidinium-2-carboxylate bis(hydrogen peroxide): unusual hydrogen-bonded peroxide chains
Acta Crystallographica Section E, 2020, 76, 1331-1335
2243498 CIF
HKL
Paper
C13 H9 Cl2 N3 O2P 1 21 17.1212; 12.711; 7.6991
90; 105.94; 90
670.1Atioğlu, Zeliha; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Suleymanova, Gulnar T.; Babayeva, Gulnare V.; Gurbanova, Nurana V.; Mammadova, Gunay Z.; Mlowe, Sixberth
(<i>E</i>)-1-(2,6-Dichlorophenyl)-2-(3-nitrobenzylidene)hydrazine: crystal structure and Hirshfeld surface analysis
Acta Crystallographica Section E, 2020, 76, 1291-1295
2243497 CIF
HKL
Paper
C53 H42 Co2 N5 O13P -110.8832; 11.4742; 19.905
74.295; 89.791; 88.502
2392Saelim, Thawanrat; Chainok, Kittipong; Kielar, Filip; Wannarit, Nanthawat
Crystal structure of a novel one-dimensional zigzag chain-like cobalt(II) coordination polymer constructed from 4,4'-bipyridine and 2-hydroxybenzoate ligands
Acta Crystallographica Section E, 2020, 76, 1302-1306
2243496 CIF
HKL
Paper
C10 H14 Cl6 N4 SnP -17.4537; 8.0674; 8.1025
83.791; 82.591; 71.407
456.768Ghallab, Rochdi; Boutebdja, Mehdi; Dénès, George; Merazig, Hocine
Synthesis, crystal structure and Hirshfeld surface of bis(2-aminopyridinium) hexachloridostannate(IV)
Acta Crystallographica Section E, 2020, 76, 1279-1283
2243495 CIF
HKL
Paper
C3 H7 Cs O3P -4 21 m17.7764; 17.7764; 4.2223
90; 90; 90
1334.25Samolová, Erika; Fábry, Jan
Caesium propanoate monohydrate
Acta Crystallographica Section E, 2020, 76, 1307-1310
2243494 CIF
HKL
Paper
C26 H22 Au F N O P SP 1 21/n 18.9311; 17.2458; 15.6857
90; 99.361; 90
2383.8Yeo, Chien Ing; Tan, Sang Loon; Kwong, Huey Chong; Tiekink, Edward R. T.
[(<i>Z</i>)-<i>N</i>-(3-Fluorophenyl)-<i>O</i>-methylthiocarbamato-κ<i>S</i>](triphenylphosphane-κ<i>P</i>)gold(I): crystal structure, Hirshfeld surface analysis and computational study
Acta Crystallographica Section E, 2020, 76, 1284-1290
2243493 CIF
HKL
Paper
C11 H10 O3P 1 21/n 111.3538; 7.4062; 20.5398
90; 92.6226; 90
1725.35Hulsman, Andrew; Lorenzana, Isabel; Schultz, Theodore; Squires, Breezy; Stenfors, Brock A.; Tolonen, Mason; Staples, Richard J.; Biros, Shannon M.; Winchester, William R.
Syntheses and crystal structures of the anhydride 4-oxatetracyclo[5.3.2.0^2,6^.0^8,10^]dodec-11-ene-3,5-dione and the related imide 4-(4-bromophenyl)-4-azatetracyclo[5.3.2.0^2,6^.0^8,10^]dodec-11-ene-3,5-dione
Acta Crystallographica Section E, 2020, 76, 1311-1315
2243492 CIF
HKL
Paper
C17 H14 Br N O2P 1 21/n 112.49907; 6.41302; 17.8772
90; 99.8083; 90
1412.03Hulsman, Andrew; Lorenzana, Isabel; Schultz, Theodore; Squires, Breezy; Stenfors, Brock A.; Tolonen, Mason; Staples, Richard J.; Biros, Shannon M.; Winchester, William R.
Syntheses and crystal structures of the anhydride 4-oxatetracyclo[5.3.2.0^2,6^.0^8,10^]dodec-11-ene-3,5-dione and the related imide 4-(4-bromophenyl)-4-azatetracyclo[5.3.2.0^2,6^.0^8,10^]dodec-11-ene-3,5-dione
Acta Crystallographica Section E, 2020, 76, 1311-1315
2243491 CIF
HKL
Paper
C11 H14 N2 O3P 1 21/n 17.0695; 10.8321; 14.4349
90; 101.556; 90
1082.98Zouitini, Ayman; Faizi, Md. Serajul Haque; Ouzidan, Younes; Ouazzani Chahdi, Fouad; Marrot, Jérôme; Prim, Damien; Dege, Necmi; Mashrai, Ashraf
Synthesis, crystal structure at 219K and Hirshfeld surface analyses of 1,4,6-trimethylquinoxaline-2,3(1<i>H</i>,4<i>H</i>)-dione monohydrate
Acta Crystallographica Section E, 2020, 76, 1296-1301
2243490 CIF
HKL
Paper
C12 H32 Ba2 Cr2 Ni O40P 1 21/n 111.5556; 11.0774; 14.6105
90; 93.794; 90
1866.1Mbiangué, Yves Alain; Ndinga, Manelsa Lande; Nduga, Jean Pierre; Wenger, Emmanuel; Lecomte, Claude
Hexaaquanickel(II) bis[triaqua-μ~3~-oxalato-di-μ-oxalato-bariumchromate(III)] tetrahydrate
Acta Crystallographica Section E, 2020, 76, 1316-1319
2243489 CIF
HKL
Paper
C7 H5 Ag O5 SP -16.0376; 8.6293; 15.5903
92.315; 99.589; 90.657
800.12Bettinger, Reuben T.; Squattrito, Philip J.; Aulakh, Darpandeep
The low-temperature triclinic crystal structure of silver 3-sulfobenzoic acid
Acta Crystallographica Section E, 2020, 76, 1275-1278
2243488 CIF
HKL
Paper
C24 H15 Cl2 N3 O2P -18.7077; 10.4281; 12.1329
101.111; 92.087; 113.161
986.22Kashiwagi, Yukiyasu; Kubono, Koji; Tamai, Toshiyuki
Crystal structure of 7,7'-[(pyridin-2-yl)methylene]bis(5-chloroquinolin-8-ol)
Acta Crystallographica Section E, 2020, 76, 1271-1274
2243487 CIF
HKL
Paper
C24 H33 N O2P n a 2110.2778; 11.4064; 17.5586
90; 90; 90
2058.4Wannapaiboon, Suttipong; Hanlumyuang, Yuranan; Chansaenpak, Kantapat; Pinyou, Piyanut; Veranitisagul, Chatchai; Laobuthee, Apirat; Wattanathana, Worawat
Crystal structure and Hirshfeld surface analysis of the product of the ring-opening reaction of a dihydrobenzoxazine: 6,6'-[(cyclohexylazanediyl)bis(methylene)]bis(2,4-dimethylphenol)
Acta Crystallographica Section E, 2020, 76, 1239-1244
2243486 CIF
HKL
C18 H26 N2 Ni O11C 1 2/c 140.884; 6.9438; 7.8983
90; 91.9; 90
2241Narvekar, Kedar U.; Srinivasan, Bikshandarkoil R.
Crystal structures of two isostructural bivalent metal <i>N</i>-benzoylglycinates
Acta Crystallographica Section E, 2020, 76, 1260-1265
2243485 CIF
HKL
Paper
C18 H26 Co N2 O11C 1 2/c 140.843; 6.9072; 8.0031
90; 91.891; 90
2256.5Narvekar, Kedar U.; Srinivasan, Bikshandarkoil R.
Crystal structures of two isostructural bivalent metal <i>N</i>-benzoylglycinates
Acta Crystallographica Section E, 2020, 76, 1260-1265
2243484 CIF
HKL
Paper
C20 H24 Br2 N4P -18.1488; 11.2243; 12.6378
64.049; 74.184; 86.067
998.3Jabri, Zainab; Sebbar, Nada Kheira; Hökelek, Tuncer; Mague, Joel T.; Sabir, Safia; Rodi, Youssef Kandri; Misbahi, Khalid
Crystal structure, Hirshfeld surface analysis and DFT study of 6-bromo-3-(5-bromohexyl)-2-[4-(dimethylamino)phenyl]-3<i>H</i>-imidazo[4,5-<i>b</i>]pyridine
Acta Crystallographica Section E, 2020, 76, 1234-1238
2243483 CIF
HKL
Paper
C18 H19 Cl2 N3P -18.1035; 9.1965; 12.3665
102.421; 95.88; 91.105
894.48Özkaraca, Kadriye; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Askerova, Ulviyya F.; Suleymanova, Gulnar T.; Mammadova, Gunay Z.; Shadrack, Daniel M.
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-4-{2,2-dichloro-1-[(3,5-dimethylphenyl)diazenyl]ethenyl}-<i>N</i>,<i>N</i>-dimethylaniline
Acta Crystallographica Section E, 2020, 76, 1251-1254
2243482 CIF
HKL
Paper
C32 H30 N4 O2 S4P b c n15.4653; 7.9639; 24.8116
90; 90; 90
3055.9Paulus, Georgiana; Kwong, Huey Chong; Crouse, Karen A.; Tiekink, Edward R. T.
2-[(1<i>E</i>)-[(<i>Z</i>)-2-({[(1<i>Z</i>)-[(<i>E</i>)-2-[(2-Hydroxyphenyl)methylidene]hydrazin-1-ylidene]({[(4-methylphenyl)methyl]sulfanyl})methyl]disulfanyl}({[(4-methylphenyl)methyl]sulfanyl})methylidene)hydrazin-1-ylidene]methyl]phenol: crystal structure, Hirshfeld surface analysis and computational study
Acta Crystallographica Section E, 2020, 76, 1245-1250
2243481 CIF
HKL
Paper
C26 H30 B2 Fe N10P 1 21/c 117.1798; 8.7991; 18.7608
90; 99.711; 90
2795.37Ossinger, Sascha; Näther, Christian; Tuczek, Felix
Crystal structure of bis{(3,5-dimethylpyrazol-1-yl)dihydro[3-(pyridin-2-yl)pyrazol-1-yl]borato}iron(II)
Acta Crystallographica Section E, 2020, 76, 1266-1270
2243480 CIF
HKL
Paper
C96 H134 Dy Mn4 N14 Na O38P 4/n :219.9869; 19.9869; 13.957
90; 90; 90
5575.5Manickas, Elizabeth C.; Zeller, Matthias; Zaleski, Curtis M.
Crystal structures of two heterotrimetallic dysprosium‒manganese‒sodium 12-metallacrown-4 complexes with the bridging ligands 3-hydroxybenzoate and 4-hydroxybenzoate
Acta Crystallographica Section E, 2020, 76, 1213-1221
2243479 CIF
HKL
Paper
C68 H72 Dy Mn4 N8 Na O32P 1 n 114.3622; 16.5258; 16.8246
90; 92.347; 90
3989.9Manickas, Elizabeth C.; Zeller, Matthias; Zaleski, Curtis M.
Crystal structures of two heterotrimetallic dysprosium‒manganese‒sodium 12-metallacrown-4 complexes with the bridging ligands 3-hydroxybenzoate and 4-hydroxybenzoate
Acta Crystallographica Section E, 2020, 76, 1213-1221
2243478 CIF
HKL
Paper
C15 H15 N OP 21 21 215.2133; 18.3625; 26.0799
90; 90; 90
2496.6Flores Manuel, Fermin; Sosa Rivadeneyra, Martha; Bernès, Sylvain
One molecule, three crystal structures: conformational trimorphism of <i>N</i>-[(1<i>S</i>)-1-phenylethyl]benzamide
Acta Crystallographica Section E, 2020, 76, 1229-1233
2243477 CIF
HKL
Paper
C15 H15 N OP 1 21 18.3496; 5.2632; 14.2969
90; 99.8; 90
619.12Flores Manuel, Fermin; Sosa Rivadeneyra, Martha; Bernès, Sylvain
One molecule, three crystal structures: conformational trimorphism of <i>N</i>-[(1<i>S</i>)-1-phenylethyl]benzamide
Acta Crystallographica Section E, 2020, 76, 1229-1233
2243476 CIF
HKL
Paper
C15 H15 N OP 1 21 15.0472; 9.3118; 13.9581
90; 99.708; 90
646.62Flores Manuel, Fermin; Sosa Rivadeneyra, Martha; Bernès, Sylvain
One molecule, three crystal structures: conformational trimorphism of <i>N</i>-[(1<i>S</i>)-1-phenylethyl]benzamide
Acta Crystallographica Section E, 2020, 76, 1229-1233
2243475 CIF
HKL
Paper
C24 H23 N3 O3 SP -110.1911; 10.7274; 11.7692
98.55; 105.632; 111.015
1112.76Surya Prakash Rao, H.; Gunasundari, Ramalingam; Muthukumaran, Jayaraman
Crystal structure analysis of ethyl 6-(4-methoxyphenyl)-1-methyl-4-methylsulfanyl-3-phenyl-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridine-5-carboxylate
Acta Crystallographica Section E, 2020, 76, 1209-1212
2243474 CIF
HKL
Paper
C46.44 H16.88 Cl0.88 F20 N4 O3C 1 2/c 123.1774; 15.4767; 26.0442
90; 113.168; 90
8588.9Churchill, Serena B. S.; Sharma, Meenakshi; Brückner, Christian; Zeller, Matthias
Crystal structure of 2,3-dimethoxy-<i>meso</i>-tetrakis(pentafluorophenyl)morpholinochlorin methylene chloride 0.44-solvate
Acta Crystallographica Section E, 2020, 76, 1222-1228
2243473 CIF
HKL
Paper
C15 H12 N2 OP b c a7.8139; 27.047; 11.7683
90; 90; 90
2487.14Faizi, Md. Serajul Haque; Cinar, Emine Berrin; Aydin, Alev Sema; Agar, Erbil; Dege, Necmi; Mashrai, Ashraf
Crystal structure, Hirshfeld surface analysis and DFT studies of 2-[(2-hydroxy-5-methylbenzylidene)amino]benzonitrile
Acta Crystallographica Section E, 2020, 76, 1195-1200
2243472 CIF
HKL
Paper
C17 H17 F N4 O6C 1 2/c 119.871; 7.342; 26.306
90; 94.54; 90
3825.8Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Kavitha, Channappa N.; Foro, Sabine; Glidewell, Christopher
The crystal structures of salts of <i>N</i>-(4-fluorophenyl)piperazine with four aromatic carboxylic acids and with picric acid
Acta Crystallographica Section E, 2020, 76, 1179-1186
2243471 CIF
HKL
Paper
C16 H16 F N5 O7P 1 21/n 116.658; 6.6734; 17.553
90; 117.84; 90
1725.4Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Kavitha, Channappa N.; Foro, Sabine; Glidewell, Christopher
The crystal structures of salts of <i>N</i>-(4-fluorophenyl)piperazine with four aromatic carboxylic acids and with picric acid
Acta Crystallographica Section E, 2020, 76, 1179-1186
2243470 CIF
HKL
Paper
C17 H18 F I N2 O2P -19.8892; 11.6831; 16.4547
106.776; 93.327; 104.874
1741.19Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Kavitha, Channappa N.; Foro, Sabine; Glidewell, Christopher
The crystal structures of salts of <i>N</i>-(4-fluorophenyl)piperazine with four aromatic carboxylic acids and with picric acid
Acta Crystallographica Section E, 2020, 76, 1179-1186
2243469 CIF
HKL
Paper
C17 H18.71 Br F N2 O2.35P -17.2584; 9.347; 13.767
101.14; 95.98; 109.44
849.7Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Kavitha, Channappa N.; Foro, Sabine; Glidewell, Christopher
The crystal structures of salts of <i>N</i>-(4-fluorophenyl)piperazine with four aromatic carboxylic acids and with picric acid
Acta Crystallographica Section E, 2020, 76, 1179-1186
2243468 CIF
HKL
Paper
C17 H20 F2 N2 O3P -16.5873; 7.6616; 17.3399
97.842; 90.378; 95.54
862.72Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Kavitha, Channappa N.; Foro, Sabine; Glidewell, Christopher
The crystal structures of salts of <i>N</i>-(4-fluorophenyl)piperazine with four aromatic carboxylic acids and with picric acid
Acta Crystallographica Section E, 2020, 76, 1179-1186
2243467 CIF
HKL
C18 H22 N2 O4P 21 21 217.9845; 8.5641; 25.649
90; 90; 90
1753.9Chadeayne, Andrew R.; Pham, Duyen N. K.; Golen, James A.; Manke, David R.
DMT analogues: <i>N</i>-ethyl-<i>N</i>-propyltryptamine and <i>N</i>-allyl-<i>N</i>-methytryptamine as their hydrofumarate salts
Acta Crystallographica Section E, 2020, 76, 1201-1205
2243466 CIF
HKL
Paper
C19 H26 N2 O4P 1 21 17.4839; 14.1752; 9.6461
90; 110.537; 90
958.28Chadeayne, Andrew R.; Pham, Duyen N. K.; Golen, James A.; Manke, David R.
DMT analogues: <i>N</i>-ethyl-<i>N</i>-propyltryptamine and <i>N</i>-allyl-<i>N</i>-methytryptamine as their hydrofumarate salts
Acta Crystallographica Section E, 2020, 76, 1201-1205
2243465 CIF
HKL
Paper
C32 H31 N O6P -111.572; 12.3994; 19.9358
83.779; 85.748; 71.559
2695.23Twamley, Brendan; O'Boyle, Niamh M.; Meegan, Mary J.
Azetidin-2-ones: structures of antimitotic compounds based on the 1-(3,4,5-trimethoxyphenyl)azetidin-2-one core
Acta Crystallographica Section E, 2020, 76, 1187-1194
2243464 CIF
HKL
Paper
C27 H29 N O7P 1 21/c 18.858; 22.769; 12.822
90; 109.839; 90
2432.6Twamley, Brendan; O'Boyle, Niamh M.; Meegan, Mary J.
Azetidin-2-ones: structures of antimitotic compounds based on the 1-(3,4,5-trimethoxyphenyl)azetidin-2-one core
Acta Crystallographica Section E, 2020, 76, 1187-1194
2243463 CIF
HKL
Paper
C29 H27 N O5P -110.4633; 11.318; 11.6008
104.628; 99.056; 112.929
1172.73Twamley, Brendan; O'Boyle, Niamh M.; Meegan, Mary J.
Azetidin-2-ones: structures of antimitotic compounds based on the 1-(3,4,5-trimethoxyphenyl)azetidin-2-one core
Acta Crystallographica Section E, 2020, 76, 1187-1194
2243462 CIF
HKL
Paper
C23 H23 N O6P 1 21/c 119.794; 9.1396; 23.161
90; 101.071; 90
4112.1Twamley, Brendan; O'Boyle, Niamh M.; Meegan, Mary J.
Azetidin-2-ones: structures of antimitotic compounds based on the 1-(3,4,5-trimethoxyphenyl)azetidin-2-one core
Acta Crystallographica Section E, 2020, 76, 1187-1194
2243461 CIF
HKL
Paper
C25 H24 F N O5P b c a18.6879; 9.4736; 24.283
90; 90; 90
4299.1Twamley, Brendan; O'Boyle, Niamh M.; Meegan, Mary J.
Azetidin-2-ones: structures of antimitotic compounds based on the 1-(3,4,5-trimethoxyphenyl)azetidin-2-one core
Acta Crystallographica Section E, 2020, 76, 1187-1194
2243460 CIF
HKL
Paper
C27 H34 N4 O5 SP 1 21/n 18.4867; 29.764; 10.6334
90; 94.381; 90
2678.1Natchimuthu, V.; Sharmila, N.; Ravi, S.
Crystal structure and Hirshfeld surface analysis of 1-methyl-4-(2-methyl-10<i>H</i>-benzo[<i>b</i>]thieno[2,3-<i>e</i>][1,4]diazepin-4-yl)piperazin-1-ium 2,5-dihydroxybenzoate propan-2-ol monosolvate
Acta Crystallographica Section E, 2020, 76, 1168-1172
2243459 CIF
HKL
Paper
C5 H6 O2 SP 1 21/c 14.1054; 22.9727; 6.1928
90; 103.728; 90
567.37Nashawi, Asma; Lawson, Christopher P.; Abdel-Sattar, M. Omar; ter Horst, Joop H.; Coxon, Geoffrey D.; Kennedy, Alan R.
Synthesis and crystal structures of 3-hydroxy-2,4-dimethyl-2<i>H</i>-thiophen-5-one and 3-hydroxy-4-methyl-2<i>H</i>-thiophen-5-one
Acta Crystallographica Section E, 2020, 76, 1158-1162
2243458 CIF
HKL
Paper
C6 H8 O2 SP b c a9.286; 11.4809; 12.6469
90; 90; 90
1348.3Nashawi, Asma; Lawson, Christopher P.; Abdel-Sattar, M. Omar; ter Horst, Joop H.; Coxon, Geoffrey D.; Kennedy, Alan R.
Synthesis and crystal structures of 3-hydroxy-2,4-dimethyl-2<i>H</i>-thiophen-5-one and 3-hydroxy-4-methyl-2<i>H</i>-thiophen-5-one
Acta Crystallographica Section E, 2020, 76, 1158-1162
2243457 CIF
HKL
C18 H14 Fe O2C 1 2/c 135.4613; 5.6873; 13.1523
90; 100.202; 90
2610.61Pokharel, Uttam R.; Bergeron, Jonathan T.; Fronczek, Frank R.
Synthesis and crystal structures of 2-(ferrocenylcarbonyl)benzoic acid and 3-ferrocenylphthalide
Acta Crystallographica Section E, 2020, 76, 1163-1167
2243456 CIF
HKL
Paper
C18 H14 Fe O3P 1 21/c 117.1332; 7.4478; 11.0345
90; 105.758; 90
1355.14Pokharel, Uttam R.; Bergeron, Jonathan T.; Fronczek, Frank R.
Synthesis and crystal structures of 2-(ferrocenylcarbonyl)benzoic acid and 3-ferrocenylphthalide
Acta Crystallographica Section E, 2020, 76, 1163-1167
2243455 CIF
HKL
Paper
C23 H15 Br Mn N3 O2P 1 21/c 110.497; 14.123; 13.504
90; 96.767; 90
1988Wadayama, Kosei; Takase, Tsugiko; Oyama, Dai
Selective synthesis and crystal structures of manganese(I) complexes with a bi- or tridentate terpyridine ligand
Acta Crystallographica Section E, 2020, 76, 1139-1142
2243454 CIF
HKL
Paper
C24 H15 Br Mn N3 O3P 1 21/c 111.663; 11.6691; 15.8892
90; 103.077; 90
2106.38Wadayama, Kosei; Takase, Tsugiko; Oyama, Dai
Selective synthesis and crystal structures of manganese(I) complexes with a bi- or tridentate terpyridine ligand
Acta Crystallographica Section E, 2020, 76, 1139-1142
2243453 CIF
HKL
Paper
C10 H9 F3 O3P 1 21/n 110.5916; 9.2081; 20.993
90; 103.304; 90
1992.47Savich, Carolyn Z.; Tanski, Joseph M.
Crystallographic and spectroscopic characterization of racemic Mosher's Acid
Acta Crystallographica Section E, 2020, 76, 1143-1145
2243452 CIF
HKL
Paper
Cu4 H8 O11 SP 1 n 17.84; 6.34; 9.768
90; 107.32; 90
463.51Mills, Stuart; Aishima, Jun; Aragao, David; Caradoc-Davies, Tom Tudor; Cowieson, Nathan; Gee, Christine L.; Ericsson, Daniel; Harrop, Stephen; Panjikar, Santosh; Smith, Kate Mary Louise; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Price, Jason Roy
Crystal structure of posnjakite formed in the first crystal water-cooling line of the ANSTO Melbourne Australian Synchrotron MX1 Double Crystal Monochromator
Acta Crystallographica Section E, 2020, 76, 1136-1138
2243451 CIF
HKL
Paper
C17 H17 N O5 S2P -15.05866; 12.2617; 15.1009
106.149; 96.446; 100.884
869.944Tan, Sang Loon; Tiekink, Edward R. T.
2,2'-(Disulfanediyl)dibenzoic acid <i>N</i>,<i>N</i>-dimethylformamide monosolvate: crystal structure, Hirshfeld surface analysis and computational study
Acta Crystallographica Section E, 2020, 76, 1150-1157
2243450 CIF
HKL
Paper
C13 H9 I N2 O3P n a 2112.8022; 24.4556; 4.1459
90; 90; 90
1298.02Faizi, Md. Serajul Haque; Alagöz, Tenzile; Ahmed, Ruby; Cinar, Emine Berrin; Agar, Erbil; Dege, Necmi; Mashrai, Ashraf
Crystal structure and Hirshfeld surface analysis of 2-{[(4-iodophenyl)imino]methyl}-4-nitrophenol
Acta Crystallographica Section E, 2020, 76, 1146-1149
2243449 CIF
HKL
Paper
C15 H8 N2 S5P b c n3.9458; 11.434; 33.366
90; 90; 90
1505.3Kafuta, Kevin; Golz, Christopher; Alcarazo, Manuel
Polymorphism of bis(1,3-benzothiazol-2-yl) trithiocarbonate
Acta Crystallographica Section E, 2020, 76, 1126-1130
2243448 CIF
HKL
Paper
C15 H8 N2 S5P -16.4976; 9.5593; 13.1962
80.576; 82.312; 86.288
800.55Kafuta, Kevin; Golz, Christopher; Alcarazo, Manuel
Polymorphism of bis(1,3-benzothiazol-2-yl) trithiocarbonate
Acta Crystallographica Section E, 2020, 76, 1126-1130
2243447 CIF
HKL
C13 H12 Br Cl3 O4P 1 21/c 111.7655; 20.464; 6.7332
90; 90.161; 90
1621.1Tiouabi, Mustapha; Tabacchi, Raphaël; Stoeckli-Evans, Helen
Crystal structures and Hirshfeld surface analyses of 6,8-dimethoxy-3-methyl-1<i>H</i>-isochromen-1-one and 5-bromo-6,8-dimethoxy-3-methyl-1<i>H</i>-isochromen-1-one chloroform monosolvate
Acta Crystallographica Section E, 2020, 76, 1107-1112
2243446 CIF
HKL
C12 H12 O4P b c a12.7875; 11.3732; 14.3637
90; 90; 90
2089Tiouabi, Mustapha; Tabacchi, Raphaël; Stoeckli-Evans, Helen
Crystal structures and Hirshfeld surface analyses of 6,8-dimethoxy-3-methyl-1<i>H</i>-isochromen-1-one and 5-bromo-6,8-dimethoxy-3-methyl-1<i>H</i>-isochromen-1-one chloroform monosolvate
Acta Crystallographica Section E, 2020, 76, 1107-1112
2243445 CIF
HKL
C17 H17 Cl2 N3P -19.5967; 9.6767; 10.8043
114.162; 109.93; 90.917
846.3Özkaraca, Kadriye; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Askerova, Ulviyya F.; Suleymanova, Gulnar T.; Mammadova, Gunay Z.; Mlowe, Sixberth
Crystal structure and Hirshfeld surface analysis of 4-{2,2-dichloro-1-[(<i>E</i>)-2-(4-methylphenyl)diazen-1-yl]ethenyl}-<i>N</i>,<i>N</i>-dimethylaniline
Acta Crystallographica Section E, 2020, 76, 1122-1125
2243444 CIF
HKL
Paper
C21 H18 O7P 21 21 217.4958; 12.422; 20.325
90; 90; 90
1892.5Leepasert, Theerachart; Saparpakorn, Patchreenart; Chainok, Kittipong; Duangthongyou, Tanwawan
Crystal structure of 5-[(benzoyloxy)methyl]-5,6-dihydroxy-4-oxocyclohex-2-en-1-yl benzoate
Acta Crystallographica Section E, 2020, 76, 1096-1100
2243443 CIF
HKL
Paper
C16 H14 N6 O12 ZnP b c a10.26799; 18.26557; 21.67365
90; 90; 90
4064.91Ibragimov, Avazbek; Ashurov, Jamshid; Dusmatov, Aziz; Ibragimov, Aziz
Crystal structure and Hirshfeld surface analysis of the orthorhombic polymorph of a Zn^II^ complex with 3,5-dinitrobenzoic acid and ethylenediamine
Acta Crystallographica Section E, 2020, 76, 1113-1116
2243442 CIF
HKL
C14 H18 O8P -18.5628; 9.6623; 9.9767
112.534; 94.744; 97.999
746.6Tiouabi, Mustapha; Tabacchi, Raphaël; Stoeckli-Evans, Helen
The crystal structure, Hirshfeld surface analysis and energy frameworks of 2-[2-(methoxycarbonyl)-3,6-bis(methoxymethoxy)phenyl]acetic acid
Acta Crystallographica Section E, 2020, 76, 1101-1106
2243441 CIF
HKL
Paper
C15 H15 N OP 1 c 113.8433; 7.0774; 6.2142
90; 95.517; 90
606.01Yagci, Nermin Kahveci; Faizi, Md. Serajul Haque; Aydin, Alev Sema; Dege, Necmi; Dogan, Onur Erman; Agar, Erbil; Mashrai, Ashraf
Crystal structure, Hirshfeld surface analysis and DFT studies of (<i>E</i>)-4-methyl-2-{[(4-methylphenyl)imino]methyl}phenol
Acta Crystallographica Section E, 2020, 76, 1075-1079
2243440 CIF
HKL
Paper
C27 H28 N2 O SP 1 21/c 122.927; 5.9315; 17.191
90; 97.734; 90
2316.6Sheakh Mohamad, Ropak A.; Aziz, Hashim J.; Hamad, Wali M.
Crystal structure and Hirshfeld surface analysis of 4-{[(<i>E</i>)-4-(heptyloxy)benzylidene]amino}-<i>N</i>-(naphthalen-2-yl)-1,3-thiazol-2-amine
Acta Crystallographica Section E, 2020, 76, 1092-1095
2243439 CIF
HKL
Paper
C23 H24 N2 O9C 1 2/c 123.6396; 8.2906; 24.7683
90; 110.013; 90
4561.13Dallasta Pedroso, Sofia; Caracelli, Ignez; Zukerman-Schpector, Julio; Soto-Monsalve, Monica; De Almeida Santos, Regina H.; Correia, Carlos Roque D.; Llanes Garcia, Ariel L.; Kwong, Huey Chong; Tiekink, Edward R. T.
4-Nitrobenzyl 3,4-bis(acetyloxy)-2-(4-methoxyphenyl)pyrrolidine-1-carboxylate: crystal structure, Hirshfeld surface analysis and computational chemistry
Acta Crystallographica Section E, 2020, 76, 1080-1086
2243438 CIF
HKL
Paper
C10 H15 N O2 SC 1 c 115.9353; 10.3526; 14.8486
90; 115.135; 90
2217.7Stenfors, Brock A.; Collins, Rachel C.; Duran, Jonah R. J.; Staples, Richard J.; Biros, Shannon M.; Ngassa, Felix N.
Crystal structure of 4-methyl-<i>N</i>-propylbenzenesulfonamide
Acta Crystallographica Section E, 2020, 76, 1070-1074
2243437 CIFC12 H14 O3P b c n12.9747; 10.5449; 7.48
90; 90; 90
1023.39Fortes, A. Dominic
Phenol hemihydrate: redetermination of the crystal structure by neutron powder diffraction, Hirshfeld surface analysis and characterization of the thermal expansion
Acta Crystallographica Section E, 2020, 76, 1062-1069
2243436 CIFC12 H14 O3P b c n13.1334; 10.6781; 7.6125
90; 90; 90
1067.57Fortes, A. Dominic
Phenol hemihydrate: redetermination of the crystal structure by neutron powder diffraction, Hirshfeld surface analysis and characterization of the thermal expansion
Acta Crystallographica Section E, 2020, 76, 1062-1069
2243435 CIFC12 H14 O3P b c n13.0747; 10.9656; 7.5822
90; 90; 90
1087.07Fortes, A. Dominic
Phenol hemihydrate: redetermination of the crystal structure by neutron powder diffraction, Hirshfeld surface analysis and characterization of the thermal expansion
Acta Crystallographica Section E, 2020, 76, 1062-1069
2243434 CIF
HKL
Paper
C20 H20 N4 O3P 1 21/c 111.4312; 9.3013; 18.737
90; 104.695; 90
1927Caracelli, Ignez; Zukerman-Schpector, Julio; Kwong, Huey Chong; Tiekink, Edward R. T.
Methyl 3-[(1-benzyl-4-phenyl-1<i>H</i>-1,2,3-triazol-5-yl)formamido]propanoate: crystal structure, Hirshfeld surface analysis and computational chemistry
Acta Crystallographica Section E, 2020, 76, 1051-1056
2243433 CIF
HKL
Paper
C10 H28 Cu N2 O8P 1 21/n 17.1195; 12.3172; 19.859
90; 91.16; 90
1741.12Qadir, Adnan M.; Kansiz, Sevgi; Dege, Necmi; Rosair, Georgina M.; Iskenderov, Turganbay S.
Crystal structure and Hirshfeld surface analysis of one-dimensional copper(II) coordination polymer incorporating succinate and tetramethylethylenediamine ligands
Acta Crystallographica Section E, 2020, 76, 1038-1041
2243432 CIF
HKL
Paper
C22 H23 N7 O4 SP -18.5631; 11.1242; 13.5632
70.244; 76.086; 84.058
1179.92Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Kadambar, Anish Kumar; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher
Two <i>N</i>-{[4-(3-aryl-4-sydnonylideneamino)-5-sulfanylidene-1<i>H</i>-1,2,4-triazol-3-yl]methyl}benzamides as disordered ethanol monosolvates
Acta Crystallographica Section E, 2020, 76, 1057-1061
2243431 CIF
HKL
Paper
C21 H21 N7 O4 SP -18.6313; 10.8378; 13.384
66.645; 79.287; 85.151
1129.3Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Kadambar, Anish Kumar; Kalluraya, Balakrishna; Foro, Sabine; Glidewell, Christopher
Two <i>N</i>-{[4-(3-aryl-4-sydnonylideneamino)-5-sulfanylidene-1<i>H</i>-1,2,4-triazol-3-yl]methyl}benzamides as disordered ethanol monosolvates
Acta Crystallographica Section E, 2020, 76, 1057-1061
2243430 CIF
HKL
Paper
C16 H14 Cl3 N3P -19.7515; 9.8203; 26.6696
92.338; 91.212; 94.048
2544.7Atioğlu, Zeliha; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Mukhtarova, Sevinc H.; Suleymanova, Gulnar T.; Toze, Flavien A. A.
Crystal structure and Hirshfeld surface analysis of 4-{2,2-dichloro-1-[(<i>E</i>)-(4-chlorophenyl)diazenyl]ethenyl}-<i>N</i>,<i>N</i>-dimethylaniline
Acta Crystallographica Section E, 2020, 76, 1033-1037
2243429 CIF
HKL
Paper
C43 H88 K2 N6 O14P n a 2121.1326; 8.547; 29.9188
90; 90; 90
5403.9Chung, Amanda B.; Ziller, Joseph W.; Evans, William J.
Reductive cleavage of <i>N</i>,<i>N</i>'-di-<i>tert</i>-butylcarbodiimide generates <i>tert</i>-butylcyanamide ligands, (Me~3~CNCN)^{-^}, that bind potassium both end-on and side-on in the same single crystal
Acta Crystallographica Section E, 2020, 76, 1047-1050
2243428 CIF
HKL
Paper
C13 H21 N O2 SP 1 c 112.87828; 6.88418; 16.208
90; 108.151; 90
1365.44Stenfors, Brock A.; Staples, Richard J.; Biros, Shannon M.; Ngassa, Felix N.
Crystal structure of <i>N</i>,<i>N</i>-diisopropyl-4-methylbenzenesulfonamide
Acta Crystallographica Section E, 2020, 76, 1018-1021
2243427 CIF
HKL
Paper
C21 H24 Cl N O6 PtP -17.8746; 9.7566; 15.0004
95.782; 102.874; 93.843
1113.02Chi, Nguyen Thi Thanh; Thong, Pham Van; Van Meervelt, Luc
Crystal structures of three platinacyclic complexes bearing isopropyl eugenoxyacetate and pyridine derivatives
Acta Crystallographica Section E, 2020, 76, 1012-1017
2243426 CIF
HKL
Paper
C21 H26 Cl N O4 PtP -18.36089; 9.12717; 14.5582
94.9089; 102.277; 100.454
1058.58Chi, Nguyen Thi Thanh; Thong, Pham Van; Van Meervelt, Luc
Crystal structures of three platinacyclic complexes bearing isopropyl eugenoxyacetate and pyridine derivatives
Acta Crystallographica Section E, 2020, 76, 1012-1017
2243425 CIF
HKL
Paper
C20 H24 Cl N O4 PtP -18.3146; 8.6714; 14.5827
90.534; 104.376; 101.135
997.49Chi, Nguyen Thi Thanh; Thong, Pham Van; Van Meervelt, Luc
Crystal structures of three platinacyclic complexes bearing isopropyl eugenoxyacetate and pyridine derivatives
Acta Crystallographica Section E, 2020, 76, 1012-1017
2243424 CIF
HKL
Paper
C35 H36 N4 O3P 1 21/c 19.3903; 26.8178; 11.5639
90; 101.635; 90
2852.3Suramitr, Songwut; Teanwarawat, Jitpinan; Ithiapa, Nuttapong; Wattanathana, Worawat; Suramitr, Anwaraporn
Crystal structure, Hirshfeld surface analysis and computational study of a rhodamine B‒salicylaldehyde Schiff base derivative
Acta Crystallographica Section E, 2020, 76, 1027-1032
2243423 CIF
HKL
Paper
C7 H5 F N4 SC 1 2/c 123.5593; 9.2849; 7.7927
90; 104.009; 90
1653.92Askerov, Rizvan K.; Maharramov, Abel M.; Khalilov, Ali N.; Akkurt, Mehmet; Akobirshoeva, Anzurat A.; Osmanov, V. K.; Borisov, A. V.
Crystal structure and Hirshfeld surface analysis of 1-(2-fluorophenyl)-1<i>H</i>-tetrazole-5(4<i>H</i>)-thione
Acta Crystallographica Section E, 2020, 76, 1007-1011
2243422 CIF
HKL
C16 H24 Cu4 I4 N2 S6P -17.7713; 8.9456; 11.2464
106.839; 104.644; 93.412
716.53Assoumatine, Tokouré; Stoeckli-Evans, Helen
Crystal structures of [(μ~2~-L1)dibromidodicopper(II)] dibromide and poly[[(μ~2~-L1)diiodidodicopper(I)]-di-μ-iodido-dicopper(I)], where L1 is 2,5,8,11,14,17-hexathia-[9.9](2,6,3,5)-pyrazinophane
Acta Crystallographica Section E, 2020, 76, 984-989
2243421 CIF
HKL
C16 H24 Br4 Cu2 N2 S6P -17.209; 8.1422; 12.3904
71.842; 74.702; 72.694
647.93Assoumatine, Tokouré; Stoeckli-Evans, Helen
Crystal structures of [(μ~2~-L1)dibromidodicopper(II)] dibromide and poly[[(μ~2~-L1)diiodidodicopper(I)]-di-μ-iodido-dicopper(I)], where L1 is 2,5,8,11,14,17-hexathia-[9.9](2,6,3,5)-pyrazinophane
Acta Crystallographica Section E, 2020, 76, 984-989
2243420 CIF
HKL
Paper
Co4 H O13 P3 SrP 21 21 215.1245; 12.0491; 15.7118
90; 90; 90
970.13Cherif, Fatima-Zahra; Taibi, Mhamed; Boukhari, Ali; Aride, Jilali; Assani, Abderrazzak; Saadi, Mohamed; El Ammari, Lahcen
Crystal structure of SrCo~4~(OH)(PO~4~)~3~, a new hydroxyphosphate
Acta Crystallographica Section E, 2020, 76, 1022-1026
2243419 CIF
HKL
Paper
C20 H21 N3 O3P 1 21/c 116.212; 5.9584; 19.45
90; 110.537; 90
1759.4Taia, Abdelmaoujoud; Essaber, Mohamed; Aatif, Abdeljalil; Chkirate, Karim; Hökelek, Tuncer; Mague, Joel T.; Sebbar, Nada Kheira
Crystal structure, Hirshfeld surface analysis, interaction energy and DFT studies of 4-[(4-allyl-2-methoxyphenoxy)methyl]-1-(4-methoxyphenyl)-1<i>H</i>-1,2,3-triazole
Acta Crystallographica Section E, 2020, 76, 962-966
2243418 CIF
HKL
Paper
C12 H16 N2 O3 SP -17.1608; 8.8771; 10.0728
96.815; 96.057; 95.99
627.78Tan, Sang Loon; Tiekink, Edward R. T.
2-[Carbamothioyl(2-hydroxyethyl)amino]ethyl benzoate: crystal structure, Hirshfeld surface analysis and computational study
Acta Crystallographica Section E, 2020, 76, 933-939
2243417 CIF
HKL
Paper
C5 H6 Cd N4 O5 SP 1 21/c 19.3; 7.9798; 13.2586
90; 106.872; 90
941.6Jiajaroen, Suwadee; Chainok, Kittipong
Crystal structure of a cadmium sulfate coordination polymer based on the 3,6-bis(pyrimidin-2-yl)-1,4-dihydro-1,2,4,5-tetrazine ligand
Acta Crystallographica Section E, 2020, 76, 958-961
2243416 CIF
HKL
Paper
C23 H20 N2 O SP 1 21/c 119.1636; 6.0482; 17.023
90; 104.37; 90
1911.33Sheakh Mohamad, Ropak A.; Hamad, Wali M.; Aziz, Hashim J.
Crystal structure and Hirshfeld surface analysis of 4-(naphthalen-2-yl)-<i>N</i>-[(<i>Z</i>)-4-propoxybenzylidene]-1,3-thiazol-2-amine
Acta Crystallographica Section E, 2020, 76, 920-923
2243415 CIF
HKL
Paper
C13 H19 N O8P -16.8291; 7.867; 15.814
100.607; 99.011; 105.054
787.5Dallasta Pedroso, Sofia; Caracelli, Ignez; Zukerman-Schpector, Julio; Soto-Monsalve, Monica; De Almeida Santos, Regina H.; Correia, Carlos Roque D.; Llanes Garcia, Ariel L.; Kwong, Huey Chong; Tiekink, Edward R. T.
1-Ethyl 2-methyl 3,4-bis(acetyloxy)pyrrolidine-1,2-dicarboxylate: crystal structure, Hirshfeld surface analysis and computational chemistry
Acta Crystallographica Section E, 2020, 76, 967-972
2243414 CIF
HKL
C20 H38 O4P 1 21 17.04; 5.438; 25.56
90; 91.914; 90
978Geburtig, Felix; Vill, Volkmar
2-<i>O</i>-Monoalkyl isosorbide ethers with C8, C10, C12 and C14 chain lengths
Acta Crystallographica Section E, 2020, 76, 924-928
2243413 CIF
HKL
C18 H34 O4P 1 21 17.025; 5.4674; 23.377
90; 97.051; 90
891.08Geburtig, Felix; Vill, Volkmar
2-<i>O</i>-Monoalkyl isosorbide ethers with C8, C10, C12 and C14 chain lengths
Acta Crystallographica Section E, 2020, 76, 924-928
2243412 CIF
HKL
C16 H30 O4P 1 21 16.9892; 5.4888; 20.8041
90; 91.302; 90
797.89Geburtig, Felix; Vill, Volkmar
2-<i>O</i>-Monoalkyl isosorbide ethers with C8, C10, C12 and C14 chain lengths
Acta Crystallographica Section E, 2020, 76, 924-928
2243411 CIF
HKL
Paper
C14 H26 O4P 1 21 17.0008; 5.5112; 18.544
90; 100.155; 90
704.3Geburtig, Felix; Vill, Volkmar
2-<i>O</i>-Monoalkyl isosorbide ethers with C8, C10, C12 and C14 chain lengths
Acta Crystallographica Section E, 2020, 76, 924-928
2243410 CIF
Paper
C6 H7 Br N2 O3P 1 21/c 19.7123; 23.4964; 7.6264
90; 97.052; 90
1727.2Anbarasan, Radhakrishnan; Eniya, Palaniyasan; Kalyana Sundar, Jeyaperumal; Mengesha Woldemariam, Menberu
Crystal structure and Hirshfeld surface analysis of 4-bromoanilinium nitrate
Acta Crystallographica Section E, 2020, 76, 973-976
2243409 CIF
HKL
Paper
C24 H20 N2 O6P 1 21/n 17.9074; 12.4794; 10.6248
90; 102.394; 90
1024Bogdanov, Georgii; Oskolkov, Evgenii; Bustos, Jenna; Glebov, Viktor; Tillotson, John P.; Timofeeva, Tatiana V.
Molecular and crystal structure, optical properties and DFT studies of 1,4-dimethoxy-2,5-bis[2-(4-nitrophenyl)ethenyl]benzene
Acta Crystallographica Section E, 2020, 76, 940-943
2243408 CIF
HKL
C51 H42 O5P 1 21/c 111.3654; 14.243; 25.168
90; 91.207; 90
4073.2Meng, Xiang-Zhen; Cheng, Dong
Crystal structure of dimethyl 5-(4-ethylphenyl)-4-[(4-ethylphenyl)ethynyl]-6,11-diphenyl-1,3,6,11-tetrahydro-2<i>H</i>-6,11-epoxycyclopenta[<i>a</i>]anthracene-2,2-dicarboxylate
Acta Crystallographica Section E, 2020, 76, 954-957
2243407 CIF
HKL
Paper
C72 H90 N8 Ni2 O11 Si2C 1 2/c 125.39; 7.3865; 18.2424
90; 98.161; 90
3386.6Gavrish, Sergey P.; Shova, Sergiu; Cazacu, Maria; Lampeka, Yaroslaw D.
Crystal structure of the one-dimensional coordination polymer formed by the macrocyclic [Ni(cyclam)]^2+^ cation and the dianion of diphenylsilanediylbis(4-benzoic acid)
Acta Crystallographica Section E, 2020, 76, 929-932
2243406 CIF
HKL
Paper
C14 H14 Mn N4 O4P 1 21/n 111.5171; 4.4212; 13.9752
90; 104.698; 90
688.32Khosa, Muhammad Kaleem; Wood, Paul T.; Humphrey, Simon M.; Harrison, William T. A.
Hydrothermal synthesis and crystal structure of poly[bis(μ~3~-3,4-diaminobenzoato)manganese], a layered coordination polymer
Acta Crystallographica Section E, 2020, 76, 909-913
2243405 CIF
HKL
Paper
C19 H17 N O5P 1 21/c 19.3581; 10.5306; 17.0141
90; 91.967; 90
1675.69Muslim, Mohd; Ali, Arif; Kamaal, Saima; Ahmad, Musheer; Afzal, Mohd; Plutenko, Maksym O.
Crystal structure and Hirshfeld surface analysis of diethyl 5-(2-cyanophenoxy)isophthalate
Acta Crystallographica Section E, 2020, 76, 905-908
2243404 CIF
HKL
C30 H30 N4 O6P 1 21/n 116.326; 8.0566; 20.565
90; 104.497; 90
2618.8Tojiboev, Akmal; Zhurakulov, Sherzod; Vinogradova, Valentina; Englert, Ulli; Wang, Ruimin
Stereochemistry of the methylidene-bridged quinazoline-isoquinoline alkaloid 3-{[6,7-dimethoxy-1-(4-nitrophenyl)-1,2,3,4-tetrahydroisoquinolin-2-yl]methylidene}-1,2,3,9-tetrahydropyrrolo[2,1-<i>b</i>]quinazolin-9-one methanol monosolvate
Acta Crystallographica Section E, 2020, 76, 914-919
2243403 CIF
HKL
Paper
C22 H25 N O SP -18.8581; 9.183; 13.021
106.474; 109.398; 93.383
944.2Sebbar, Ghizlane; Hni, Brahim; Hökelek, Tuncer; Mague, Joel T.; Sebbar, Nada Kheira; Belkadi, Bouchra; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis and interaction energy, DFT and antibacterial activity studies of (<i>Z</i>)-4-hexyl-2-(4-methylbenzylidene)-2<i>H</i>-benzo[<i>b</i>][1,4]thiazin-3(4<i>H</i>)-one
Acta Crystallographica Section E, 2020, 76, 889-895
2243402 CIF
HKL
Paper
C31 H40 Cl F N4 O7P 1 21/n 110.7716; 7.4153; 38.175
90; 92.311; 90
3046.7George, Christy P.; Sangtani, Ekta; Gonnade, Rajesh G.
Crystal structure of a 1:1 co-crystal of the anticancer drug gefitinib with azelaic acid
Acta Crystallographica Section E, 2020, 76, 884-888
2243401 CIF
HKL
C30 H24 O2P 21 21 217.3431; 11.5468; 25.7555
90; 90; 90
2183.79Brown, Loren C.; Iacono, Scott T.; Balaich, Gary J.
Crystal structures of 6-cyclopropyl-1,3-diphenylfulvene and 6-(2,3-dimethoxynaphthyl)-1,3-diphenylfulvene
Acta Crystallographica Section E, 2020, 76, 896-899
2243400 CIF
HKL
Paper
C21 H18P b c a12.9844; 11.9583; 19.3729
90; 90; 90
3008.06Brown, Loren C.; Iacono, Scott T.; Balaich, Gary J.
Crystal structures of 6-cyclopropyl-1,3-diphenylfulvene and 6-(2,3-dimethoxynaphthyl)-1,3-diphenylfulvene
Acta Crystallographica Section E, 2020, 76, 896-899
2243399 CIF
HKL
C15 H11 N O5P 1 21/c 112.209; 14.307; 7.418
90; 92.815; 90
1294.2Bogdanov, Georgii; Bustos, Jenna; Glebov, Viktor; Oskolkov, Evgenii; Tillotson, John P.; Timofeeva, Tatiana V.
Molecular and crystal structure, lattice energy and DFT calculations of two 2'-(nitrobenzoyloxy)acetophenone isomers
Acta Crystallographica Section E, 2020, 76, 857-861
2243398 CIF
HKL
Paper
C15 H11.15 N O5.07C 1 2/c 126.225; 7.9955; 13.772
90; 111.08; 90
2694.5Bogdanov, Georgii; Bustos, Jenna; Glebov, Viktor; Oskolkov, Evgenii; Tillotson, John P.; Timofeeva, Tatiana V.
Molecular and crystal structure, lattice energy and DFT calculations of two 2'-(nitrobenzoyloxy)acetophenone isomers
Acta Crystallographica Section E, 2020, 76, 857-861
2243397 CIF
HKL
Paper
C14 H12 Cl N2 O3P -17.7817; 9.5743; 11.1516
113.721; 90.064; 112.397
691.47Tan, Sang Loon; Tiekink, Edward R. T.
Crystal structure, Hirshfeld surface analysis and computational study of the 1:2 co-crystal formed between <i>N</i>,<i>N</i>'-bis[(pyridin-4-yl)methyl]ethanediamide and 3-chlorobenzoic acid
Acta Crystallographica Section E, 2020, 76, 870-876
2243396 CIF
HKL
C64 H72.44 Cl3 Mn5 N9 Na O27.72P 1 n 114.1955; 16.3349; 16.6144
90; 94.235; 90
3842.1Zaleski, Curtis M.; Zeller, Matthias
Synthesis and crystal structure of two manganese-based 12-metallacrown-4 complexes: Na~2~(3-chlorobenzoate)~2~[12-MC~Mn(III)N(shi)~-4](DMF)~6~ and MnNa(3-chlorobenzoate)~3~[12-MC~Mn(III)N(shi)~-4](DMF)(H~2~O)~4~·4DMF·0.72H~2~O
Acta Crystallographica Section E, 2020, 76, 848-856
2243395 CIF
HKL
Paper
C60 H66.01 Cl2 Mn4 N10 Na2 O22P -112.0423; 12.3722; 12.6875
102.839; 111.628; 90.722
1704Zaleski, Curtis M.; Zeller, Matthias
Synthesis and crystal structure of two manganese-based 12-metallacrown-4 complexes: Na~2~(3-chlorobenzoate)~2~[12-MC~Mn(III)N(shi)~-4](DMF)~6~ and MnNa(3-chlorobenzoate)~3~[12-MC~Mn(III)N(shi)~-4](DMF)(H~2~O)~4~·4DMF·0.72H~2~O
Acta Crystallographica Section E, 2020, 76, 848-856
2243394 CIF
HKL
Paper
C14 H21 F N2 O7P 21 21 217.0961; 7.4967; 30.757
90; 90; 90
1636.19Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Archana, Sreeramapura D.; Foro, Sabine; Glidewell, Christopher
Three 4-(4-fluorophenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 841-847
2243393 CIF
HKL
Paper
C12 H15 F N2 O4P 1 21/c 117.0606; 5.782; 12.5815
90; 102.761; 90
1210.44Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Archana, Sreeramapura D.; Foro, Sabine; Glidewell, Christopher
Three 4-(4-fluorophenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 841-847
2243392 CIF
HKL
Paper
C17 H17 F N4 O7P 1 21/c 110.6829; 13.1701; 13.5563
90; 108.97; 90
1803.71Harish Chinthal, Chayanna; Yathirajan, Hemmige S.; Archana, Sreeramapura D.; Foro, Sabine; Glidewell, Christopher
Three 4-(4-fluorophenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions
Acta Crystallographica Section E, 2020, 76, 841-847
2243391 CIF
HKL
Paper
C48 H20 Cu F20 O10 S3P 1 21/c 17.7343; 46.8973; 13.258
90; 99.211; 90
4746.9Habuka, Yusuke; Takeuchi, Emily Ami; Hori, Akiko
Co-crystal structure, Hirshfeld surface analysis and DFT studies of 3,4-ethylenedioxythiophene solvated bis[1,3-bis(pentafluorophenyl)propane-1,3-dionato]copper(II)
Acta Crystallographica Section E, 2020, 76, 820-825
2243390 CIF
HKL
Paper
C16 H21 N O6 VP 1 21/n 19.6619; 11.9922; 15.344
90; 94.651; 90
1772Rood, Jeffrey A.; Reehl, Steven R.; Jacoby, Kaitlyn A.; Oliver, Allen
Crystal structures of a series of bis(acetylacetonato)oxovanadium(IV) complexes containing N-donor pyridyl ligands
Acta Crystallographica Section E, 2020, 76, 826-830
2243389 CIF
HKL
Paper
C16 H18 N2 O5 VC 1 2/c 19.193; 13.508; 13.3651
90; 99.03; 90
1639.1Rood, Jeffrey A.; Reehl, Steven R.; Jacoby, Kaitlyn A.; Oliver, Allen
Crystal structures of a series of bis(acetylacetonato)oxovanadium(IV) complexes containing N-donor pyridyl ligands
Acta Crystallographica Section E, 2020, 76, 826-830
2243388 CIF
HKL
Paper
C15 H19 N O5 VC 1 2/c 17.882; 15.2092; 13.9871
90; 103.367; 90
1631.33Rood, Jeffrey A.; Reehl, Steven R.; Jacoby, Kaitlyn A.; Oliver, Allen
Crystal structures of a series of bis(acetylacetonato)oxovanadium(IV) complexes containing N-donor pyridyl ligands
Acta Crystallographica Section E, 2020, 76, 826-830
2243387 CIF
HKL
Paper
C18 H22 N2 O4 SP 1 21 14.7274; 17.782; 10.734
90; 98.994; 90
891.23Gelbrich, Thomas; Kahlenberg, Volker; Adamer, Verena; Nerdinger, Sven; Griesser, Ulrich J.
Febuxostat ethanol monosolvate
Acta Crystallographica Section E, 2020, 76, 816-819
2243386 CIF
HKL
Paper
C16 H14 Cl2 F N3P 21 21 216.073; 15.9782; 16.386
90; 90; 90
1590.03Özkaraca, Kadriye; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Askerova, Ulviyya F.; Suleymanova, Gulnar T.; Shikhaliyeva, Irada M.; Bhattarai, Ajaya
Crystal structure and Hirshfeld surface analysis of 4-{2,2-dichloro-1-[(<i>E</i>)-(4-fluorophenyl)diazenyl]ethenyl}-<i>N</i>,<i>N</i>-dimethylaniline
Acta Crystallographica Section E, 2020, 76, 811-815
2243385 CIF
HKL
C17 H27 N O2P 1 21/c 16.8817; 28.249; 8.1369
90; 99.649; 90
1559.4Tiouabi, Mustapha; Tabacchi, Raphaël; Stoeckli-Evans, Helen
The crystal structure and Hirshfeld surface analysis of 1-(2,5-dimethoxyphenyl)-2,2,6,6-tetramethylpiperidine
Acta Crystallographica Section E, 2020, 76, 794-797
2243384 CIF
HKL
Paper
C14 H16P 1 21/c 111.3214; 6.7426; 14.9478
90; 107.234; 90
1089.82Domasevitch, Kostiantyn V.; Degtyarenko, Anna S.
Crystal structure and Hirshfeld surface analysis of 1,3-diethynyladamantane
Acta Crystallographica Section E, 2020, 76, 807-810
2243383 CIF
HKL
Paper
C17 H14 N2 OP 1 21/c 19.071; 12.0526; 24.612
90; 95.999; 90
2676.1Daouda, Ballo; Tuo, Nanou Tiéba; Kangah, Niameke Jean-Baptiste; Hökelek, Tuncer; Kodjo, Charles Guillaume; Retailleau, Pascal; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis and DFT studies of 2-(2,3-dihydro-1<i>H</i>-perimidin-2-yl)phenol
Acta Crystallographica Section E, 2020, 76, 798-802
2243382 CIF
HKL
Paper
C14 H16 Cl4 Cu2 N4P -17.7054; 7.724; 8.5606
103.659; 98.803; 110.273
448.74Vassilyeva, Olga Yu.; Buvaylo, Elena A.; Kokozay, Vladimir N.; Melnyk, Andrii K.; Skelton, Brian W.
Crystal structure and characterization of a new copper(II) chloride dimer with methyl(pyridin-2-ylmethylidene)amine
Acta Crystallographica Section E, 2020, 76, 790-793
2243381 CIF
HKL
Paper
C24 H18 N6 O3P 1 21/n 18.2807; 14.1554; 17.502
90; 98.92; 90
2026.71Senior, Levi; Linden, Anthony
The missing crystal structure in the series of <i>N</i>,<i>N</i>',<i>N</i>''-tris(pyridin-2-yl)benzene-1,3,5-tricarboxamides: the 2-pyridinyl derivative
Acta Crystallographica Section E, 2020, 76, 776-779
2243380 CIF
HKL
Paper
C7 H12 F5 N6 O VP 1 21/n 16.5915; 12.1969; 15.5669
90; 97.617; 90
1240.47Senchyk, Ganna A.; Lysenko, Andrey B.; Krautscheid, Harald; Domasevitch, Kostiantyn V.
Crystal structure and Hirshfeld surface analysis of 4,4'-(propane-1,3-diyl)bis(4<i>H</i>-1,2,4-triazol-1-ium) pentafluoridooxidovanadate(V)
Acta Crystallographica Section E, 2020, 76, 780-784
2243379 CIF
HKL
Paper
C9 H9 N O4P 21 21 214.9279; 10.635; 15.8788
90; 90; 90
832.18Greene, John; Kopplin, Noa; Roireau, Jack; Bezpalko, Mark; Kassel, Scott; Giuliano, Michael W.; Giuliano, Robert
Synthesis and crystal structure of (2<i>S</i>,4a<i>R</i>,8a<i>R</i>)-6-oxo-2,4a,6,8a-tetrahydropyrano[3,2-<i>b</i>]pyran-2-carboxamide
Acta Crystallographica Section E, 2020, 76, 761-764
2243378 CIF
HKL
Paper
C19 H17 Cl N4 O2P 1 21/n 110.5673; 8.0182; 21.2318
90; 95.282; 90
1791.35Pokhodylo, Nazariy; Slyvka, Yurii; Pavlyuk, Volodymyr
Synthesis, crystal structure and Hirshfeld surface analysis of <i>N</i>-(4-chlorophenyl)-5-cyclopropyl-1-(4-methoxyphenyl)-1<i>H</i>-1,2,3-triazole-4-carboxamide
Acta Crystallographica Section E, 2020, 76, 756-760
2243377 CIF
HKL
Paper
C43 H55 Cu5 Mn N9 O19P 1 21/n 119.0669; 14.2943; 19.345
90; 95.1476; 90
5251.2Van Trieste III, Gerard P.; Zeller, Matthias; Zaleski, Curtis M.
Synthesis and crystal structure of a pentacopper(II) 12-metallacrown-4: <i>cis</i>-diaquatetrakis(dimethylformamide-κ<i>O</i>)manganese(II) tetrakis(μ~3~-<i>N</i>,2-dioxidobenzene-1-carboximidate)pentacopper(II) dimethylformamide monosolvate
Acta Crystallographica Section E, 2020, 76, 747-751
2243376 CIF
HKL
Paper
C35 H34 Cl Co N3 P S4P -19.0954; 13.4319; 14.7905
97.074; 94.68; 107.354
1698.1Williams, DaShawn; Brannon, Jacob P.; Chandrasekaran, Perumalreddy; Stieber, S. Chantal E.
A five-coordinate cobalt bis(dithiolene)‒phosphine complex [Co(pdt)~2~(PTA)] (pdt = phenyldithiolene; PTA = 1,3,5-triaza-7-phosphaadamantane)
Acta Crystallographica Section E, 2020, 76, 736-741
2243375 CIF
HKL
C23 H28 F3 N OP 1 21/c 115.6783; 15.788; 8.7054
90; 91.217; 90
2154.4Kan Kaynar, Nihal; Tanak, Hasan; Macit, Mustafa; Özdemir, Namık
Crystal structure and DFT computational studies of (<i>E</i>)-2,4-di-<i>tert</i>-butyl-6-{[3-(trifluoromethyl)benzyl]iminomethyl}phenol
Acta Crystallographica Section E, 2020, 76, 732-735
2243374 CIF
HKL
Paper
C28 H20 N2 O2P 1 21/n 19.4693; 8.7384; 24.5049
90; 91.792; 90
2026.7Ahmed, Ruby; Doğan, Onur Erman; Ali, Farman; Ahmad, Musheer; Ahmed, Adeeba; Dege, Necmi; Golenia, Irina A.
Crystal structure and Hirshfeld surface analysis of 2-phenyl-1<i>H</i>-phenanthro[9,10-<i>d</i>]imidazol-3-ium benzoate
Acta Crystallographica Section E, 2020, 76, 724-727
2243373 CIF
HKL
Paper
C19 H20 F6 N2 O5P b c a13.2518; 12.1773; 25.8419
90; 90; 90
4170.14Sugiyama, Haruki
Hydrogen-bonding patterns in 2,2-bis(4-methylphenyl)hexafluoropropane pyridinium and ethylenediammonium salt crystals
Acta Crystallographica Section E, 2020, 76, 742-746
2243372 CIF
HKL
Paper
C22 H15 F6 N O4P 1 21/c 125.5453; 13.4125; 11.8879
90; 91.644; 90
4071.4Sugiyama, Haruki
Hydrogen-bonding patterns in 2,2-bis(4-methylphenyl)hexafluoropropane pyridinium and ethylenediammonium salt crystals
Acta Crystallographica Section E, 2020, 76, 742-746
2243371 CIF
HKL
Paper
C25 H24 N2 O3P 1 21/n 110.6878; 8.9088; 21.9503
90; 99.049; 90
2064Ahmed, Adeeba; Ahmad, Aiman; Ahmad, Musheer; Kalibabchuk, Valentina A.
Crystal structure and Hirshfeld surface analysis of 4-{[(anthracen-9-yl)methyl]amino}benzoic acid dimethylformamide monosolvate
Acta Crystallographica Section E, 2020, 76, 728-731
2243370 CIF
HKL
Paper
C25 H20 O2P 1 21/n 110.2365; 9.7989; 19.3759
90; 103.333; 90
1891.14Naghiyev, Farid N.; Akkurt, Mehmet; Askerov, Rizvan K.; Mamedov, Ibrahim G.; Rzayev, Rovnag M.; Chyrka, Taras; Maharramov, Abel M.
Crystal structure and Hirshfeld surface analysis of 6-benzoyl-3,5-diphenylcyclohex-2-en-1-one
Acta Crystallographica Section E, 2020, 76, 720-723
2243369 CIF
HKL
Paper
C29 H21 N5 O2P 1 21/n 19.846; 22.4303; 11.049
90; 104.157; 90
2366Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Asma; Manju, Nagaraja; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher
Functionalized 3-(5-aryloxy-3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)-1-(4-substituted-phenyl)prop-2-en-1-ones: synthetic pathway, and the structures of six examples
Acta Crystallographica Section E, 2020, 76, 683-691
2243368 CIF
HKL
Paper
C25 H17 Cl2 N5 O2C 1 2/c 128.1916; 8.0537; 22.0446
90; 109.07; 90
4730.5Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Asma; Manju, Nagaraja; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher
Functionalized 3-(5-aryloxy-3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)-1-(4-substituted-phenyl)prop-2-en-1-ones: synthetic pathway, and the structures of six examples
Acta Crystallographica Section E, 2020, 76, 683-691
2243367 CIF
HKL
Paper
C26 H21 N5 O2P -19.8432; 11.7441; 12.3005
114.12; 111.139; 96.537
1152.06Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Asma; Manju, Nagaraja; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher
Functionalized 3-(5-aryloxy-3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)-1-(4-substituted-phenyl)prop-2-en-1-ones: synthetic pathway, and the structures of six examples
Acta Crystallographica Section E, 2020, 76, 683-691
2243366 CIF
HKL
Paper
C32 H24 N2 O3P -18.8615; 10.4973; 13.6588
79.006; 89.412; 80.971
1231.54Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Asma; Manju, Nagaraja; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher
Functionalized 3-(5-aryloxy-3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)-1-(4-substituted-phenyl)prop-2-en-1-ones: synthetic pathway, and the structures of six examples
Acta Crystallographica Section E, 2020, 76, 683-691
2243365 CIF
HKL
Paper
C28 H21 Cl N2 O3P -18.9959; 9.738; 13.637
95.901; 94.122; 95.959
1177.8Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Asma; Manju, Nagaraja; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher
Functionalized 3-(5-aryloxy-3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)-1-(4-substituted-phenyl)prop-2-en-1-ones: synthetic pathway, and the structures of six examples
Acta Crystallographica Section E, 2020, 76, 683-691
2243364 CIF
HKL
Paper
C28 H21 Cl N2 O3P -19.909; 10.193; 12.024
90.94; 106.27; 92.75
1163.9Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Asma; Manju, Nagaraja; Kalluraya, Balakrishna; Rathore, Ravindranath S.; Glidewell, Christopher
Functionalized 3-(5-aryloxy-3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)-1-(4-substituted-phenyl)prop-2-en-1-ones: synthetic pathway, and the structures of six examples
Acta Crystallographica Section E, 2020, 76, 683-691
2243363 CIF
HKL
Paper
C33 H39 N6 O3 YbP 1 21/n 110.9428; 9.8253; 28.6089
90; 94.722; 90
3065.5Gajecki, Leah; Twamley, Brendan; Berg, David J.
Synthesis and crystal structures of tetrameric [2-(4,4-dimethyl-2-oxazolin-2-yl)anilido]sodium and tris[2-(4,4-dimethyl-2-oxazolin-2-yl)anilido]ytterbium(III)
Acta Crystallographica Section E, 2020, 76, 703-709
2243362 CIF
HKL
Paper
C44 H52 N8 Na4 O4P -110.9545; 11.8785; 18.8415
105.266; 97.446; 106.12
2217.2Gajecki, Leah; Twamley, Brendan; Berg, David J.
Synthesis and crystal structures of tetrameric [2-(4,4-dimethyl-2-oxazolin-2-yl)anilido]sodium and tris[2-(4,4-dimethyl-2-oxazolin-2-yl)anilido]ytterbium(III)
Acta Crystallographica Section E, 2020, 76, 703-709
2243361 CIF
HKL
Paper
C23 H22 B N O2P c a 2117.854; 11.5361; 18.5366
90; 90; 90
3817.9Gubler, Joël; Chen, Peter
Structure of a push‒pull olefin prepared by ynamine hydroboration with a borandiol ester
Acta Crystallographica Section E, 2020, 76, 710-714
2243360 CIF
HKL
Paper
C17 H16 N2 O3 SP -17.9782; 8.1711; 12.6661
92.214; 93.423; 114.274
749.55Izuogu, David Chukwuma; Asegbeloyin, Jonnie Niyi; Jotani, Mukesh M.; Tiekink, Edward R. T.
2-[(2,4,6-Trimethylbenzene)sulfonyl]phthalazin-1(2<i>H</i>)-one: crystal structure, Hirshfeld surface analysis and computational study
Acta Crystallographica Section E, 2020, 76, 697-702
2243359 CIF
HKL
Paper
C24 H30 Br2 N4 O2P -16.3291; 9.8911; 21.133
76.48; 84.965; 73.891
1235.4Jabri, Zainab; Jarmoni, Karim; Hökelek, Tuncer; Mague, Joel T.; Sabir, Safia; Kandri Rodi, Youssef; Misbahi, Khalid
Crystal structure, Hirshfeld surface analysis and DFT studies of 6-bromo-3-(12-bromododecyl)-2-(4-nitrophenyl)-4<i>H</i>-imidazo[4,5-<i>b</i>]pyridine
Acta Crystallographica Section E, 2020, 76, 677-682
2243358 CIF
HKL
Paper
C18 H16 N2 O3 SP 1 21/n 111.8865; 5.1298; 28.2942
90; 93.667; 90
1721.72Nguyen Tien, Cong; Nguyen Tan, Quang; Pham Duc, Dung; Tran Hoang, Phuong; Nguyen Dang, Dat; Truong Minh, Luong; Van Meervelt, Luc
Synthesis and structure of ethyl 2-[(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate
Acta Crystallographica Section E, 2020, 76, 668-672
2243357 CIF
HKL
Paper
C14 H17 N3 O3P 1 21/c 112.9328; 11.2551; 9.8092
90; 106.245; 90
1370.82Sylla-Gueye, Rokhaya; Thiam, Ibrahima Elhadji; Orton, James; Coles, Simon; Gaye, Mohamed
Crystal structure of <i>N</i>'-[4-(dimethylamino)benzylidene]furan-2-carbohydrazide monohydrate
Acta Crystallographica Section E, 2020, 76, 660-663
2243356 CIF
HKL
Paper
C21 H23 F2 N OP 1 21/c 15.4945; 25.0707; 12.9811
90; 93.497; 90
1784.83Anitha, K.; Sivakumar, S.; Arulraj, R.; Rajkumar, K.; Kaur, Manpreet; Jasinski, Jerry P.
Synthesis, crystal structure, DFT calculations and Hirshfeld surface analysis of 3-butyl-2,6-bis(4-fluorophenyl)piperidin-4-one
Acta Crystallographica Section E, 2020, 76, 651-655
2243355 CIF
HKL
Paper
C16 H17 N O3P b c a11.8747; 7.2485; 30.392
90; 90; 90
2616Ezawa, Toshinari; Inoue, Yutaka; Murata, Isamu; Suzuki, Mitsuaki; Takao, Koichi; Sugita, Yoshiaki; Kanamoto, Ikuo
Syntheses and crystal structures of two piperine derivatives
Acta Crystallographica Section E, 2020, 76, 646-650
2243354 CIF
HKL
Paper
C18 H21 N O3P 1 21/c 111.4982; 5.0086; 26.724
90; 97.683; 90
1525.22Ezawa, Toshinari; Inoue, Yutaka; Murata, Isamu; Suzuki, Mitsuaki; Takao, Koichi; Sugita, Yoshiaki; Kanamoto, Ikuo
Syntheses and crystal structures of two piperine derivatives
Acta Crystallographica Section E, 2020, 76, 646-650
2243353 CIF
HKL
Paper
C22 H31 N O3P 1 21/c 117.6928; 13.2512; 8.5916
90; 90.184; 90
2014.3Bouzian, Younos; Kansiz, Sevgi; Mahi, Lhassane; Ahabchane, Noureddine Hamou; Mague, Joel T.; Dege, Necmi; Karrouchi, Khalid; Essassi, El Mokhtar
Crystal structure and Hirshfeld surface analysis of hexyl 1-hexyl-2-oxo-1,2-dihydroquinoline-4-carboxylate
Acta Crystallographica Section E, 2020, 76, 642-645
2243352 CIF
HKL
Paper
C19 H16 Cl N O3 SP 1 21/c 111.6882; 9.0903; 16.9533
90; 105.105; 90
1739.04Sebbar, Ghizlane; Mohamed, Ellouz; Hökelek, Tuncer; Mague, Joel T.; Sebbar, Nada Kheira; Essassi, El Mokhtar; Belkadi, Bouchra
Crystal structure, Hirshfeld surface analysis and interaction energy, DFT and antibacterial activity studies of ethyl 2-[(2<i>Z</i>)-2-(2-chlorobenzylidene)-3-oxo-3,4-dihydro-2<i>H</i>-1,4-benzothiazin-4-yl]acetate
Acta Crystallographica Section E, 2020, 76, 629-636
2243351 CIF
HKL
Paper
C113.8 H94.3 Cl2.3 F12 Ir2 N6 O2P -111.8734; 14.2267; 16.6076
110.386; 106.524; 96.303
2452M'hamedi, Ahmed; Batsanov, Andrei S.
Phosphorescent mono- and diiridium(III) complexes cyclometalated by fluorenyl- or phenyl-pyridino ligands with bulky substituents, as prospective OLED dopants
Acta Crystallographica Section E, 2020, 76, 392-399
2243350 CIF
HKL
Paper
C131 H164 Ir2 N6 O6P 1 21/c 138.976; 21.615; 28.759
90; 108.92; 90
22919M'hamedi, Ahmed; Batsanov, Andrei S.
Phosphorescent mono- and diiridium(III) complexes cyclometalated by fluorenyl- or phenyl-pyridino ligands with bulky substituents, as prospective OLED dopants
Acta Crystallographica Section E, 2020, 76, 392-399
2243349 CIF
HKL
Paper
C121.5 H143.6 Cl2 F4 Ir2 N4P -112.2744; 17.6132; 25.3966
105.119; 93.787; 90.779
5286.2M'hamedi, Ahmed; Batsanov, Andrei S.
Phosphorescent mono- and diiridium(III) complexes cyclometalated by fluorenyl- or phenyl-pyridino ligands with bulky substituents, as prospective OLED dopants
Acta Crystallographica Section E, 2020, 76, 392-399
2243348 CIF
HKL
Paper
C98 H126 Ir N3 O3P -116.488; 17.0003; 17.0288
91.9252; 97.8137; 117.349
4175.2M'hamedi, Ahmed; Batsanov, Andrei S.
Phosphorescent mono- and diiridium(III) complexes cyclometalated by fluorenyl- or phenyl-pyridino ligands with bulky substituents, as prospective OLED dopants
Acta Crystallographica Section E, 2020, 76, 392-399
2243347 CIF
HKL
Paper
C22 H49 Cl N4 Ni O9 Si2P -19.3815; 12.9009; 14.7604
99.309; 100.343; 99.232
1700.9Gavrish, Sergey P.; Shova, Sergiu; Cazacu, Maria; Dascalu, Mihaela; Lampeka, Yaroslaw D.
Syntheses and crystal structures of the one-dimensional coordination polymers formed by [Ni(cyclam)]^2+^ cations and 1,3-bis(3-carboxypropyl)tetramethyldisiloxane anions in different degrees of deprotonation
Acta Crystallographica Section E, 2020, 76, 446-451
2243346 CIF
HKL
Paper
C22 H48 N4 Ni O5 Si2P 1 21/c 113.033; 12.877; 9.028
90; 101.31; 90
1485.7Gavrish, Sergey P.; Shova, Sergiu; Cazacu, Maria; Dascalu, Mihaela; Lampeka, Yaroslaw D.
Syntheses and crystal structures of the one-dimensional coordination polymers formed by [Ni(cyclam)]^2+^ cations and 1,3-bis(3-carboxypropyl)tetramethyldisiloxane anions in different degrees of deprotonation
Acta Crystallographica Section E, 2020, 76, 446-451
2243345 CIF
HKL
Paper
C19 H16 N2 O3P 1 21/c 110.5976; 15.55; 10.3731
90; 109.12; 90
1615.11Daoui, Said; Baydere, Cemile; Chelfi, Tarik; El Kalai, Fouad; Dege, Necmi; Karrouchi, Khalid; Benchat, Noureddine
Polymorphism of 2-(5-benzyl-6-oxo-3-phenyl-1,6-dihydropyridazin-1-yl)acetic acid with two monoclinic modifications: crystal structures and Hirshfeld surface analyses
Acta Crystallographica Section E, 2020, 76, 432-437
2243344 CIF
HKL
Paper
C19 H16 N2 O3P 1 21/n 110.55; 9.3679; 16.5606
90; 93.886; 90
1632.9Daoui, Said; Baydere, Cemile; Chelfi, Tarik; El Kalai, Fouad; Dege, Necmi; Karrouchi, Khalid; Benchat, Noureddine
Polymorphism of 2-(5-benzyl-6-oxo-3-phenyl-1,6-dihydropyridazin-1-yl)acetic acid with two monoclinic modifications: crystal structures and Hirshfeld surface analyses
Acta Crystallographica Section E, 2020, 76, 432-437
2243343 CIF
HKL
Paper
C18 H18 Cl N3 O2 SP 1 21/a 18.9995; 16.7778; 12.3595
90; 98.892; 90
1843.8Rao, H. Surya Prakash; Gunasundari, Ramalingam; Muthukumaran, Jayaraman
Crystal structure analysis of ethyl 3-(4-chlorophenyl)-1,6-dimethyl-4-methylsulfanyl-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridine-5-carboxylate
Acta Crystallographica Section E, 2020, 76, 443-445
2243342 CIF
HKL
C14 H9 I2 NP -17.3179; 8.1089; 11.3252
97.05; 92.059; 95.579
663.02Cui, Yu-Jin; Su, Feng; Jin, Wei-Jun
Structural and luminescent properties of co-crystals of tetraiodoethylene with two azaphenanthrenes
Acta Crystallographica Section E, 2020, 76, 438-442
2243341 CIF
HKL
Paper
C14 H9 I2 NC 1 2/c 124.292; 4.8348; 24.8761
90; 116.272; 90
2619.8Cui, Yu-Jin; Su, Feng; Jin, Wei-Jun
Structural and luminescent properties of co-crystals of tetraiodoethylene with two azaphenanthrenes
Acta Crystallographica Section E, 2020, 76, 438-442
2243340 CIF
HKL
C22 H36 I Ir N4P c c n10.6041; 12.3058; 18.2513
90; 90; 90
2381.65Bernier, Chad M.; DuChane, Christine M.; Merola, Joseph S.
Crystal structures of (η^4^-cycloocta-1,5-diene)bis(1,3-dimethylimidazol-2-ylidene)iridium(I) iodide and (η^4^-cycloocta-1,5-diene)bis(1,3-diethylimidazol-2-ylidene)iridium(I) iodide
Acta Crystallographica Section E, 2020, 76, 611-614
2243339 CIF
HKL
C18 H28 I Ir N4C 1 2/m 126.6519; 8.307; 9.7852
90; 100.241; 90
2131.9Bernier, Chad M.; DuChane, Christine M.; Merola, Joseph S.
Crystal structures of (η^4^-cycloocta-1,5-diene)bis(1,3-dimethylimidazol-2-ylidene)iridium(I) iodide and (η^4^-cycloocta-1,5-diene)bis(1,3-diethylimidazol-2-ylidene)iridium(I) iodide
Acta Crystallographica Section E, 2020, 76, 611-614
2243338 CIF
HKL
Paper
C18 H16 N2 O2P b c a12.7245; 9.5887; 23.7276
90; 90; 90
2895Daouda, Ballo; Tuo, Nanou Tiéba; Hökelek, Tuncer; Niameke Jean-Baptiste, Kangah; Charles Guillaume, Kodjo; Claude, Kablan Ahmont Landry; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of 2-(2,3-dihydro-1<i>H</i>-perimidin-2-yl)-6-methoxyphenol
Acta Crystallographica Section E, 2020, 76, 605-610
2243337 CIF
HKL
Paper
C27 H26 Cl2 In N3 O3P 1 21/c 110.0704; 16.2514; 16.1749
90; 99.13; 90
2613.62Ventura, Dominic L.; Brennessel, William W.; Durfee, William S.
Crystal structures of {1,1,1-tris[(salicylaldimino)methyl]ethane}gallium as both a pyridine solvate and an acetonitrile 0.75-solvate and {1,1,1-tris[(salicylaldimino)methyl]ethane}indium dichloromethane solvate
Acta Crystallographica Section E, 2020, 76, 615-620
2243336 CIF
HKL
Paper
C27.5 H26.25 Ga N3.75 O3P -110.9053; 14.1157; 16.2324
93.915; 103.12; 97.6
2399.6Ventura, Dominic L.; Brennessel, William W.; Durfee, William S.
Crystal structures of {1,1,1-tris[(salicylaldimino)methyl]ethane}gallium as both a pyridine solvate and an acetonitrile 0.75-solvate and {1,1,1-tris[(salicylaldimino)methyl]ethane}indium dichloromethane solvate
Acta Crystallographica Section E, 2020, 76, 615-620
2243335 CIF
HKL
Paper
C31 H29 Ga N4 O3P 1 21/c 113.359; 20.413; 9.747
90; 98.326; 90
2630Ventura, Dominic L.; Brennessel, William W.; Durfee, William S.
Crystal structures of {1,1,1-tris[(salicylaldimino)methyl]ethane}gallium as both a pyridine solvate and an acetonitrile 0.75-solvate and {1,1,1-tris[(salicylaldimino)methyl]ethane}indium dichloromethane solvate
Acta Crystallographica Section E, 2020, 76, 615-620
2243334 CIF
HKL
Paper
C9 H10 Cl N O SP b c a9.6659; 14.0682; 14.4869
90; 90; 90
1970Mongkholkeaw, Sitthichok; Songsasen, Apisit; Duangthongyou, Tanwawan; Chainok, Kittipong; Suramitr, Songwut; Wattanathana, Worawat; Wannalerse, Boontana
Crystal structure, Hirshfeld surface analysis and computational study of 2-chloro-<i>N</i>-[4-(methylsulfanyl)phenyl]acetamide
Acta Crystallographica Section E, 2020, 76, 594-598
2243333 CIF
HKL
Paper
C32 H37 N O4P 1 21/n 110.578; 18.419; 14.398
90; 108.791; 90
2655.73Suresh Babu, N.; Sughanya, V.; Dhandapani, A.; Kalaivanan, R.
Crystal structure, Hirshfeld surface and frontier molecular orbital analysis of 10-benzyl-9-(3-ethoxy-4-hydroxyphenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2<i>H</i>,5<i>H</i>)-dione
Acta Crystallographica Section E, 2020, 76, 585-588
2243332 CIF
HKL
Paper
C12 H13 N O3 SP 1 21/n 18.3252; 17.1485; 9.3505
90; 116.249; 90
1197.26Agnimonhan, Finagnon Hyacinthe; Bendeif, El-Eulmi; Akanni, Léon Ahoussi; Gbaguidi, Ahokannou Fernand; Martin, Eddy; Wenger, Emmanuel; Lecomte, Claude
Crystal structure of a new phenyl(morpholino)methanethione derivative: 4-[(morpholin-4-yl)carbothioyl]benzoic acid
Acta Crystallographica Section E, 2020, 76, 581-584
2243331 CIF
HKL
Paper
C13 H16 N2 O3P -17.7363; 9.7146; 9.7854
105.524; 110.554; 97.167
643.69Chadeayne, Andrew R.; Pham, Duyen N. K.; Golen, James A.; Manke, David R.
Norpsilocin: freebase and fumarate salt
Acta Crystallographica Section E, 2020, 76, 589-593
2243330 CIF
HKL
Paper
C11 H14 N2 OP 1 21/c 19.406; 8.8436; 12.144
90; 100.601; 90
992.9Chadeayne, Andrew R.; Pham, Duyen N. K.; Golen, James A.; Manke, David R.
Norpsilocin: freebase and fumarate salt
Acta Crystallographica Section E, 2020, 76, 589-593
2243329 CIF
HKL
Paper
C9 H11 N3 O5 SP -17.1676; 9.1175; 10.1554
66.174; 80.225; 71.803
576.01Kansiz, Sevgi; Faizi, Md. Serajul Haque; Aydin, Tansu Merve; Dege, Necmi; Icbudak, Hasan; Golenya, Irina A.
Crystal structure and Hirshfeld surface analysis of 2-amino-3-hydroxypyridin-1-ium 6-methyl-2,2,4-trioxo-2<i>H</i>,4<i>H</i>-1,2,3-oxathiazin-3-ide
Acta Crystallographica Section E, 2020, 76, 572-575
2243328 CIF
HKL
Paper
C17 H12 O4P 1 21/n 14.2951; 16.7714; 18.0537
90; 95.941; 90
1293.51Zazouli, Sofia; Chigr, Mohammed; Jouaiti, Ahmed; Kyritsakas, Nathalie; Ketatni, El Mostafa
Crystal structure and Hirshfeld surface analysis of 3,4-dihydro-2<i>H</i>-anthra[1,2-<i>b</i>][1,4]dioxepine-8,13-dione
Acta Crystallographica Section E, 2020, 76, 576-580
2243327 CIF
HKL
Paper
C18 H19 B F4 N2 O2 SP c 21 b7.9117; 11.476; 20.9659
90; 90; 90
1903.59Gelbrich, Thomas; Lampl, Martin; Laus, Gerhard; Kahlenberg, Volker; Huppertz, Hubert; Schottenberger, Herwig
Synthesis and crystal structures of two 1,3-di(alkyloxy)-2-(methylsulfanyl)imidazolium tetrafluoridoborates
Acta Crystallographica Section E, 2020, 76, 552-556
2243326 CIF
HKL
Paper
C6 H11 B F4 N2 O2 SP 1 21/n 18.1049; 11.6979; 12.081
90; 90.069; 90
1145.4Gelbrich, Thomas; Lampl, Martin; Laus, Gerhard; Kahlenberg, Volker; Huppertz, Hubert; Schottenberger, Herwig
Synthesis and crystal structures of two 1,3-di(alkyloxy)-2-(methylsulfanyl)imidazolium tetrafluoridoborates
Acta Crystallographica Section E, 2020, 76, 552-556
2243325 CIF
HKL
Paper
C5 H10 O3 SP 1 21/c 116.094; 8.8747; 10.558
90; 105.654; 90
1452.1Mawhinney, Thomas P.; Li, Yiyi; Chance, Deborah L.; Kelley, Steven P.; Mossine, Valeri V.
Crystal structure of (<i>R</i>,<i>S</i>)-2-hydroxy-4-(methylsulfanyl)butanoic acid
Acta Crystallographica Section E, 2020, 76, 562-566
2243324 CIF
HKL
Paper
C11 H9 N3 O SP 1 21/n 112.06; 4.4531; 19.9528
90; 102.228; 90
1047.24Mossine, Valeri V.; Kelley, Steven P.; Mawhinney, Thomas P.
Intramolecular 1,5-S···N σ-hole interaction in (<i>E</i>)-<i>N</i>'-(pyridin-4-ylmethylidene)thiophene-2-carbohydrazide
Acta Crystallographica Section E, 2020, 76, 557-561
2243323 CIF
HKL
C18 H24 Mo N3 O5 PP 1 21/n 112.8674; 11.6366; 14.4655
90; 113.224; 90
1990.45Anstey, Mitchell R.; Bost, John L.; Grumman, Anna S.; Kennedy, Nicholas D.; Whited, Matthew T.
Crystal structures of <i>trans</i>-acetyldicarbonyl(η^5^-cyclopentadienyl)(1,3,5-triaza-7-phosphaadamantane)molybdenum(II) and <i>trans</i>-acetyldicarbonyl(η^5^-cyclopentadienyl)(3,7-diacetyl-1,3,7-triaza-5-phosphabicyclo[3.3.1]nonane)molybdenum(II)
Acta Crystallographica Section E, 2020, 76, 547-551
2243322 CIF
HKL
C15 H20 Mo N3 O3 PP 1 21/c 19.7919; 14.5757; 12.114
90; 107.694; 90
1647.2Anstey, Mitchell R.; Bost, John L.; Grumman, Anna S.; Kennedy, Nicholas D.; Whited, Matthew T.
Crystal structures of <i>trans</i>-acetyldicarbonyl(η^5^-cyclopentadienyl)(1,3,5-triaza-7-phosphaadamantane)molybdenum(II) and <i>trans</i>-acetyldicarbonyl(η^5^-cyclopentadienyl)(3,7-diacetyl-1,3,7-triaza-5-phosphabicyclo[3.3.1]nonane)molybdenum(II)
Acta Crystallographica Section E, 2020, 76, 547-551
2243321 CIF
HKL
Paper
C13 H16 Cl N OP -16.6286; 8.1569; 12.0061
96.803; 101.506; 98.511
621.73Srividya, J.; Reuben Jonathan, D.; Revathi, B. K.; Divya Bharathi, M.; Anbalagan, G.
Crystal structure of (4-chlorophenyl)(4-methylpiperidin-1-yl)methanone
Acta Crystallographica Section E, 2020, 76, 534-538
2243320 CIF
HKL
Paper
C12 H16 Ag N3 O3 S4P 1 21/c 17.0777; 12.0654; 19.5725
90; 90.446; 90
1671.3Assoumatine, Tokouré; Stoeckli-Evans, Helen
Silver(I) nitrate two-dimensional coordination polymers of two new pyrazinethiophane ligands: 5,7-dihydro-1<i>H</i>,3<i>H</i>-dithieno[3,4-<i>b</i>:3',4'-<i>e</i>]pyrazine and 3,4,8,10,11,13-hexahydro-1<i>H</i>,6<i>H</i>-bis([1,4]dithiocino)[6,7-<i>b</i>:6',7'-<i>e</i>]pyrazine
Acta Crystallographica Section E, 2020, 76, 539-546
2243319 CIF
HKL
Paper
C8 H8 Ag N3 O3 S2P 1 2/n 13.8995; 6.3902; 20.5741
90; 93.121; 90
511.92Assoumatine, Tokouré; Stoeckli-Evans, Helen
Silver(I) nitrate two-dimensional coordination polymers of two new pyrazinethiophane ligands: 5,7-dihydro-1<i>H</i>,3<i>H</i>-dithieno[3,4-<i>b</i>:3',4'-<i>e</i>]pyrazine and 3,4,8,10,11,13-hexahydro-1<i>H</i>,6<i>H</i>-bis([1,4]dithiocino)[6,7-<i>b</i>:6',7'-<i>e</i>]pyrazine
Acta Crystallographica Section E, 2020, 76, 539-546
2243318 CIF
HKL
Paper
C12 H16 N2 S4C 1 2/c 121.1618; 7.0585; 9.5057
90; 94.47; 90
1415.55Assoumatine, Tokouré; Stoeckli-Evans, Helen
Silver(I) nitrate two-dimensional coordination polymers of two new pyrazinethiophane ligands: 5,7-dihydro-1<i>H</i>,3<i>H</i>-dithieno[3,4-<i>b</i>:3',4'-<i>e</i>]pyrazine and 3,4,8,10,11,13-hexahydro-1<i>H</i>,6<i>H</i>-bis([1,4]dithiocino)[6,7-<i>b</i>:6',7'-<i>e</i>]pyrazine
Acta Crystallographica Section E, 2020, 76, 539-546
2243317 CIF
HKL
Paper
C8 H8 N2 S2P 1 21/n 14.1027; 12.1789; 8.1014
90; 95.78; 90
402.74Assoumatine, Tokouré; Stoeckli-Evans, Helen
Silver(I) nitrate two-dimensional coordination polymers of two new pyrazinethiophane ligands: 5,7-dihydro-1<i>H</i>,3<i>H</i>-dithieno[3,4-<i>b</i>:3',4'-<i>e</i>]pyrazine and 3,4,8,10,11,13-hexahydro-1<i>H</i>,6<i>H</i>-bis([1,4]dithiocino)[6,7-<i>b</i>:6',7'-<i>e</i>]pyrazine
Acta Crystallographica Section E, 2020, 76, 539-546
2243316 CIF
HKL
Paper
C22 H24 F2 N4 Ni O9C 1 2/c 112.1175; 18.7705; 12.3246
90; 110.232; 90
2630.29Politeo, Nives; Pisačić, Mateja; Daković, Marijana; Sokol, Vesna; Kukovec, Boris-Marko
The first coordination compound of 6-fluoronicotinate: the crystal structure of a one-dimensional nickel(II) coordination polymer containing the mixed ligands 6-fluoronicotinate and 4,4'-bipyridine
Acta Crystallographica Section E, 2020, 76, 500-505
2243315 CIF
HKL
Paper
C16 H22 N2 O3C 1 2/c 119.77; 9.477; 17.62
90; 105.78; 90
3177Chadeayne, Andrew R.; Pham, Duyen N. K.; Golen, James A.; Manke, David R.
Bis(4-hydroxy-<i>N</i>-isopropyl-<i>N</i>-methyltryptammonium) fumarate: a new crystalline form of miprocin
Acta Crystallographica Section E, 2020, 76, 514-517
2243314 CIF
HKL
C6 H17 Mo2 N O12P 1 21 18.1775; 6.7722; 12.305
90; 99.664; 90
671.8Mirzaei, Masoud; Tahmasebi, Morteza; Mague, Joel T.
A redetermination of the crystal structure of the mannitol complex NH~4~[Mo~2~O~5~(C~6~H~11~O~6~)]·H~2~O: hydrogen-bonding scheme and Hirshfeld surface analysis
Acta Crystallographica Section E, 2020, 76, 518-522
2243313 CIF
HKL
Paper
C14 H36 Cl4 Cr2 N4 O6P -17.061; 8.674; 10.775
77.61; 88.2; 79.39
633.5Moon, Dohyun; Choi, Jong-Ha
Crystal structure of 1,4,8,11-tetramethyl-1,4,8,11-tetraazoniacyclotetradecane bis[chloridochromate(VI)] dichloride from synchrotron X-ray data
Acta Crystallographica Section E, 2020, 76, 523-526
2243312 CIF
HKL
Paper
C7 H11 Cl3 N4 O3 ZnP 1 21/c 18.0932; 13.744; 12.429
90; 92.29; 90
1381.4El Hamdani, Hicham; El Amane, Mohamed; Saadi, Mohamed; El Ammari, Lahcen
Crystal structure and Hirshfeld surface analysis of (C~7~H~9~N~4~O~2~)[ZnCl~3~(H~2~O)]
Acta Crystallographica Section E, 2020, 76, 506-509
2243311 CIF
HKL
Paper
C18 H25 N3 O4P -16.259; 7.4549; 19.269
83.28; 84.74; 85.38
886.94Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Harish Chinthal, Chayanna; Foro, Sabine; Glidewell, Christopher
Crystal structures of the recreational drug <i>N</i>-(4-methoxyphenyl)piperazine (MeOPP) and three of its salts
Acta Crystallographica Section E, 2020, 76, 488-495
2243310 CIF
HKL
Paper
C17 H19 N5 O8P 1 21/n 18.7568; 6.6292; 34.024
90; 96.987; 90
1960.4Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Harish Chinthal, Chayanna; Foro, Sabine; Glidewell, Christopher
Crystal structures of the recreational drug <i>N</i>-(4-methoxyphenyl)piperazine (MeOPP) and three of its salts
Acta Crystallographica Section E, 2020, 76, 488-495
2243309 CIF
HKL
Paper
C18 H20 N4 O7P -17.4365; 10.6276; 13.27
92.238; 97.057; 108.618
982.92Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Harish Chinthal, Chayanna; Foro, Sabine; Glidewell, Christopher
Crystal structures of the recreational drug <i>N</i>-(4-methoxyphenyl)piperazine (MeOPP) and three of its salts
Acta Crystallographica Section E, 2020, 76, 488-495
2243308 CIF
HKL
Paper
C11 H16 N2 OP n a 216.9683; 7.9683; 18.975
90; 90; 90
1053.6Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Harish Chinthal, Chayanna; Foro, Sabine; Glidewell, Christopher
Crystal structures of the recreational drug <i>N</i>-(4-methoxyphenyl)piperazine (MeOPP) and three of its salts
Acta Crystallographica Section E, 2020, 76, 488-495
2243307 CIF
HKL
Paper
C30 H28 Cl4 Co N6 O4I 41/a :29.2846; 9.2846; 38.069
90; 90; 90
3281.7Thippeswamy, B.; Suchetan, P. A.; Mahadevan, K. M.; Nagabhushana, H.; Vijayakumar, G. R.
Crystal structure and photoluminescent properties of bis(4'-chloro-2,2':6',2''-terpyridyl)cobalt(II) dichloride tetrahydrate
Acta Crystallographica Section E, 2020, 76, 496-499
2243305 CIF
HKL
Paper
C13 H15 N3 O5 SP 1 21/c 19.2139; 8.8122; 18.3486
90; 104.521; 90
1442.22Metwally, Nadia H.; Elgemeie, Galal H.; Jones, Peter G.
Crystal structure of ethyl 2-(5-amino-1-benzenesulfonyl-3-oxo-2,3-dihydro-1<i>H</i>-pyrazol-2-yl)acetate
Acta Crystallographica Section E, 2020, 76, 481-483
2243304 CIF
HKL
Paper
C12 H9.14 Cl O S2P -17.3709; 7.5063; 12.4247
84.126; 76.694; 62.372
592.69Al-Refai, Mahmoud; Ali, Basem F.; Geyer, Armin; Harms, Klaus; Marsch, Michael
Unexpected formation of a co-crystal containing the chalcone (<i>E</i>)-1-(5-chlorothiophen-2-yl)-3-(3-methylthiophen-2-yl)prop-2-en-1-one and the keto‒enol tautomer (<i>Z</i>)-1-(5-chlorothiophen-2-yl)-3-(3-methylthiophen-2-yl)prop-1-en-1-ol
Acta Crystallographica Section E, 2020, 76, 477-480
2243303 CIF
HKL
Paper
C10 H12 N8 O2C 1 2/c 123.473; 3.7262; 13.9102
90; 95.687; 90
1210.67Khotchasanthong, Kenika; Jittirattanakun, Siripak; Chainok, Kittipong
Crystal structure and Hirshfeld surface analysis of 3,6-bis(pyrimidin-2-yl)-1,4-dihydro-1,2,4,5-tetrazine dihydrate
Acta Crystallographica Section E, 2020, 76, 473-476
2243302 CIF
Paper
C22 H22 O2 S2P b c a7.7418; 13.856; 36.197
90; 90; 90
3882.9Raghuvanshi, Abhinav; Knauer, Lena; Viau, Lydie; Knorr, Michael; Strohmann, Carsten
Crystal structure of 2-[bis(benzylsulfanyl)methyl]-6-methoxyphenol
Acta Crystallographica Section E, 2020, 76, 484-487
2243301 CIF
HKL
Paper
C11 H15 N O2 SP -17.5347; 8.2581; 9.6157
77.876; 86.132; 69.682
548.56Stenfors, Brock A.; Staples, Richard J.; Biros, Shannon M.; Ngassa, Felix N.
Crystal structure of 1-[(4-methylbenzene)sulfonyl]pyrrolidine
Acta Crystallographica Section E, 2020, 76, 452-455
2243300 CIF
HKL
Paper
C10 H11 N O4P -18.706; 13.753; 14.683
116.142; 93.871; 96.985
1552El Ghallab, Yassine; Derfoufi, Sanae; Ketatni, El Mostafa; Saadi, Mohamed; El Ammari, Lahcen
Crystal structure and Hirshfeld surface analysis of 4-allyl-2-methoxy-6-nitrophenol
Acta Crystallographica Section E, 2020, 76, 461-465
2243299 CIF
HKL
Paper
C18 H18 Ca Cu N4 O5 S2P 1 21/n 18.5623; 10.5377; 24.4439
90; 90.768; 90
2205.3Plyuta, Nataliya; Vassilyeva, Olga Yu.; Kokozay, Vladimir N.; Omelchenko, Iryna; Petrusenko, Svitlana
A binuclear Cu^II^/Ca^II^ thiocyanate complex with a Schiff base ligand derived from <i>o</i>-vanillin and ammonia
Acta Crystallographica Section E, 2020, 76, 423-426
2243298 CIF
HKL
Paper
C16 H16 Br N3 SP 1 21/c 112.138; 8.336; 15.872
90; 93.91; 90
1602.2Duruskari, Gulnara Sh.; Akkurt, Mehmet; Mammadova, Gunay Z.; Chyrka, Taras; Maharramov, Abel M.
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-3-(benzylideneamino)-5-phenylthiazolidin-2-iminium bromide
Acta Crystallographica Section E, 2020, 76, 427-431
2243297 CIF
HKL
Paper
C34 H22 Br6 Cu N4 O3 SP 1 21/n 18.9922; 16.461; 24.835
90; 92.491; 90
3672.6Chetioui, Souheyla; Bougueria, Hassiba; Brihi, Ouarda; Boutebdja, Mehdi; Bouroumane, Nadia; Merazig, Hocine; Touzani, Rachid
Crystal structure, characterization and Hirshfeld analysis of bis{(<i>E</i>)-1-[(2,4,6-tribromophenyl)diazenyl]naphthalen-2-olato}copper(II) dimethyl sulfoxide monosolvate
Acta Crystallographica Section E, 2020, 76, 382-386
2243296 CIF
HKL
C28 H29 N5P -18.686; 9.7731; 14.3948
85.915; 75.349; 78.891
1159.8Tesouro Vallina, Ana; Stoeckli-Evans, Helen
Crystal structures and Hirshfeld surface analyses of two new tetrakis-substituted pyrazines and a degredation product
Acta Crystallographica Section E, 2020, 76, 404-409
2243295 CIF
HKL
C36 H40 N6P -18.6753; 8.916; 10.0631
85.774; 73.468; 82.467
739.21Tesouro Vallina, Ana; Stoeckli-Evans, Helen
Crystal structures and Hirshfeld surface analyses of two new tetrakis-substituted pyrazines and a degredation product
Acta Crystallographica Section E, 2020, 76, 404-409

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