Crystallography Open Database
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Searching space group like 'P b c a'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
8103871 | CIF | Ag B F4 H2 O | P b c a | 7.966; 7.794; 13.42 90; 90; 90 | 833.208 | Ludwig, W.; Wartchow, R. Crystal structure of silver tetrafluoroborate monohydrate, Ag (B F4) (H2 O) Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 631-631 |
8104072 | CIF | Ag Cl H2 O5 | P b c a | 8.122; 7.829; 13.56 90; 90; 90 | 862.242 | Wartchow, R.; Ludwig, W. Crystal structure of silver perchlorate monohydrate, Ag (Cl O4) (H2 O) Zeitschrift fuer Kristallographie (149,1979-), 1995, 210, 879-879 |
1509291 | CIF | Ag Cu O4 P | P b c a | 7.5; 15.751; 5.702 90; 90; 90 | 673.592 | Oumba, M.T.; Quarton, M. Proprietes de l'ion Cu2+ dans la structure de Ag Cu P O4 - beta Materials Research Bulletin, 1983, 18, 967-974 |
4312674 | CIF | Ag F11 Sb2 | P b c a | 10.918; 12.4628; 38.802 90; 90; 90 | 5279.7 | Zoran Mazej; Primož Benkič Silver(I) Undecafluorodiantimonate(V) Inorganic Chemistry, 2003, 42, 8337-8343 |
1509320 | CIF | Ag F2 | P b c a | 5.073; 5.529; 5.813 90; 90; 90 | 163.047 | Fischer, P.; Schwarzenbach, D.; Rietveld, H.M. Crystal and magnetic structure of silver difluoride. I. Determination of the Ag F2 structure Journal of Physics and Chemistry of Solids, 1971, 32, 543-550 |
1509321 | CIF | Ag F2 | P b c a | 5.568; 5.831; 5.101 90; 90; 90 | 165.614 | Mueller, B.G.; Hoppe, R.; Zemva, B.; Jesih, A.; Lutar, K.; Becker, S.; Bachmann, B. Einkristalluntersuchungen an Ag F2 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1990, 588, 77-83 |
1509346 | CIF | Ag Ga P2 Se6 | P b c a | 12.169; 22.484; 7.473 90; 90; 90 | 2044.67 | Pfeiff, R.; Kniep, R. Quaternary selenodiphosphates(IV):M(I)M(III)(P2Se6), (M(I)=Cu,Ag;M(III)=Cr,Al,Ga,In) Journal of Alloys Compd., 1992, 186, 111-133 |
1509468 | CIF | Ag N O3 | P b c a | 6.995; 7.328; 10.118 90; 90; 90 | 518.642 | Trotter, J.; Gibbons, C.S. Crystal structure of exo-tricyclo(3.2.1.02,4)oct-6-ene-silver nitrate, and a refinement of the silver nitrate structure Journal of the Chemical Society A: Inorganic, Physical, Theoretical (1966-1971), 1971, 1971, 2058-2062 |
7004808 | CIF | Ag N3 O4 | P b c a | 5.804; 9.7496; 13.9105 90; 90; 90 | 787.15 | Klapötke, Thomas M.; Krumm, Burkhard; Scherr, Matthias First structural characterization of solvate-free silver dinitramide, Ag[N(NO2)2] Dalton Transactions, 2008, 5876-5878 |
1563339 | CIF | Ag O7 Te U | P b c a | 7.0849; 11.986; 13.913 90; 90; 90 | 1181.5 | Ling, Jie; Ward, Matthew; Burns, Peter C. Hydrothermal syntheses and structures of the uranyl tellurates AgUO2(HTeO5) and Pb2UO2(TeO6) Journal of Solid State Chemistry, 2011, 184, 401-404 |
1509622 | CIF | Ag11 K O16 V4 | P b c a | 16.5328; 10.6286; 10.5452 90; 90; 90 | 1853.01 | Jansen, M.; Kovalevskiy, A. Synthesis and crystal structure analysis of K Ag11 (V O4)4 Zeitschrift fuer Anorganische und Allgemeine Chemie, 2006, 632, 413-436 |
2018859 | CIF | Ag2 Al4 Cl10 O2 | P b c a | 11.24; 12.278; 12.955 90; 90; 90 | 1787.85 | Jentsch, D.; Schwarzmann, E.; Sheldrick, G.M.; Jones, P.G. Disilver(I) Decachlorodioxotetraaluminate(III), Ag2 (Al4 Cl10 O2) Acta Crystallographica C (39,1983-), 1983, 39, 1173-1174 |
7209369 | CIF | Ag2 Hg O6 Se2 | P b c a | 6.8206; 11.237; 16.876 90; 90; 90 | 1293.43 | Weil, M. Investigations in the systems Ag - Hg - X - O (X = As(V), Se(IV), Se(VI)): hydrothermal single crystal growth of Ag3 As O4, Ag Hg(I)2 As O4, Ag Hg(II) As O4, Ag2 Se O4 and the crystal structure of Ag2 Hg(II) (Se O3)2 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 2003, 58, 1091-1096 |
7024504 | CIF | Ag2 I3 O11 V | P b c a | 35.245; 7.7757; 7.172 90; 90; 90 | 1965.5 | Sun, Chuan-Fu; Hu, Chun-Li; Kong, Fang; Yang, Bing-Ping; Mao, Jiang-Gao Syntheses and crystal structures of four new silver(I) iodates with d(0)-transition metal cations. Dalton transactions (Cambridge, England : 2003), 2010, 39, 1473-1479 |
1007100 | CIF | Ag4 O7 V2 | P b c a | 18.82; 10.89; 13.925 90; 90; 90 | 2853.9 | Masse, R; Averbuch-Pouchot, M T; Durif, A; Guitel, J C Chemical Preparation and Crystal Structure of Silver Pyrovanadate, Ag~4~ V~2~ O~7~ Acta Crystallographica C (39,1983-), 1983, 39, 1608-1610 |
2011450 | CIF | Al As H4 O6 | P b c a | 8.8218; 9.8252; 10.1163 90; 90; 90 | 876.8 | Harrison, William T. A. Synthetic mansfieldite, AlAsO~4~.2H~2~O Acta Crystallographica, Section C, 2000, 56, e421-e421 |
7708360 | CIF | Al B H2 O10 Se3 | P b c a | 8.465; 8.7788; 21.9237 90; 90; 90 | 1629.21 | Cao, Ming-Yang; Hu, Chun-Li; Kong, Fang; Xiong, Zheyao; Mao, Jiang-Gao M(B(SeO3)3)H2O(M = Al, Ga):The first boroselenites with a unique sandwich like double-layer structure Dalton Transactions, 2021 |
1531606 | CIF | Al Br3 H3 N | P b c a | 11.529; 12.188; 19.701 90; 90; 90 | 2768.29 | Jacobs, H.; Schroeder, F.O. Monoammoniates of aluminium halides: the crystal structures of (Al Br3) * (N H3) and (Al I3) * (N H3) Zeitschrift fuer Anorganische und Allgemeine Chemie, 2002, 628, 327-329 |
9000571 | CIF | Al Ca H9 Mg O13 P2 | P b c a | 14.723; 18.746; 7.107 90; 90; 90 | 1961.51 | Moore, P. B.; Araki, T. Overite, segelerite, and jahnsite: a study in combinatorial polymorphism American Mineralogist, 1977, 62, 692-702 |
1530734 | CIF | Al Cl3 H3 N | P b c a | 9.895; 10.148; 11.544 90; 90; 90 | 1159.19 | Semenenko, K.N.; Lobkovskii, E.B.; Kravchenko, O.V.; Polyakova, V.B.; Korobov, I.I. Structure and vibrational spectra of aluminium chloride monoammoniate Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1978, 4, 1649-1652 |
1531607 | CIF | Al H3 I3 N | P b c a | 13.536; 8.759; 14.348 90; 90; 90 | 1701.12 | Jacobs, H.; Schroeder, F.O. Monoammoniates of aluminium halides: the crystal structures of (Al Br3) * (N H3) and (Al I3) * (N H3) Zeitschrift fuer Anorganische und Allgemeine Chemie, 2002, 628, 327-329 |
1534642 | CIF | Al H3 O3 | P b c a | 8.6857; 5.0521; 9.4954 90; 90; 90 | 416.668 | Liu, H.; Tse, J.S.; Hu, J.; Liu, Z.; Wang, L.; Weidner, D.J.; Chen, J.; Meng, Y.; Mao, H.-K.; Haeusermann, D. Structural Refinement of the High-Pressure Phase of Aluminium Trihydroxide: In-Situ High-Pressure Angle Dispersive Synchrotron X-ray Diffraction and Theoretical Studies J. Phys. Chem. B, 2005, 109, 8857-8860 |
9007618 | CIF | Al H4 O6 P | P b c a | 9.822; 8.561; 9.63 90; 90; 90 | 809.75 | Kniep, R.; Mootz, D.; Vegas, A. Variscite Acta Crystallographica, Section B, 1977, 33, 263-265 |
1526660 | CIF | Al K O2 | P b c a | 5.4482; 10.916; 15.445 90; 90; 90 | 918.554 | Sokolowski, J.; Kotarba, A. The structure of potassium aluminium oxide K Al O2 Materials Science Forum, 2000, 321, 954-959 |
2105200 | CIF Paper | Al K O2 | P b c a | 5.43867; 10.9236; 15.4564 90; 90; 90 | 918.26 | Voronin, Vladimir I.; Shekhtman, Georgi Sh.; Blatov, Vladislav A. The natural tiling approach to cation conductivity in KAlO~2~ polymorphs Acta Crystallographica Section B, 2012, 68, 356-363 |
2105201 | CIF Paper | Al K O2 | P b c a | 5.4457; 10.9401; 15.4698 90; 90; 90 | 921.64 | Voronin, Vladimir I.; Shekhtman, Georgi Sh.; Blatov, Vladislav A. The natural tiling approach to cation conductivity in KAlO~2~ polymorphs Acta Crystallographica Section B, 2012, 68, 356-363 |
2105202 | CIF Paper | Al K O2 | P b c a | 5.456; 10.9617; 15.4893 90; 90; 90 | 926.37 | Voronin, Vladimir I.; Shekhtman, Georgi Sh.; Blatov, Vladislav A. The natural tiling approach to cation conductivity in KAlO~2~ polymorphs Acta Crystallographica Section B, 2012, 68, 356-363 |
2105203 | CIF Paper | Al K O2 | P b c a | 5.4668; 10.9862; 15.5103 90; 90; 90 | 931.54 | Voronin, Vladimir I.; Shekhtman, Georgi Sh.; Blatov, Vladislav A. The natural tiling approach to cation conductivity in KAlO~2~ polymorphs Acta Crystallographica Section B, 2012, 68, 356-363 |
2105204 | CIF Paper | Al K O2 | P b c a | 5.4788; 11.0123; 15.5359 90; 90; 90 | 937.35 | Voronin, Vladimir I.; Shekhtman, Georgi Sh.; Blatov, Vladislav A. The natural tiling approach to cation conductivity in KAlO~2~ polymorphs Acta Crystallographica Section B, 2012, 68, 356-363 |
2105205 | CIF Paper | Al K O2 | P b c a | 5.4888; 11.0346; 15.5598 90; 90; 90 | 942.41 | Voronin, Vladimir I.; Shekhtman, Georgi Sh.; Blatov, Vladislav A. The natural tiling approach to cation conductivity in KAlO~2~ polymorphs Acta Crystallographica Section B, 2012, 68, 356-363 |
7117899 | CIF | Al Na5 O4 | P b c a | 5.894; 17.87; 10.095 90; 90; 90 | 1063.26 | Barker, M.G.; Gadd, P.G.; Begley, M.J. Preparation and crystal structures of the first alkali-rich sodium aluminates Na7 Al3 O8 and Na5 Al O4 Journal of the Chemical Society. Chemical Communications (1972-), 1981, 1981, 379-381 |
1526641 | CIF | Al O4 P | P b c a | 18.02411; 13.91737; 9.65536 90; 90; 90 | 2422.03 | Kirchner, R.M.; Grosse-Kunstleve, R.W.; Pluth, J.J.; Smith, J.V.; Broach, R.W.; Wilson, S.T. The structures of as-synthesized Al P O4 - 53(A), calcined dehydrated Al P O4 - 53(B), and Al P O4 - 53(C), a new phase determined by the FOCUS method Microporous and Mesoporous Materials, 2000, 39, 319-332 |
1533070 | CIF | Al O4 P | P b c a | 14.0343; 15.1794; 17.4024 90; 90; 90 | 3707.27 | Roux, M.; Marichal, C.; le Meins, J.M.; Chezeau, J.M.; Baerlocher, C. Solid state NMR and X-ray diffraction study of three forms of the aluminophosphate Al P O4 - ZON Microporous and Mesoporous Materials, 2003, 63, 163-176 |
9003577 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.509 O6 Si1.997 Ti0.002 | P b c a | 18.3718; 8.8836; 5.2334 90; 90; 90 | 854.131 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: quenched from 904 deg C ORD American Mineralogist, 2005, 90, 155-161 |
9003574 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.541 O6 Si1.997 Ti0.002 | P b c a | 18.3668; 8.8725; 5.2289 90; 90; 90 | 852.099 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: untreated American Mineralogist, 2005, 90, 155-161 |
9003575 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.541 O6 Si1.997 Ti0.002 | P b c a | 18.3653; 8.8819; 5.2305 90; 90; 90 | 853.193 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: quenched from 980 deg C DIS American Mineralogist, 2005, 90, 155-161 |
9003578 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.541 O6 Si1.997 Ti0.002 | P b c a | 18.3645; 8.881; 5.2284 90; 90; 90 | 852.727 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: quenched from 856 deg C ORD American Mineralogist, 2005, 90, 155-161 |
9003579 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.541 O6 Si1.997 Ti0.002 | P b c a | 18.3559; 8.8741; 5.2256 90; 90; 90 | 851.209 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: quenched from 806 deg C ORD American Mineralogist, 2005, 90, 155-161 |
9003576 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.542 O6 Si1.997 Ti0.002 | P b c a | 18.3686; 8.8828; 5.2287 90; 90; 90 | 853.139 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: quenched from 900 deg C DIS American Mineralogist, 2005, 90, 155-161 |
9001749 | CIF | Al0.028 Ca0.036 Cr0.004 Fe0.795 Mg1.134 Mn0.026 O6 Si1.986 Ti0.005 | P b c a | 18.316; 8.907; 5.218 90; 90; 90 | 851.268 | Domeneghetti, M. C.; Tazzoli, V.; Ballaran, T. B.; Molin, G. M. Orthopyroxene from the Serra de Mage meteorite: A structure-refinement procedure for a Pbca phase coexisting with a C2/c exsolved phase Sample Opx SDM N.13, natural American Mineralogist, 1996, 81, 842-846 |
9001750 | CIF | Al0.028 Ca0.036 Cr0.004 Fe0.801 Mg1.128 Mn0.026 O6 Si1.986 Ti0.005 | P b c a | 18.32; 8.917; 5.219 90; 90; 90 | 852.573 | Domeneghetti, M. C.; Tazzoli, V.; Ballaran, T. B.; Molin, G. M. Orthopyroxene from the Serra de Mage meteorite: A structure-refinement procedure for a Pbca phase coexisting with a C2/c exsolved phase Sample Opx SDM N.7, heated American Mineralogist, 1996, 81, 842-846 |
9010887 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.2429; 8.8171; 5.1894 90; 90; 90 | 834.712 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 20 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
9010888 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.4588; 8.9638; 5.2848 90; 90; 90 | 874.428 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,200 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
9010889 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.4517; 8.9612; 5.2797 90; 90; 90 | 872.995 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,175 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
9010890 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.445; 8.9589; 5.2749 90; 90; 90 | 871.661 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,150 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
9010891 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.4378; 8.9555; 5.2711 90; 90; 90 | 870.363 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,125 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
9010892 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.4314; 8.952; 5.2674 90; 90; 90 | 869.11 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,100 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
9010893 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.4244; 8.9481; 5.2639 90; 90; 90 | 867.824 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,075 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
9010894 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.4197; 8.9449; 5.2609 90; 90; 90 | 866.798 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,050 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
9010895 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.4125; 8.9408; 5.2577 90; 90; 90 | 865.536 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,025 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
9010896 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.4047; 8.9366; 5.2543 90; 90; 90 | 864.203 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,000 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
9010897 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.3995; 8.9329; 5.2519 90; 90; 90 | 863.207 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 975 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
9010898 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.2513; 8.8274; 5.1929 90; 90; 90 | 836.636 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 150 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
1537228 | CIF | Al0.06 Fe0.096 Mg0.854 O3 Si0.97 | P b c a | 18.2248; 8.7822; 5.1927 90; 90; 90 | 831.112 | Ganguly, J.; Ghose, S. Aluminous orthopyroxene: Order-disorder, thermodynamic properties, and petrologic implications Contributions to Mineralogy and Petrology (23,1969-), 1979, 69, 375-385 |
1566757 | CIF HKL | Al0.067 Fe0.067 Mg1.94 O6 Si1.93 | P b c a | 5.1815; 18.2321; 8.8085 90; 90; 90 | 832.14 | Glazyrin, K.; Khandarkhaeva, S.; Fedotenko, T.; Dong, W.; Laniel, D.; Seiboth, F.; Schropp, A.; Garrevoet, J.; Brückner, D.; Falkenberg, G.; Kubec, A.; David, C.; Wendt, M.; Wenz, S.; Dubrovinsky, L.; Dubrovinskaia, N.; Liermann, H.-P. Sub-micrometer focusing setup for high-pressure crystallography at the Extreme Conditions beamline at PETRAIII Journal of Synchrotron Radiation, 2022, 29, 654-663 |
1537231 | CIF | Al0.088 Mg0.956 O3 Si0.956 | P b c a | 18.1991; 8.78; 5.1666 90; 90; 90 | 825.561 | Ganguly, J.; Ghose, S. Aluminous orthopyroxene: Order-disorder, thermodynamic properties, and petrologic implications Contributions to Mineralogy and Petrology (23,1969-), 1979, 69, 375-385 |
9006436 | CIF | Al0.14 Ca0.012 Fe0.24 Mg1.66 O6 Si1.94 | P b c a | 18.231; 8.8095; 5.1873 90; 90; 90 | 833.111 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 0.00 GPa, natural orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
9006437 | CIF | Al0.14 Ca0.012 Fe0.24 Mg1.66 O6 Si1.94 | P b c a | 18.189; 8.7765; 5.1723 90; 90; 90 | 825.684 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 1.04 GPa, natural orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
9006438 | CIF | Al0.14 Ca0.012 Fe0.24 Mg1.66 O6 Si1.94 | P b c a | 18.16; 8.7503; 5.1606 90; 90; 90 | 820.047 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 1.90 GPa, natural orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
9006439 | CIF | Al0.14 Ca0.012 Fe0.24 Mg1.66 O6 Si1.94 | P b c a | 18.115; 8.7184; 5.1472 90; 90; 90 | 812.917 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 3.00 GPa, natural orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
9006440 | CIF | Al0.14 Ca0.012 Fe0.24 Mg1.66 O6 Si1.94 | P b c a | 18.077; 8.6907; 5.1349 90; 90; 90 | 806.702 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 4.03 GPa, natural orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
9006441 | CIF | Al0.14 Ca0.012 Fe0.24 Mg1.66 O6 Si1.94 | P b c a | 18.051; 8.6683; 5.1244 90; 90; 90 | 801.822 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 4.93 GPa, natural orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
9006442 | CIF | Al0.14 Ca0.012 Fe0.24 Mg1.66 O6 Si1.94 | P b c a | 18; 8.642; 5.115 90; 90; 90 | 795.669 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 6.01 GPa, natural orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
9008434 | CIF | Al0.14 F0.8 Fe1.78 H23.2 K0.32 Mg0.08 Mn1.5 O32.76 P4 Ti1.56 | P b c a | 10.561; 20.585; 12.516 90; 90; 90 | 2720.96 | Demartin, F.; Pilati, T.; Gay, H. D.; Gramaccioli, C. M. The crystal structure of a mineral related to paulkerrite Zeitschrift fur Kristallographie, 1993, 208, 57-71 |
2101702 | CIF Paper | Al0.15 Mg0.79 Na1.74 O4 Si1.06 | P b c a | 10.487; 14.351; 5.243 90; 90; 90 | 789.1 | Withers, Ray L.; Lobo, Charlene; Thompson, John G.; Schmid, Siegbert A Modulation Wave Approach to the Structural Characterization of Three New Cristobalite-Related Sodium Magnesiosilicates Acta Crystallographica Section B, 1997, 53, 203-220 |
1526735 | CIF | Al0.196 Ca0.069 Fe0.409 Mg1.49 O6 Si1.85 | P b c a | 18.276; 8.819; 5.196 90; 90; 90 | 837.471 | Takeda, H. Crystallographic Studies of Coexisting Aluminan Orthopyroxene and Augite of High-Pressure Origin Journal of Geophysical Research, 1972, 77, 5798-5811 |
9010241 | CIF | Al0.23 Mg0.874 O3 Si0.875 | P b c a | 18.1876; 8.7352; 5.1789 90; 90; 90 | 822.784 | Smyth, J. R.; Mierdel, K.; Keppler, H.; Langenhorst, F.; Dubrovinsky, L.; Nestola, F. Crystal chemistry of hydration in aluminous orthopyroxene American Mineralogist, 2007, 92, 973-976 |
9010424 | CIF | Al0.236 Ca0.01 Fe0.967 Mg0.923 Mn0.016 O6 Si1.848 | P b c a | 18.2889; 8.8662; 5.2175 90; 90; 90 | 846.034 | Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Secco, L.; Dal Negro, A. The high-pressure behavior of an Al- and Fe-rich natural orthopyroxene Sample: P = 0 GPa, in air American Mineralogist, 2008, 93, 644-652 |
9010425 | CIF | Al0.236 Ca0.01 Fe0.967 Mg0.923 Mn0.016 O6 Si1.848 | P b c a | 18.2889; 8.8662; 5.2175 90; 90; 90 | 846.034 | Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Secco, L.; Dal Negro, A. The high-pressure behavior of an Al- and Fe-rich natural orthopyroxene Sample: P = 0 GPa, in air, same # of reflections as DAC crystal American Mineralogist, 2008, 93, 644-652 |
9010426 | CIF | Al0.236 Ca0.01 Fe0.967 Mg0.923 Mn0.016 O6 Si1.848 | P b c a | 18.2804; 8.8601; 5.2161 90; 90; 90 | 844.832 | Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Secco, L.; Dal Negro, A. The high-pressure behavior of an Al- and Fe-rich natural orthopyroxene Sample: P = 0.163 GPa American Mineralogist, 2008, 93, 644-652 |
9010427 | CIF | Al0.236 Ca0.01 Fe0.967 Mg0.923 Mn0.016 O6 Si1.848 | P b c a | 18.2192; 8.8111; 5.1965 90; 90; 90 | 834.2 | Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Secco, L.; Dal Negro, A. The high-pressure behavior of an Al- and Fe-rich natural orthopyroxene Sample: P = 1.715 GPa American Mineralogist, 2008, 93, 644-652 |
9010428 | CIF | Al0.236 Ca0.01 Fe0.967 Mg0.923 Mn0.016 O6 Si1.848 | P b c a | 18.1427; 8.746; 5.1716 90; 90; 90 | 820.609 | Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Secco, L.; Dal Negro, A. The high-pressure behavior of an Al- and Fe-rich natural orthopyroxene Sample: P = 3.947 GPa American Mineralogist, 2008, 93, 644-652 |
9010429 | CIF | Al0.236 Ca0.01 Fe0.967 Mg0.923 Mn0.016 O6 Si1.848 | P b c a | 18.0221; 8.6456; 5.1327 90; 90; 90 | 799.736 | Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Secco, L.; Dal Negro, A. The high-pressure behavior of an Al- and Fe-rich natural orthopyroxene Sample: P = 8.033 GPa American Mineralogist, 2008, 93, 644-652 |
9010430 | CIF | Al0.236 Ca0.01 Fe0.967 Mg0.923 Mn0.016 O6 Si1.848 | P b c a | 17.977; 8.61; 5.1227 90; 90; 90 | 792.902 | Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Secco, L.; Dal Negro, A. The high-pressure behavior of an Al- and Fe-rich natural orthopyroxene Sample: P = 9.562 GPa American Mineralogist, 2008, 93, 644-652 |
2220936 | CIF Paper | Al0.95 As Co0.05 H4 O6 | P b c a | 8.79263; 9.79795; 10.08393 90; 90; 90 | 868.728 | Zoppi, Matteo; Pratesi, Giovanni Rietveld refinement of a natural cobaltian mansfieldite from synchrotron data Acta Crystallographica Section E, 2009, 65, i6-i7 |
2002895 | CIF Paper | Al1.55 Na1.55 O4 Si0.45 | P b c a | 10.385; 14.198; 5.1925 90; 90; 90 | 765.6 | Thompson, John G; Withers, Ray L.; Melnitchenko, Alexandra; Palethorpe, Stephen R. Cristobalite-Related Phases in the NaAlO~2~‒NaAlSiO~4~ System. I. Two Tetragonal and Two Orthorhombic Structures Acta Crystallographica Section B, 1998, 54, 531-546 |
2002893 | CIF Paper | Al1.75 Na1.75 O4 Si0.25 | P b c a | 10.416; 14.25; 5.2038 90; 90; 90 | 772.4 | Thompson, John G; Withers, Ray L.; Melnitchenko, Alexandra; Palethorpe, Stephen R. Cristobalite-Related Phases in the NaAlO~2~‒NaAlSiO~4~ System. I. Two Tetragonal and Two Orthorhombic Structures Acta Crystallographica Section B, 1998, 54, 531-546 |
2106230 | CIF | Al2 Ba H4 O6 | P b c a | 12.99; 12.34; 7.19 90; 90; 90 | 1152.53 | Ahmed, A.H.M.; Dent Glasser, L.S. Barium Aluminate Hydrates. III. The Crystal Structure of alpha- Ba (Al O (O H)2)2 Acta Crystallographica B (24,1968-38,1982), 1970, 26, 1686-1690 |
7129139 | CIF | Al2 Br8 Sm | P b c a | 12.0436; 11.959; 20.842 90; 90; 90 | 3001.9 | Schäfer, Thomas C.; Sorg, Jens; Sedykh, Alexander E.; Müller-Buschbaum, Klaus Red emitting Sm(II) phosphors: Thermally switchable Luminescence in Sm(AlX4)2 (X = Cl, Br) by 5d-4f and intra-4f transitions Chemical Communications, 2021 |
4343650 | CIF | Al2 Cl8 Te4 | P b c a | 10.746; 14.112; 11.845 90; 90; 90 | 1796.27 | Couch, T.W.; Lokken, D.A.; Corbett, J.D. The crystal structures of tetratellurium(2+) tetrachloroaluminate and heptachlorodialuminate, Te4(2+) (Al Cl4)2(-) and Te4(2+) (Al2 Cl7)2(-) Inorganic Chemistry, 1972, 11, 357-362 |
1537019 | CIF | Al32 H123.68 O189.84 P32 | P b c a | 14.49297; 14.87313; 17.57384 90; 90; 90 | 3788.14 | Fjellvag, H.; Akporiaye, D.E.; Halvorsen, E.N.; Karlsson, A.; Lillerud, K.P.; Kongshaug, K.O. Crystal structure and MAS-NMR study of rehydrated UiO-7 Solid State Sciences, 2001, 3, 603-611 |
8103596 | CIF | Al5.175 Ca8.393 Fe0.45 Na0.875 O18 Si0.375 | P b c a | 10.879; 10.845; 15.106 90; 90; 90 | 1782.25 | Takeuchi, Y.; Nishi, F.; Maki, I. Crystal chemical characterization of the (Ca O)3 * (Al2 O3) - (Na2 O) solid solution series Zeitschrift fuer Kristallographie (149,1979-), 1980, 152, 259-307 |
9014308 | CIF | Al6 Ca8.5 Na O18 | P b c a | 10.875; 10.859; 15.105 90; 90; 90 | 1783.77 | Nishi, F.; Takeuchi, Y. The Al6O18 rings of tetrahedra in the structure of Ca8.5NaAl6O18 Acta Crystallographica, Section B, 1975, 31, 1169-1173 |
9003380 | CIF | As Ba H3 O5 | P b c a | 7.7519; 8.759; 14.668 90; 90; 90 | 995.941 | Jimenez, A.; Prieto, M.; Salvado, M. A.; Garcia-Granda S Structure and crystallization behavior of the (Ba,Sr)HAsO4.H2O solid-solution in aqueous environments American Mineralogist, 2004, 89, 601-609 |
9003379 | CIF | As Ba0.11 H3 O5 Sr0.89 | P b c a | 7.443; 8.477; 14.38 90; 90; 90 | 907.296 | Jimenez, A.; Prieto, M.; Salvado, M. A.; Garcia-Granda S Structure and crystallization behavior of the (Ba,Sr)HAsO4.H2O solid-solution in aqueous environments American Mineralogist, 2004, 89, 601-609 |
2106855 | CIF | As Ca H7 O7 | P b c a | 11.195; 10.713; 11.179 90; 90; 90 | 1340.72 | Catti, M.; Ferraris, G. Hydrogen bonding in the crystalline state. Crystal structure of Ca H As O4 (H2 O)3 Acta Crystallographica B (24,1968-38,1982), 1973, 29, 90-96 |
1562759 | CIF | As Cs Cu2 S3 | P b c a | 9.531; 10.433; 13.355 90; 90; 90 | 1328 | Yao, Hua-Gang; Ji, Min; Ji, Shou-Hua; An, Yong-Lin Synthesis, structure and characterization of two new copper(І)-thioarsenates (ІІІ) constructed by the [AsS3]3− and CuSx units Journal of Solid State Chemistry, 2013, 198, 289-294 |
1540957 | CIF | As Cs Se2 | P b c a | 6.755; 9.689; 16.645 90; 90; 90 | 1089.4 | Sheldrick, W.S.; Haeusler, H.J. Zur Kenntnis von Alkalimetaselenoarseniten. Darstellung und Kristallstrukturen von M As Se2, M = K, Rb, Cs Zeitschrift fuer Anorganische und Allgemeine Chemie, 1988, 561, 139-148 |
4327215 | CIF | As F10 N S Xe | P b c a | 8.7844; 12.3857; 16.255 90; 90; 90 | 1768.56 | Gregory L. Smith; Hélène P. A. Mercier; Gary J. Schrobilgen Synthesis of [F3S\τbNXeF][AsF6] and Structural Study by Multi-NMR and Raman Spectroscopy, Electronic Structure Calculations, and X-ray Crystallography Inorganic Chemistry, 2007, 46, 1369-1378 |
4031796 | CIF | As F10 N S2 | P b c a | 14.909; 9.843; 12.113 90; 90; 90 | 1777.57 | Brooks, W.V.F.; Wong, C.-M.; Passmore, J.; MacLean, G.K.; White, P.S. Reaction of S2 N As F6 with Halogens: Preparation and X-Ray Crystal Structure of (S F2)2 N As F6; Preparation of (S Br2)2 N As F6,and Vibrational Spectrum and Normal-Co-Ordinate Analysis of the (SX)2 N(+) (X=Cl or Br) Cations Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1983, 1983, 1961-1983 |
2212542 | CIF HKL Paper | As Fe H4 O6 | P b c a | 8.942; 10.075; 10.339 90; 90; 90 | 931.4 | Yan Xu; Guang-Peng Zhou; Xue-Fang Zheng Redetermination of iron(III) arsenate dihydrate Acta Crystallographica Section E, 2007, 63, i67-i69 |
9007605 | CIF | As Fe H4 O6 | P b c a | 10.325; 8.953; 10.038 90; 90; 90 | 927.91 | Kitahama, K.; Kiriyama, R.; Yoshihisa, B. Refinement of the crystal structure of scorodite Acta Crystallographica, Section B, 1975, 31, 322-324 |
9003378 | CIF | As H3 O5 Sr | P b c a | 7.4361; 8.4808; 14.348 90; 90; 90 | 904.843 | Jimenez, A.; Prieto, M.; Salvado, M. A.; Garcia-Granda S Structure and crystallization behavior of the (Ba,Sr)HAsO4.H2O solid-solution in aqueous environments American Mineralogist, 2004, 89, 601-609 |
1531142 | CIF | As H4 In O6 | P b c a | 9.09; 10.344; 10.468 90; 90; 90 | 984.274 | Chen Zhenxia; Zhao, D.-Y.; Weng, L.-H.; Zhou, Y.-M.; Zhang, H.-Y. Synthesis and structure of a new three-dimensional microporous indium arsenate Hua Hsueh Hsueh Pao, 2002, 60, 305-309 |
9007613 | CIF | As H9 Mg O8 | P b c a | 7.472; 10.891; 16.585 90; 90; 90 | 1349.65 | Protas, J.; Gindt, R. Structure cristalline de la brassite, MgHAsO4*4H2O, produit de deshydratation de la roesslerite Locality: synthetic Acta Crystallographica, Section B, 1976, 32, 1460-1466 |
1561966 | CIF | As Li3 O25 W7 | P b c a | 7.2438; 10.0815; 49.0616 90; 90; 90 | 3582.9 | Zhao, Pei; Mangir Murshed, M.; Huq, Ashfia; Grossmann, Henrike K.; Mädler, Lutz; Alekseev, Evgeny V.; Gesing, Thorsten M. Nanoscale building blocks in a novel lithium arsenotungsten bronze: Synthesis and characterization Journal of Solid State Chemistry, 2015, 226, 81-87 |
2013927 | CIF HKL Paper | As Na O2 | P b c a | 6.7762; 5.0901; 14.3098 90; 90; 90 | 493.57 | Lee, Clare; Harrison, William T. A. The <i>catena</i>-arsenite chain anion, [AsO~2~]~<i>n~</i>^<i>n^{-</i>}: (H~3~NCH~2~CH~2~NH~3~)~0.5~[AsO~2~] and NaAsO~2~ (revisited) Acta Crystallographica Section C, 2004, 60, m215-m218 |
2310632 | CIF | As Na O2 | P b c a | 14.314; 6.779; 5.086 90; 90; 90 | 493.518 | Menary, J.W. The Crystal Structure of Sodium Polymetaarsenite (Na As O2)X Acta Crystallographica (1,1948-23,1967), 1958, 11, 742-743 |
1527333 | CIF | As Na Se2 | P b c a | 5.83; 24.27; 11.82 90; 90; 90 | 1672.46 | Eisenmann, B.; Schaefer, H. Ueber Seleno- und Telluroarsenite, -antimonite und -bismutite Zeitschrift fuer Anorganische und Allgemeine Chemie, 1979, 456, 87-94 |
4340531 | CIF | As Zn | P b c a | 5.6607; 7.2774; 7.5599 90; 90; 90 | 311.43 | Fischer, Andreas; Eklöf, Daniel; Benson, Daryn E.; Wu, Yang; Scheidt, Ernst-Wilhelm; Scherer, Wolfgang; Häussermann, Ulrich Synthesis, Structure, and Properties of the Electron-Poor II-V Semiconductor ZnAs. Inorganic chemistry, 2014, 53, 8691-8699 |
4340532 | CIF | As Zn | P b c a | 5.6731; 7.2754; 7.5572 90; 90; 90 | 311.916 | Fischer, Andreas; Eklöf, Daniel; Benson, Daryn E.; Wu, Yang; Scheidt, Ernst-Wilhelm; Scherer, Wolfgang; Häussermann, Ulrich Synthesis, Structure, and Properties of the Electron-Poor II-V Semiconductor ZnAs. Inorganic chemistry, 2014, 53, 8691-8699 |
2020180 | CIF | As2 Cu Fe2 H2 O10 | P b c a | 7.717; 13.225; 14.549 90; 90; 90 | 1484.83 | Effenberger, H. Structure of copper(II) diiron(III) dihydroxide diarsenate(V) Acta Crystallographica C (39,1983-), 1988, 44, 2041-2043 |
1526106 | CIF | As2 H5 O8 Rb | P b c a | 7.9403; 9.8218; 20.4244 90; 90; 90 | 1592.86 | Naili, H.; Mhiri, T. X-ray structural, vibrational and calorimetric studies of a new rubidium pentahydrogen arsenate Rb H5 (As O4)2 Journal of Alloys Compd., 2001, 315, 143-149 |
9000258 | CIF | As2 Ni | P b c a | 5.753; 5.799; 11.407 90; 90; 90 | 380.556 | Fleet, M. E. The crystal structure of pararammelsbergite (NiAs2) American Mineralogist, 1972, 57, 1-9 |
9012410 | CIF | As2 Ni | P b c a | 5.77; 5.838; 11.419 90; 90; 90 | 384.652 | Stassen, W. N.; Heyding, R. D. Crystal structures of RuSe2, OsSe2, PtAs2, and alpha-NiAs2 Canadian Journal of Chemistry, 1968, 46, 2159-2163 |
8100821 | CIF | As2.5 K3 Sb4.5 | P b c a | 13.33; 26.042; 15.983 90; 90; 90 | 5548 | Hönle, Wolfgang; Buresch, Juta; Peters, Karl; Chang, Jen-Hui; von Schnering, Hans Georg Crystal structure of tripotassium heptapentelides K~3~[As~x~Sb~1-x~]~7~ with x = 5/14 and x = 13/14 Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 491-493 |
1535168 | CIF | As3 La Si | P b c a | 6.084; 5.986; 26.235 90; 90; 90 | 955.448 | Hayakawa, H.; Ono, S.; Suzuki, A. The crystal structure of lanthanum silicon triarsenide (La Si As3) Nippon Kagaku Kaishi (= J.Chem.Soc.Japan) (1947-), 1984, 1984, 697-701 |
1560683 | CIF | As4 Cl2 Mn7 O16 | P b c a | 8.2315; 8.5673; 22.5625 90; 90; 90 | 1591.15 | Weil, Matthias; Kremer, Reinhard K. Crystal growth and crystal structures of six novel phases in the Mn/As/O/Cl(Br) system, as well as magnetic properties of α -Mn 3 (AsO 4 ) 2 Journal of Solid State Chemistry, 2017, 245, 115-126 |
8104389 | CIF | As4 Cs5.18 Ga2 Rb0.82 | P b c a | 15.0513; 26.3804; 9.7476 90; 90; 90 | 3870.38 | Somer, M.; Carrillo-Cabrera, W.; Peters, K.; von Schnering, H.G. Crystal structure of Cesium rubidium di-mue-arsenido-bis(arsenidogallate) Zeitschrift fuer Kristallographie (149,1979-), 1992, 201, 327-328 |
8104387 | CIF | As4 Cs5.23 Ga2 K0.77 | P b c a | 15.0326; 26.1623; 9.6908 90; 90; 90 | 3811.27 | Somer, M.; Peters, K.; Thiery, D.; von Schnering, H.G. Crystal structure of cesium potassium di-mue-arsenidobis-(arsenidogallate) Zeitschrift fuer Kristallographie (149,1979-), 1991, 195, 312-313 |
9011505 | CIF | As4.782 Pb S9 Sb0.218 Tl | P b c a | 10.786; 35.389; 8.141 90; 90; 90 | 3107.47 | Matsushita, Y.; Takeuchi, Y. Refinement of the crystal structure of hutchinsonite, TlPbAs5S9 Zeitschrift fur Kristallographie, 1994, 209, 475-478 |
1539286 | CIF | As5 Pb S9 Tl | P b c a | 10.86; 35.45; 8.16 90; 90; 90 | 3141.49 | Takeuchi, Y.; Nowacki, W.; Ghose, S. The crystal structure of the thallium-lead sulfosalt hutchinsonite Chimia, 1964, 18, 215-217 |
9008108 | CIF | As5 Pb S9 Tl | P b c a | 10.81; 35.36; 8.16 90; 90; 90 | 3119.09 | Takeuchi, Y.; Ghose, S.; Nowacki, W. The crystal structure of hutchinsonite, (Tl,Pb)2As5S9 Zeitschrift fur Kristallographie, 1965, 121, 321-348 |
4318760 | CIF | As6 Cs9 Nb2 | P b c a | 17.5848; 16.94; 18.183 90; 90; 90 | 5416.5 | Franck Gascoin; Slavi C. Sevov Synthesis and Characterization of K38Nb7As24 and Cs9Nb2As6: The First Mixed-Valence Transition-Metal Zintl Phases Inorganic Chemistry, 2002, 41, 5920-5924 |
8100822 | CIF | As6.6 K3 Sb0.4 | P b c a | 13.102; 25.737; 15.199 90; 90; 90 | 5125 | Hönle, Wolfgang; Buresch, Juta; Peters, Karl; Chang, Jen-Hui; von Schnering, Hans Georg Crystal structure of tripotassium heptapentelides K~3~[As~x~Sb~1-x~] ~7~ with x = 5/14 and x = 13/14 Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 491-493 |
7222739 | CIF | As7 Cs3 | P b c a | 10.228; 13.176; 21.952 90; 90; 90 | 2958.34 | Emmerling, F.; Roehr, C. Alkalimetall-Arsenide A3 As7 und A As (A = K, Rb, Cs). Synthesen, Kristallstrukturen, Schwingungsspektren Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 2002, 57, 963-975 |
7222737 | CIF | As7 K3 | P b c a | 12.919; 25.441; 15.377 90; 90; 90 | 5053.99 | Emmerling, F.; Roehr, C. Alkalimetall-Arsenide A3 As7 und A As (A = K, Rb, Cs). Synthesen, Kristallstrukturen, Schwingungsspektren Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 2002, 57, 963-975 |
8100819 | CIF | As7 Li3 | P b c a | 12.466; 22.489; 12.592 90; 90; 90 | 3530.1 | Hönle, Wolfgang; Buresch, Juta; Peters, Karl; Chang, Jen-Hui; von Schnering, Hans Georg Crystal structure of the low-temperature modification of trilithium heptaarsenide, LT-Li~3~As~7~ Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 485-486 |
8100815 | CIF | As7 Rb3 | P b c a | 13.194; 25.878; 15.881 90; 90; 90 | 5422.3 | Hönle, Wolfgang; Buresch, Juta; Wolf, Juliane; Peters, Karl; Chang, Jen-Hui; von Schnering, Hans Georg Crystal structure of the low-temperature modification of trirubidium heptaarsenide, LT-Rb~3~As~7~ Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 489-490 |
1510264 | CIF | Au O4 S | P b c a | 8.549; 8.249; 10.011 90; 90; 90 | 705.983 | Wickleder, M.S. Au S O4 : a true gold(II) sulfate with Au2(4+) ion Zeitschrift fuer Anorganische und Allgemeine Chemie, 2001, 627, 2112-2114 |
1510306 | CIF | Au Sn2 | P b c a | 6.909; 7.037; 11.789 90; 90; 90 | 573.165 | Schubert, K.; Gohle, R.; Breimer, H. Zum Aufbau der Systeme Gold-Indium, Gold-Zinn, Gold-Indium Zinn uns Gold-Zinn-Antimon Zeitschrift fuer Metallkunde, 1959, 50, 146-153 |
7209398 | CIF | Au Sn2 | P b c a | 6.898; 7.011; 11.773 90; 90; 90 | 569.364 | Wu, Z.; Rodewald, U.C.; Hoffmann, R.D.; Poettgen, R. Structure refinement of Au Sn2 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 2006, 61, 108-110 |
1510484 | CIF | Au3 Ca7 | P b c a | 20.742; 18.036; 6.665 90; 90; 90 | 2493.4 | Fornasini, M.L.; Merlo, F. Ca7 Au3 and Ca5 Au4, two structures closely related to the Th7 Fe3 and Pu5 Rh4 types Journal of Solid State Chemistry, 1985, 59, 65-70 |
9014644 | CIF | B Be2 F0.04 H0.96 O3.96 | P b c a | 9.762; 12.201; 4.43 90; 90; 90 | 527.64 | Gatta, G. D.; McIntyre, G. J.; Bromiley, G.; Guastoni, A.; Nestola, F. A single-crystal neutron diffraction study of hambergite, Be2BO3(OH,F) American Mineralogist, 2012, 97, 1891-1897 |
1011268 | CIF | B Be2 H O4 | P b c a | 9.75; 12.204; 4.429 90; 90; 90 | 527 | Zachariasen, W H The crystalline structure of Hambergite Be2 B O3 (O H) Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1931, 76, 289-302 |
9004396 | CIF | B Be2 H O4 | P b c a | 9.776; 12.194; 4.43 90; 90; 90 | 528.094 | Burns, P. C.; Novak, M.; Hawthorne, F. C. Fluorine-hydroxyl variation in hambergite: A crystal-structure study Note: sample HM1 The Canadian Mineralogist, 1995, 33, 1205-1213 |
9004397 | CIF | B Be2 H O4 | P b c a | 9.754; 12.231; 4.434 90; 90; 90 | 528.981 | Burns, P. C.; Novak, M.; Hawthorne, F. C. Fluorine-hydroxyl variation in hambergite: A crystal-structure study Note: sample HM2 The Canadian Mineralogist, 1995, 33, 1205-1213 |
9004398 | CIF | B Be2 H O4 | P b c a | 9.678; 12.313; 4.439 90; 90; 90 | 528.974 | Burns, P. C.; Novak, M.; Hawthorne, F. C. Fluorine-hydroxyl variation in hambergite: A crystal-structure study Note: sample HM3 The Canadian Mineralogist, 1995, 33, 1205-1213 |
9004399 | CIF | B Be2 H O4 | P b c a | 9.663; 12.364; 4.44 90; 90; 90 | 530.462 | Burns, P. C.; Novak, M.; Hawthorne, F. C. Fluorine-hydroxyl variation in hambergite: A crystal-structure study Note: sample HM4 The Canadian Mineralogist, 1995, 33, 1205-1213 |
9004400 | CIF | B Be2 H O4 | P b c a | 9.654; 12.347; 4.4364 90; 90; 90 | 528.81 | Burns, P. C.; Novak, M.; Hawthorne, F. C. Fluorine-hydroxyl variation in hambergite: A crystal-structure study Note: sample HM5 The Canadian Mineralogist, 1995, 33, 1205-1213 |
7031516 | CIF | B Bi4 O10 P | P b c a | 5.536; 14.102; 22.62 90; 90; 90 | 1766 | Wang, Ying; Pan, Shilie; Huang, Shengshi; Dong, Lingyun; Zhang, Min; Han, Shujuan; Wang, Xian Structural insights for the design of new borate-phosphates: synthesis, crystal structure and optical properties of Pb4O(BO3)(PO4) and Bi4O3(BO3)(PO4). Dalton transactions (Cambridge, England : 2003), 2014, 43, 12886 |
1511464 | CIF | B Ca Li O3 | P b c a | 13.227; 6.1675; 6.062 90; 90; 90 | 494.523 | Xu, Y.P.; He, M.; Li, X.Z.; Dai, L.; Wu, L.; Li, H.; Chen, X.L. Structure determination of a new compound Li Ca B O3 Journal of Solid State Chemistry, 2004, 177, 1111-1116 |
1511036 | CIF | B Ce3 O10 Si2 | P b c a | 9.9007; 7.2036; 23.292 90; 90; 90 | 1661.2 | Grossholz, H.; Mueller-Bunz, H.; Schleid, T. Einkristalle des Cer(III)-Borosilicats Ce3 (B Si O6) (Si O4) Zeitschrift fuer Anorganische und Allgemeine Chemie, 2001, 627, 1436-1438 |
1511039 | CIF | B Cl Mg2 N2 | P b c a | 6.6139; 9.766; 10.6 90; 90; 90 | 684.668 | Somer, M.; Cardoso Gil, R.; Borrmann, H.; Kuetuekcue, M.N.; Carillo-Cabrera, W. Mg2 (B N2) Cl and Mg8 (B N2)5 I: Novel magnesium nitridoborate halides - syntheses, crystal structures and vibrational spectra Zeitschrift fuer Anorganische und Allgemeine Chemie, 2004, 630, 1015-1021 |
4309995 | CIF | B Cu0.5 H3 O6 P | P b c a | 13.487; 8.331; 7.827 90; 90; 90 | 879.4 | Hengzhen Shi; Min Li; Hejin Tangbo; Aiguo Kong; Bo Chen; Yongkui Shan A Novel Open-Framework Copper Borophosphate: Cu(H2O)2[B2P2O8(OH)2] Inorganic Chemistry, 2005, 44, 8179-8181 |
1562273 | CIF | B Cu2 H3 O10 P2 | P b c a | 8.234; 9.655; 17.805 90; 90; 90 | 1415.48 | Zhao, Long; Liu, Wei; Ma, Xiaohong; Cao, Lixin; Su, Ge; Lu, Zhisheng The molten hydrated flux synthesis of a novel open-framework copper borophosphate and its structural relation with the precursors Journal of Solid State Chemistry, 2014, 218, 10-14 |
4344131 | CIF | B D3 F3 N | P b c a | 7.979; 7.925; 9.1956 90; 90; 90 | 581.471 | Penner, G.H.; Ruscitti, B.; Reynolds, J.; Swainson, I. Structure and dynamics of N D3 B F3 in the solid and gas phases: a combined NMR, neutron diffraction and ab initio study Inorganic Chemistry, 2002, 41, 7064-7071 |
2005491 | CIF Paper | B Eu3 O10 Si2 | P b c a | 9.673; 6.992; 22.867 90; 90; 90 | 1546.6 | Chi, L.; Chen, H.; Deng, S.; Zhuang, H.; Huang, J. A New Europium Borosilicate, Eu~3~BSi~2~O~10~ Acta Crystallographica Section C, 1996, 52, 2385-2387 |
1502675 | CIF | B F3 H3 N | P b c a | 8.0067; 7.9511; 9.2216 90; 90; 90 | 587.07 | Mebs, Stefan; Grabowsky, Simon; Förster, Diana; Kickbusch, Rainer; Hartl, Monika; Daemen, Luke L.; Morgenroth, Wolfgang; Luger, Peter; Paulus, Beate; Lentz, Dieter Charge transfer via the dative N-B bond and dihydrogen contacts. Experimental and theoretical electron density studies of small Lewis acid-base adducts. The journal of physical chemistry. A, 2010, 114, 10185-10196 |
1534628 | CIF | B F3 H3 N | P b c a | 8.0726; 8.0048; 9.2431 90; 90; 90 | 597.285 | Goebbels, D.; Meyer, G. Aufbau und Abbau von (N H4) (B F4) und (H3 N)-(B F3) Zeitschrift fuer Anorganische und Allgemeine Chemie, 2002, 628, 1799-1805 |
2311074 | CIF | B F3 H3 N | P b c a | 8.22; 8.11; 9.31 90; 90; 90 | 620.644 | Hoard, J.L.; Geller, S.; Cashin, W.M. Structures of molecular addition compounds. III.ammonia-boron trifluoride, H3 N B F3 Acta Crystallographica (1,1948-23,1967), 1951, 4, 396-398 |
1534633 | CIF | B F4 H Hg2 O | P b c a | 9.8504; 9.9096; 11.41 90; 90; 90 | 1113.77 | Goebbels, D.; Meyer, G. Hg2 (O H) (B F4), the first basic mercurous tetrafluoroborate Zeitschrift fuer Anorganische und Allgemeine Chemie, 2003, 629, 933-935 |
7708361 | CIF | B Ga H2 O10 Se3 | P b c a | 8.5773; 8.8445; 22.0195 90; 90; 90 | 1670.44 | Cao, Ming-Yang; Hu, Chun-Li; Kong, Fang; Xiong, Zheyao; Mao, Jiang-Gao M(B(SeO3)3)H2O(M = Al, Ga):The first boroselenites with a unique sandwich like double-layer structure Dalton Transactions, 2021 |
1511168 | CIF | B Gd3 O10 Si2 | P b c a | 9.63; 6.959; 22.792 90; 90; 90 | 1527.41 | Chen, H.-Y.; Zhuang, H.-H.; Huang Jinshun; Lin, X.; Chi Lisheng Synthesis and crystal structure of Gd3 (B Si O6) (Si O4) Jiegon Huaxue, 1998, 17, 297-301 |
1511177 | CIF | B Ge1.08 Nd3 O10 Si0.92 | P b c a | 9.845; 7.146; 23.382 90; 90; 90 | 1644.98 | Serhan, K.; Darriet, J.; Taibi, M.; Aride, J.; le Flem, G.; Boukhari, A. The crystal structure of a new borogermanosilicate Nd3BGe1.08Si0.92O10 Journal of Solid State Chemistry, 1994, 110, 384-388 |
1542044 | CIF | B H4 Li O4 | P b c a | 9.169; 7.958; 8.548 90; 90; 90 | 623.721 | Kutschabsky, L.; Reck, G. Anwendung der Methode der linearen Strukturfaktorgleichungssysteme zur Bestimmung des Strukturprinzips zentrosymmetrischer Strukturen aus Harkerschnitten Monatsberichte der Deutschen Akademie der Wissenschaften zu Berlin, 1966, 8, 648-654 |
2200380 | CIF | B H4 Li O4 | P b c a | 7.9362; 8.522; 9.1762 90; 90; 90 | 620.61 | Fronczek, Frank R.; Aubry, David A.; Stanley, George G. Refinement of lithium tetrahydroxoborate with low-temperature CCD data Acta Crystallographica, Section E, 2001, 57, i62-i63 |
4102947 | CIF | B H5 K N | P b c a | 9.349; 8.209; 17.192 90; 90; 90 | 1319.4 | Himashinie V. K. Diyabalanage; Tessui Nakagawa; Roshan P. Shrestha; Troy A. Semelsberger; Benjamin L. Davis; Brian L. Scott; Anthony K. Burrell; William I. F. David; Kate R. Ryan; Martin Owen Jones; Peter P. Edwards Potassium(I) Amidotrihydroborate: Structure and Hydrogen Release Journal of the American Chemical Society, 2010, 132, 11836-11837 |
4106960 | CIF | B H5 N Na | P b c a | 5.6446; 7.425; 14.514 90; 90; 90 | 608.3 | David J. Wolstenholme; James T. Titah; Franklin N. Che; Kyle T. Traboulsee; Jenna Flogeras; G. Sean McGrady Homopolar Dihydrogen Bonding in Alkali-Metal Amidoboranes and Its Implications for Hydrogen Storage Journal of the American Chemical Society, 2011, 133, 16598-16604 |
7707597 | CIF | B La O5 Te | P b c a | 10.822; 6.9216; 11.5812 90; 90; 90 | 867.5 | Wang, Jiankang; Wu, Hongping; Yu, Hongwei; Hu, Zhanggui; Wang, Jiyang; Wu, Yicheng LaTeBO<sub>5</sub>: a new borotellurite with a large birefringence activated by the highly distorted [Te<sup>(iv)</sup>O<sub>4</sub>] group. Dalton transactions (Cambridge, England : 2003), 2021, 50, 12404-12407 |
7209471 | CIF | B O12 P3 Pb3 | P b c a | 6.9459; 14.199; 21.116 90; 90; 90 | 2082.56 | Bluhm, K.; Park, C.-H. Synthese und Kristallstruktur von Triblei-DiphosphatoBorat-Phosphat, eine Verbindung mit einem ((P O4)2 B P O4)6- - Anion Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 1995, 50, 1617-1622 |
7037804 | CIF | B10 Cl2 H8 P2 | P b c a | 13.283; 12.311; 13.786 90; 90; 90 | 2254.38 | Gruener, B.; Hnyk, D.; Stibr, B.; Cisarova, I.; Plzak, Z. Phosphaborane chemistry. Syntheses and calculated molecular structures of mono- and di-chloro derivatives of 1,2-diphospha-closo-dodecaborane(10) Journal of the Chemical Society. Dalton Transactions, 2002, 2002, 2954-2959 |
2310622 | CIF | B10 K2 O16 | P b c a | 7.418; 11.702; 14.745 90; 90; 90 | 1279.95 | Krogh-Moe, J. Least-squares refinement of the crystal structure of potassium pentaborate Acta Crystallographica (1,1948-23,1967), 1965, 18, 1088-1089 |
7215730 | CIF | B18 H36 K10 O75 V12 | P b c a | 18.212; 19.276; 19.306 90; 90; 90 | 6777.5 | An, Litao; Zhou, Jian; Xiao, Hong-Ping; Liu, Xing; Zou, Huahong; Pan, Chun-Yang; Liu, Meihua; Li, Jianhui A series of new 3-D boratopolyoxovanadates containing five types of [KxOy]n building units CrystEngComm, 2014, 16, 4236 |
2105406 | CIF | B2 Ca F8 | P b c a | 9.2792; 8.9103; 13.3719 90; 90; 90 | 1105.59 | Brown, W.E.; Schroeder, L.W.; Jordan, T.H.; Dickens, B. The crystal structure of Ca (B F4)2 Acta Crystallographica B (24,1968-38,1982), 1975, 31, 669-672 |
1547867 | CIF | B2 Ca Fe0.369 Mg0.631 O5 | P b c a | 36.2342; 11.182; 5.5197 90; 90; 90 | 2236.42 | Hayashi, A.; Momma, K.; Miyawaki, R.; Tanabe, M.; Kishi, S.; Kobayashi, S.; Kusachi, I. Kurchatovite from the Fuka mine, Okayama Prefecture, Japan Journal of Mineralogical and Petrological Sciences, 2017, 112, 159-165 |
9010721 | CIF | B2 Ca Mg O5 | P b c a | 36.34; 11.135; 5.499 90; 90; 90 | 2225.15 | Callegari, A.; Mazzi, F.; Tadini, C. Modular aspects of the crystal structures of kurchatovite and clinokurchatovite Locality: Solongo, Siberia European Journal of Mineralogy, 2003, 15, 277-282 |
4308740 | CIF | B2 Cd F8 | P b c a | 9.1271; 8.746; 13.225 90; 90; 90 | 1055.7 | Gašper Tavčar; Boris Žemva XeF2 as a Ligand in a Coordination Compound with the BF4- Anion Inorganic Chemistry, 2005, 44, 1525-1529 |
1512657 | CIF | B2 Cd O5 Sr | P b c a | 12.01; 5.795; 12.677 90; 90; 90 | 882.3 | Jian Cao; Junyu Gao; Shilie Pan; Hongwei Yu; Wenwu Zhao; Zhihua Yang Synthesis, crystal structure and properties of a new strontium cadmium diborate Inorganica Chimica Acta, 2012, 392, 459-464 |
7132370 | CIF | B2 Cl Rb S6 Sr3 | P b c a | 11.082; 7.9064; 29.1239 90; 90; 90 | 2551.8 | Yun, Yihan; Hou, Xueling; Yang, Zhihua; Li, Guangmao; Pan, Shilie [RbSr<sub>3</sub>X][(BS<sub>3</sub>)<sub>2</sub>] (X = Cl, Br): two salt-inclusion thioborates with large birefringence and structure transformation from centrosymmetric to asymmetric. Chemical communications (Cambridge, England), 2023, 60, 118-121 |
1510986 | CIF | B2 Cl4 | P b c a | 11.9; 6.281; 7.69 90; 90; 90 | 574.781 | Atoji, M.; Wheatley, P.J.; Lipscomb, W.N. Molecular Structure of Diborane Tetrachloride, B2 Cl4 Journal of Chemical Physics, 1955, 23, 1176-1176 |
7036277 | CIF | B2 Co H K2 O13 P3 | P b c a | 9.5543; 12.056; 19.814 90; 90; 90 | 2282.3 | Zhang, Dan; Feng, Yuquan; Liu, Yunling; Zhang, Yuan; Li, Guanghua; Yuan, Hongming Organotemplate-free synthesis of two open-framework metal borophosphates. Dalton transactions (Cambridge, England : 2003), 2015, 44, 17100-17105 |
7036276 | CIF | B2 Co H3 K2 O14 P3 | P b c a | 9.7255; 12.2075; 19.9276 90; 90; 90 | 2365.9 | Zhang, Dan; Feng, Yuquan; Liu, Yunling; Zhang, Yuan; Li, Guanghua; Yuan, Hongming Organotemplate-free synthesis of two open-framework metal borophosphates. Dalton transactions (Cambridge, England : 2003), 2015, 44, 17100-17105 |
2016139 | CIF HKL Paper | B2 F8 Sr | P b c a | 9.121; 8.714; 13.18 90; 90; 90 | 1047.6 | Bunic̆, Tina; Tavc̆ar, Gas̆per; Goreshnik, Evgeny; Z̆emva, Boris Strontium tetrafluoridoborate and barium tetrafluoridoborate Acta Crystallographica Section C, 2007, 63, i75-i76 |
2017572 | CIF HKL Paper | B2 F8 Sr | P b c a | 9.602; 9.259; 13.89 90; 90; 90 | 1234.9 | Goreshnik, Evgeny; Vakulka, Andrii; Žemva, Boris Strontium tetrafluoroborate. Erratum Acta Crystallographica Section C, 2010, 66, e9 |
4031593 | CIF | B2 H6 O12 P8 | P b c a | 8.606; 15.686; 22.96 90; 90; 90 | 3099.46 | Tellenbach, A.; Jansen, M. (P8 O12) * 2(B H3) - The borane adduct of a new molecular phosphorus oxide European Journal of Inorganic Chemistry, 2003, 2003, 3759-3766 |
2012069 | CIF HKL Paper | B20 H26 | P b c a | 10.6601; 10.5515; 14.5604 90; 90; 90 | 1637.75 | Bould, Jonathan; William Clegg; Kennedy, John D.; Simon J. Teat Isomeric icosaboranes B~20~H~26~: the synchrotron structure of 1,1'-bis(<i>nido</i>-decaboranyl) Acta Crystallographica Section C, 2001, 57, 779-780 |
4031403 | CIF | B20 H26 | P b c a | 14.673; 19.765; 11.58 90; 90; 90 | 3358.34 | Boocock, S.K.; Greenwood, N.N.; Kennedy, J.D.; McDonald, W.S.; Staves, J. The chemistry of isomeric icosaboranes, B20 H26. Molecular structures and physical characterization of 2,2'-Bi(nido-decaboranyl) and 2,6'-Bi(nido-decaboranyl) Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1980, 1980, 790-796 |
7007357 | CIF | B20 H26 | P b c a | 11.3252; 14.045; 20.8013 90; 90; 90 | 3308.71 | Bould, Jonathan; Dörfler, Udo; Rath, Nigam P.; Barton, Lawrence; Kilner, Colin A.; Londesborough, Michael G. S.; Ormsby, Daniel L.; Kennedy, John D. Macropolyhedral boron-containing cluster chemistry. A synthetic approach via the auto-fusion of [6,9-(SMe2)2-arachno-B10H12]. Dalton transactions (Cambridge, England : 2003), 2006, 3752-3765 |
4325236 | CIF | B3 Bi2 H O8 | P b c a | 6.0268; 11.3635; 19.3485 90; 90; 90 | 1325.09 | Rihong Cong; Junliang Sun; Tao Yang; Mingrun Li; Fuhui Liao; Yingxia Wang; Jianhua Lin Syntheses and Crystal Structures of Two New Bismuth Hydroxyl Borates Containing [Bi2O2]2+ Layers: Bi2O2[B3O5(OH)] and Bi2O2[BO2(OH)] Inorganic Chemistry, 2011, 50, 5098-5104 |
2310110 | CIF | B4 Cd O7 | P b c a | 8.21; 8.7; 14.18 90; 90; 90 | 1012.84 | Krogh-Moe, J.; Ihara, M. The crystal structure of cadmium diborate, Cd O (B2 O3)2 Acta Crystallographica (1,1948-23,1967), 1966, 20, 132-134 |
1511654 | CIF | B4 Co O7 | P b c a | 8.1189; 8.621; 13.737 90; 90; 90 | 961.494 | Taylor, N.J.; Rowsell, J.L.C.; Nazar, L.F. Crystallographic investigation of the Co - B - O system Journal of Solid State Chemistry, 2003, 174, 189-197 |
8103001 | CIF | B4 Co3 Cs2 H6 O28 P6 | P b c a | 9.5526; 12.319; 20.1123 90; 90; 90 | 2366.78 | Prashanth W. Menezes; Stefan Hoffmann; Yurii Prots; Rüdiger Kniep Crystal structure of dicaesium diaquatricobalt(II) (phosphate-borate-hydrogenphosphate), Cs2Co3(H2O)2[B4P6O24(OH)2] Zeitschrift für Kristallographie - New Crystal Structures, 2009, 224, 1 |
2106558 | CIF | B4 H2 Na2 O8 | P b c a | 8.54; 10.263; 14.547 90; 90; 90 | 1274.99 | Menchetti, S.; Sabelli, C. The crystal structure of Na2 (B4 O6 (O H)2) Acta Crystallographica B (24,1968-38,1982), 1978, 34, 1080-1084 |
7047947 | CIF | B4 H20 N2 Sr | P b c a | 8.47444; 13.56258; 8.57401 90; 90; 90 | 985.456 | Jørgensen, Mathias; Lee, Young-Su; Bjerring, Morten; Jepsen, Lars H.; Akbey, Ümit; Cho, Young Whan; Jensen, Torben R. Disorder induced polymorphic transitions in the high hydrogen density compound Sr(BH<sub>4</sub>)<sub>2</sub>(NH<sub>3</sub>BH<sub>3</sub>)<sub>2</sub>. Dalton transactions (Cambridge, England : 2003), 2018, 47, 16737-16746 |
7044478 | CIF | B4 H24 N4 O13 Zn | P b c a | 15.0796; 11.8853; 16.7606 90; 90; 90 | 3003.9 | Imer, Marcos Ramón; González, Mariana Estefani; Veiga, Nicolás; Kremer, Carlos; Suescun, Leopoldo; Arizaga, Livia Synthesis, structural characterization and scalable preparation of new amino-zinc borates. Dalton Trans., 2017 |
2201763 | CIF | B4 Hg O7 | P b c a | 8.3994; 8.8066; 14.137 90; 90; 90 | 1045.7 | Weil, Matthias HgB~4~O~7~, a member of the isotypic M^II^B~4~O~7~ family (M^II^ = Mg, Mn, Zn, Cd) Acta Crystallographica, Section E, 2003, 59, i40-i42 |
9007943 | CIF | B4 Hg O7 | P b c a | 8.3994; 8.8066; 14.137 90; 90; 90 | 1045.72 | Weil, M. HgB4O7, a member of the isotypic MIIB4O7 family (MII = Mg, Mn, Zn, Cd) Acta Crystallographica, Section E, 2003, 59, i40-i42 |
1511482 | CIF | B4 Mn O7 | P b c a | 8.62354; 14.0071; 8.07237 90; 90; 90 | 975.068 | Bernstein, J.L.; Sherwood, R.C.; Gibart, P.; Abrahams, S.C. Manganese diborate. Crystal structure, magnetization, and thermal extinction dependence Journal of Chemical Physics, 1974, 60, 1899-1905 |
2105425 | CIF | B4 O7 Zn | P b c a | 13.714; 8.091; 8.631 90; 90; 90 | 957.696 | Martinez-Carrera, S.; Martinez-Ripoll, M.; Garcia-Blanco, S. The crystal structure of zinc diborate, Zn B4 O7 Acta Crystallographica B (24,1968-38,1982), 1971, 27, 672-677 |
7049873 | CIF | B5 Ba F H0.33 O8.17 | P b c a | 11.399; 9.429; 13.467 90; 90; 90 | 1447.4 | Huang, Chunmei; Han, Guopeng; Li, Hao; Zhang, Fangfang; Yang, Zhihua; Pan, Shilie A new barium fluorooxoborate BaB<sub>5</sub>O<sub>8</sub>F·xH<sub>2</sub>O with large birefringence and a wide UV transparency window. Dalton transactions (Cambridge, England : 2003), 2019, 48, 6714-6717 |
2311499 | CIF Paper | B5 Cd0.09 Na3 O10 Zn0.91 | P b c a | 7.9407; 12.293; 18.0684 90; 90; 90 | 1763.7 | Chen, Xue-An; Zhang, Ya-Hua; Chang, Xin-An; Xiao, Wei-Qiang Crystal structures of the solid solutions Na<sub>3</sub>Zn<sub>0.912</sub>Cd<sub>0.088</sub>B<sub>5</sub>O<sub>10</sub> and Na<sub>3</sub>Zn<sub>0.845</sub>Mg<sub>0.155</sub>B<sub>5</sub>O<sub>10</sub>. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1774-1778 |
1511539 | CIF | B5 Cs O8 | P b c a | 8.697; 8.431; 21.41 90; 90; 90 | 1569.88 | Touboul, M.; Nowogrocki, G.; Seguin, L.; Penin, N. Crystal structures of three M B5 O8 (M = Cs, Rb) borates (alpha-(Cs B5 O8), gamma-(Cs B5 O8) and beta-(Rb B5 O8)) Journal of Solid State Chemistry, 2001, 161, 205-213 |
7121798 | CIF | B5 F O8 Pb | P b c a | 10.885; 9.108; 13.576 90; 90; 90 | 1345.9 | Mutailipu, Miriding; Zhang, Min; Zhang, Bingbing; Yang, Zhihua; Pan, Shilie The first lead fluorooxoborate PbB<sub>5</sub>O<sub>8</sub>F: achieving the coexistence of large birefringence and deep-ultraviolet cut-off edge. Chemical communications (Cambridge, England), 2018, 54, 6308-6311 |
2106390 | CIF | B5 H4 Na3 O11 | P b c a | 8.804; 18.371; 10.924 90; 90; 90 | 1766.83 | Menchetti, S.; Sabelli, C. The crystal structure of synthetic sodium pentaborate monohydrate Acta Crystallographica B (24,1968-38,1982), 1977, 33, 3730-3733 |
1511545 | CIF | B5 Ho2 Ni10 | P b c a | 17.588; 9.001; 9.477 90; 90; 90 | 1500.3 | Zavalii, P.Yu.; Bruskov, V.A.; Kuz'ma, Yu.B.; Gubich, I.B. A new type of Ho2Ni10B5 boride structure Kristallografiya, 1991, 36, 490-491 |
2107027 | CIF | B5 K O8 | P b c a | 8.383; 8.418; 21.54 90; 90; 90 | 1520.04 | Krogh-Moe, J. The crystall structure of the high-temperature modification of potassium pentaborate Acta Crystallographica B (24,1968-38,1982), 1972, 28, 168-172 |
5910291 | CIF | B5 K O8 | P b c a | 7.42; 11.69; 14.72 90; 90; 90 | 1276.81 | Wyckoff, R. W. G. Pages 469-471 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals, 1951, 3, 469-469 |
1511550 | CIF | B5 Mg Na3 O10 | P b c a | 7.838; 12.288; 18.18 90; 90; 90 | 1750.98 | Xiao Weiqiang; Zang Hegui; Li Ming; Chang Xinan; Zuo Jianlong; Chen Xuean Syntheses and crystal structures of two pentaborates, Na3 Ca B5 O10 and Na3 Mg B5 O10 Solid State Sciences, 2007, 9, 678-685 |
2311500 | CIF Paper | B5 Mg0.155 Na3 O10 Zn0.845 | P b c a | 7.8931; 12.2555; 18.0874 90; 90; 90 | 1749.7 | Chen, Xue-An; Zhang, Ya-Hua; Chang, Xin-An; Xiao, Wei-Qiang Crystal structures of the solid solutions Na<sub>3</sub>Zn<sub>0.912</sub>Cd<sub>0.088</sub>B<sub>5</sub>O<sub>10</sub> and Na<sub>3</sub>Zn<sub>0.845</sub>Mg<sub>0.155</sub>B<sub>5</sub>O<sub>10</sub>. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1774-1778 |
1511554 | CIF | B5 O8 Rb | P b c a | 7.553; 11.857; 14.813 90; 90; 90 | 1326.59 | Seguin, L.; Touboul, M.; Penin, N.; Nowogrocki, G. Crystal structures of three M B5 O8 (M = Cs, Rb) borates (alpha-(Cs B5 O8), gamma-(Cs B5 O8) and beta-(Rb B5 O8)) Journal of Solid State Chemistry, 2001, 161, 205-213 |
1004151 | CIF | B5 O8 Tl | P b c a | 7.557; 11.925; 14.734 90; 90; 90 | 1327.8 | Touboul, M; Nowogrocki, G Dehydration process of Tl B5 O6 (O H)4 . 2(H2 O) and crystal structure of Tl B5 O8 Journal of Solid State Chemistry, 1998, 136, 216-220 |
7130839 | CIF | B6 F2 K2 O9 | P b c a | 11.7129; 10.303; 15.414 90; 90; 90 | 1860.1 | Chen, Zilong; Li, Zijian; Chu, Dongdong; Zhang, Fangfang; Li, Xiaojing; Yang, Zhihua; Long, Xifa; Pan, Shilie A2B6O9F2 (A = NH4, K): New members of A2B6O9F2 family with deep-UV cutoff edge and moderate birefringence Chemical Communications, 2022 |
9000250 | CIF | B6 H9 Mg O15 | P b c a | 12.54; 24.327; 7.48 90; 90; 90 | 2281.85 | Dal Negro, A.; Ungaretti, L.; Sabelli, C. The crystal structure of aksaite American Mineralogist, 1971, 56, 1553-1566 |
7700021 | CIF | B8 Cs4 Cu6 H12 O56 P12 | P b c a | 9.4057; 12.9274; 19.3912 90; 90; 90 | 2357.8 | Shvanskaya, Larisa; Yakubovich, Olga; Melchakova, Lyubov; Ivanova, Anna; Vasiliev, Alexander Crystal chemistry and physical properties of the A<sub>2</sub>M<sub>3</sub>(H<sub>2</sub>O)<sub>2</sub>[B<sub>4</sub>P<sub>6</sub>O<sub>24</sub>(OH)<sub>2</sub>] (A = Cs, Rb; M = Ni, Cu, (Ni, Fe)) borophosphate family. Dalton transactions (Cambridge, England : 2003), 2019, 48, 8835-8842 |
7700022 | CIF | B8 Cs4 H12 Ni6 O56 P12 | P b c a | 9.52; 12.2546; 19.966 90; 90; 90 | 2329.31 | Shvanskaya, Larisa; Yakubovich, Olga; Melchakova, Lyubov; Ivanova, Anna; Vasiliev, Alexander Crystal chemistry and physical properties of the A<sub>2</sub>M<sub>3</sub>(H<sub>2</sub>O)<sub>2</sub>[B<sub>4</sub>P<sub>6</sub>O<sub>24</sub>(OH)<sub>2</sub>] (A = Cs, Rb; M = Ni, Cu, (Ni, Fe)) borophosphate family. Dalton transactions (Cambridge, England : 2003), 2019, 48, 8835-8842 |
7700020 | CIF | B8 Fe H12 Ni5 O56 P12 Rb4 | P b c a | 9.4599; 12.2035; 19.9085 90; 90; 90 | 2298.31 | Shvanskaya, Larisa; Yakubovich, Olga; Melchakova, Lyubov; Ivanova, Anna; Vasiliev, Alexander Crystal chemistry and physical properties of the A<sub>2</sub>M<sub>3</sub>(H<sub>2</sub>O)<sub>2</sub>[B<sub>4</sub>P<sub>6</sub>O<sub>24</sub>(OH)<sub>2</sub>] (A = Cs, Rb; M = Ni, Cu, (Ni, Fe)) borophosphate family. Dalton transactions (Cambridge, England : 2003), 2019, 48, 8835-8842 |
4344575 | CIF | B8 K Li O13 | P b c a | 14.472; 8.4169; 18.101 90; 90; 90 | 2204.9 | An, Donghai; Kong, Qingrong; Zhang, Min; Yang, Yun; Li, Danni; Yang, Zhihua; Pan, Shilie; Chen, Huimin; Su, Zhi; Sun, Yi; Mutailipu, Miriding Versatile Coordination Mode of LiNaB8O13 and α- and β-LiKB8O13 via the Flexible Assembly of Four-Connected B5O10 and B3O7 Groups. Inorganic chemistry, 2016, 55, 552-554 |
7031829 | CIF | B9 H25 K4 N O39 V6 | P b c a | 19.1919; 18.1864; 19.2584 90; 90; 90 | 6721.8 | Hermosilla-Ibáñez, Patricio; Cañon-Mancisidor, Walter; Costamagna, Juan; Vega, Andrés; Paredes-García, Verónica; Garland, Maria Teresa; Le Fur, Eric; Cador, Olivier; Spodine, Evgenia; Venegas-Yazigi, Diego Crystal lattice effect on the quenching of the intracluster magnetic interaction in [V12B18O60H6](10-) polyoxometalate. Dalton transactions (Cambridge, England : 2003), 2014, 43, 14132-14141 |
2002837 | CIF | Ba Cd O9 P2 V | P b c a | 8.838; 8.915; 19.37398 90; 90; 90 | 1526.5 | Mueller-Buschbaum, Hk; Meyer, S; Mertens, B Zum Ba Zn (V O) (P O4)2-Typ verwandte, jedoch isotype Vanadylphosphate: Sr Zn (V O) (P O4)2 und Ba Cd (V O) (P O4)2. Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 1997, 52, 985-988 |
7045075 | CIF | Ba F O5 Se V | P b c a | 10.0539; 8.3967; 13.1744 90; 90; 90 | 1112.18 | Liang, Ming-Li; Ma, Yun-Xiang; Hu, Chun-Li; Kong, Fang; Mao, Jiang-Gao A(VO<sub>2</sub>F)(SeO<sub>3</sub>) (A = Sr, Ba) and Ba(MOF<sub>2</sub>)(TeO<sub>4</sub>) (M = Mo, W): first examples of alkali-earth selenites/tellurites with a fluorinated d<sup>0</sup>-TM octahedron. Dalton transactions (Cambridge, England : 2003), 2018, 47, 1513-1519 |
4301514 | CIF | Ba Ga2 H4 O6 | P b c a | 12.586; 7.4091; 13.042 90; 90; 90 | 1216.2 | Min Kyung Kim; Vinna Jo; Il-Wun Shim; Kang Min Ok New Inorganic Helical Chain: Synthesis, Structure, Characterization, and Interconversion of BaGa2O2(OH)4 Inorganic Chemistry, 2009, 48, 1275-1277 |
4338390 | CIF | Ba Ge4 Rh2 S6 | P b c a | 5.95124; 5.89412; 29.2011 90; 90; 90 | 1024.3 | Lei, Hechang; Yamaura, Jun-Ichi; Guo, Jiangang; Qi, Yanpeng; Toda, Yoshitake; Hosono, Hideo Layered Compounds BaM2Ge4Ch6 (M = Rh, Ir and Ch = S, Se) with Pyrite-Type Building Blocks and Ge-Ch Heteromolecule-Like Anions. Inorganic chemistry, 2014, 53, 5684-5691 |
1539448 | CIF | Ba H4 O6 | P b c a | 16.837; 6.407; 8.005 90; 90; 90 | 863.537 | Vannerberg, N.G. On the system Ba O2 - H2 O - H2 O2 3. The crystal structure of alpha-, beta-, and gamma-Ba O2 (H2 O2)2 and Ba O2 H2 O2 (H2 O)2 Arkiv foer Kemi, 1959, 14, 125-145 |
4316150 | CIF | Ba H6 N4 O32 U6 | P b c a | 7.2616; 17.097; 21.55 90; 90; 90 | 2675.5 | Daniel K. Unruh; Michelle Baranay; Melissa Baranay; Peter C. Burns Uranium(VI) Tetraoxido Core Coordinated by Bidentate Nitrate Inorganic Chemistry, 2010, 49, 6793-6795 |
1530860 | CIF | Ba H8 Mo4 O26 U3 | P b c a | 17.797; 11.975; 23.33 90; 90; 90 | 4972.07 | Tabachenko, V.V.; Balashov, V.L.; Kovba, L.M.; Serezhkin, V.N. Crystal Structure of Barium Uranyl Molybdate Ba (U O2)3 (Mo O4)4 (H2 O)4 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1984, 10, 854-857 |
4310551 | CIF | Ba Nb O8 P Te | P b c a | 6.7351; 7.554; 27.455 90; 90; 90 | 1396.8 | Kang Min Ok; Joseph Orzechowski; P. Shiv Halasyamani Synthesis, Structure, and Characterization of Two New Layered Mixed-Metal Phosphates, BaTeMO4(PO4) (M = Nb5+ or Ta5+) Inorganic Chemistry, 2004, 43, 964-968 |
1535510 | CIF | Ba O15 V10 | P b c a | 11.6155; 9.8735; 9.4178 90; 90; 90 | 1080.09 | Bridges, C.A.; Greedan, J.E. Phase transitions and electrical transport in the mixed-valence V(2+)/V(3+) oxide Ba V10 O15 Journal of Solid State Chemistry, 2004, 177, 1098-1110 |
2002839 | CIF | Ba O9 P2 V Zn | P b c a | 8.8137; 9.039; 18.53809 90; 90; 90 | 1476.9 | Mueller-Buschbaum, Hk; Meyer, S Synthese und Kristallstruktur eines Barium-Zink-Vanadylphosphats Ba Zn (V O) (P O4)2 mit ((V O) (P O4))-Schichten Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 1997, 52, 367-371 |
7011986 | CIF | Ba0.73 N4 Sr2.27 W | P b c a | 10.506; 9.75; 11.682 90; 90; 90 | 1196.6 | Baker, Charles F.; Barker, Marten G.; Blake, Alexander J.; Wilson, Claire; Gregory, Duncan H. New families of mixed alkaline-earth nitridomolybdates and nitridotungstates, (Ba,Sr)3[MN4] (M = Mo, W) Journal of the Chemical Society, Dalton Transactions, 2002, 3961-3966 |
7011983 | CIF | Ba0.81 Mo N4 Sr2.19 | P b c a | 10.503; 9.733; 11.672 90; 90; 90 | 1193.2 | Baker, Charles F.; Barker, Marten G.; Blake, Alexander J.; Wilson, Claire; Gregory, Duncan H. New families of mixed alkaline-earth nitridomolybdates and nitridotungstates, (Ba,Sr)3[MN4] (M = Mo, W) Journal of the Chemical Society, Dalton Transactions, 2002, 3961-3966 |
7011985 | CIF | Ba1.4 N4 Sr1.6 W | P b c a | 10.585; 9.873; 11.853 90; 90; 90 | 1238.7 | Baker, Charles F.; Barker, Marten G.; Blake, Alexander J.; Wilson, Claire; Gregory, Duncan H. New families of mixed alkaline-earth nitridomolybdates and nitridotungstates, (Ba,Sr)3[MN4] (M = Mo, W) Journal of the Chemical Society, Dalton Transactions, 2002, 3961-3966 |
7012467 | CIF | Ba1.44 Ca1.56 N4 W | P b c a | 10.3049; 9.5822; 11.7405 90; 90; 90 | 1159.3 | Baker, Charles F.; Barker, Marten G.; Blake, Alexander J.; Wilson, Claire; Gregory, Duncan H. Synthesis and structure of new mixed alkaline-earth nitridomolybdates and nitridotungstates, (Ba,Ca)3[MN4] (M = Mo, W) Dalton Transactions, 2003, 1065-1069 |
7012466 | CIF | Ba1.52 Ca1.48 Mo N4 | P b c a | 10.271; 9.595; 11.721 90; 90; 90 | 1155.1 | Baker, Charles F.; Barker, Marten G.; Blake, Alexander J.; Wilson, Claire; Gregory, Duncan H. Synthesis and structure of new mixed alkaline-earth nitridomolybdates and nitridotungstates, (Ba,Ca)3[MN4] (M = Mo, W) Dalton Transactions, 2003, 1065-1069 |
7011982 | CIF | Ba1.74 Mo N4 Sr1.26 | P b c a | 10.588; 9.979; 11.935 90; 90; 90 | 1261 | Baker, Charles F.; Barker, Marten G.; Blake, Alexander J.; Wilson, Claire; Gregory, Duncan H. New families of mixed alkaline-earth nitridomolybdates and nitridotungstates, (Ba,Sr)3[MN4] (M = Mo, W) Journal of the Chemical Society, Dalton Transactions, 2002, 3961-3966 |
2017042 | CIF HKL Paper | Ba2 F2 O9 Si2 Ti2 | P b c a | 8.735; 10.832; 18.769 90; 90; 90 | 1775.9 | Mann, Matthew; Kolis, Joseph Ba~2~Ti~2~Si~2~O~9~F~2~, a new titanium silicate Acta Crystallographica Section C, 2009, 65, i17-i19 |
7100607 | CIF | Ba2 Ge H18 O9 Se4 | P b c a | 13.916; 15.097; 16.116 90; 90; 90 | 3385.9 | Stefanie Dehnen; Rodolphe Clerac; Maike Melullis Ternary Mn/Ge/Se Anions from Reactions of [Ba2(H2O)9][GeSe4]: Synthesis and Characterization of Compounds Containing Discrete or Polymeric [Mn6Ge4Se17]6 Units Chemical Communications, 2005 |
1539697 | CIF | Ba2 In2 S5 | P b c a | 13.167; 12.723; 11.784 90; 90; 90 | 1974.1 | Eisenmann, B.; Hofmann, A. Schichtanionen in den Kristallstrukturen der isotypen Verbindungen Sr2(Ga2S5), Ba2(In2S5) und Ba2(In2Se5) Zeitschrift fuer Anorganische und Allgemeine Chemie, 1990, 580, 151-159 |
1539701 | CIF | Ba2 In2 Se5 | P b c a | 13.657; 13.182; 12.225 90; 90; 90 | 2200.82 | Eisenmann, B.; Hofmann, A. Schichtanionen in den Kristallstrukturen der isotypen Verbindungen Sr2(Ga2S5), Ba2(In2S5) und Ba2(In2Se5) Zeitschrift fuer Anorganische und Allgemeine Chemie, 1990, 580, 151-159 |
8101299 | CIF | Ba2 Mn2 O9 Si2 | P b c a | 8.568; 10.741; 18.287 90; 90; 90 | 1682.9 | Kaiser, Joachim W.; Jeitschko, Wolfgang Crystal structure of dibarium dimanganese disilicium nonaoxide Ba~2~Mn~2~Si~2~O~9~ Zeitschrift für Kristallographie - New Crystal Structures, 2000, 215, 313-314 |
2002792 | CIF | Ba2 Nb2 O10 Te | P b c a | 7.242; 12.433; 9.932 90; 90; 90 | 894.3 | Mueller-Buschbaum, Hk; Wedel, B Zur Kenntnis eines Barium-Oxoniobat-Tellurats: Ba2 Nb2 Te O10 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 1996, 51, 1407-1410 |
7011981 | CIF | Ba2.13 Mo N4 Sr0.87 | P b c a | 10.662; 10.095; 12.002 90; 90; 90 | 1291.8 | Baker, Charles F.; Barker, Marten G.; Blake, Alexander J.; Wilson, Claire; Gregory, Duncan H. New families of mixed alkaline-earth nitridomolybdates and nitridotungstates, (Ba,Sr)3[MN4] (M = Mo, W) Journal of the Chemical Society, Dalton Transactions, 2002, 3961-3966 |
7012465 | CIF | Ba2.23 Ca0.77 Mo N4 | P b c a | 10.441; 9.967; 11.938 90; 90; 90 | 1242.3 | Baker, Charles F.; Barker, Marten G.; Blake, Alexander J.; Wilson, Claire; Gregory, Duncan H. Synthesis and structure of new mixed alkaline-earth nitridomolybdates and nitridotungstates, (Ba,Ca)3[MN4] (M = Mo, W) Dalton Transactions, 2003, 1065-1069 |
7011984 | CIF | Ba2.26 N4 Sr0.74 W | P b c a | 10.702; 10.132; 12.036 90; 90; 90 | 1305.1 | Baker, Charles F.; Barker, Marten G.; Blake, Alexander J.; Wilson, Claire; Gregory, Duncan H. New families of mixed alkaline-earth nitridomolybdates and nitridotungstates, (Ba,Sr)3[MN4] (M = Mo, W) Journal of the Chemical Society, Dalton Transactions, 2002, 3961-3966 |
2239564 | CIF HKL Paper | Ba4 Ga N3 O | P b c a | 7.813; 25.6453; 7.9162 90; 90; 90 | 1586.14 | Hashimoto, Takayuki; Yamane, Hisanori Ba~4~GaN~3~O Acta Crystallographica Section E, 2014, 70, i28 |
2002619 | CIF | Bi Ca O5 V | P b c a | 11.2022; 5.4283; 15.5605 90; 90; 90 | 946.2 | Boje, J; Mueller-Buschbaum, Hk Synthese und Kristallstruktur von Ca Bi V O5 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1993, 619, 521-524 |
7047370 | CIF | Bi Cl Co H2 O7 Se2 | P b c a | 14.0563; 7.5815; 14.9961 90; 90; 90 | 1598.1 | Geng, Lei; Wang, Hao; Li, Qiang; Lu, Hong-Yan; Li, Guo-Bao Synthesis and characterization of a series of transition metal oxychlorides: MBi(SeO<sub>3</sub>)<sub>2</sub>(H<sub>2</sub>O)Cl (M = Co, Ni, Cu). Dalton transactions (Cambridge, England : 2003), 2018, 47, 13466-13471 |
7047372 | CIF | Bi Cl Cu H2 O7 Se2 | P b c a | 14.5757; 7.3706; 14.6563 90; 90; 90 | 1574.55 | Geng, Lei; Wang, Hao; Li, Qiang; Lu, Hong-Yan; Li, Guo-Bao Synthesis and characterization of a series of transition metal oxychlorides: MBi(SeO<sub>3</sub>)<sub>2</sub>(H<sub>2</sub>O)Cl (M = Co, Ni, Cu). Dalton transactions (Cambridge, England : 2003), 2018, 47, 13466-13471 |
7047371 | CIF | Bi Cl H2 Ni O7 Se2 | P b c a | 14.0827; 7.5752; 14.8604 90; 90; 90 | 1585.3 | Geng, Lei; Wang, Hao; Li, Qiang; Lu, Hong-Yan; Li, Guo-Bao Synthesis and characterization of a series of transition metal oxychlorides: MBi(SeO<sub>3</sub>)<sub>2</sub>(H<sub>2</sub>O)Cl (M = Co, Ni, Cu). Dalton transactions (Cambridge, England : 2003), 2018, 47, 13466-13471 |
1541947 | CIF | Bi Cr H O5 | P b c a | 11.311; 9.728; 7.314 90; 90; 90 | 804.784 | Aurivillius, B.; Loewenhielm, A. The crystal structure of the orthorhombic modification of Bi O H Cr O4. A refinement of the structure of monoclinic Bi O H Cr O4 Acta Chemica Scandinavica (1-27,1973-42,1988), 1964, 18, 1937-1957 |
1531277 | CIF | Bi Er Ge O5 | P b c a | 5.314; 15.176; 10.999 90; 90; 90 | 887.017 | Cascales, C.; Zaldo, C. Crystal-field analysis of Eu(3+) energy levels in the new rare-earth R Bi Y1-x Rx Ge O5 oxide Journal of Solid State Chemistry, 2003, 171, 262-267 |
7218127 | CIF | Bi Ge N O7 | P b c a | 11.4551; 4.95346; 18.1676 90; 90; 90 | 1030.87 | Kobayashi, Kiyoshi; Ikeda, Takuji; Hiyoshi, Norihito; Sakka, Yoshio Discovery of a new crystalline phase: BiGeO2(OH)2(NO3) CrystEngComm, 2014, 16, 10080 |
7204507 | CIF | Bi Ge O5 Y | P b c a | 5.3419; 15.232; 11.084 90; 90; 90 | 901.9 | Concepción Cascales; Juan Antonio Campa; Enrique Gutiérrez Puebla; M. Angeles Monge; Caridad Ruíz Valero; Isidoro Rasines New rare-earth (Y, Yb) bismuth(III) germanates. An initial study of a promising series J. Mater. Chem., 2002, 12, 3626-3630 |
7204508 | CIF | Bi Ge O5 Yb | P b c a | 5.315; 15.225; 11.025 90; 90; 90 | 892.2 | Concepción Cascales; Juan Antonio Campa; Enrique Gutiérrez Puebla; M. Angeles Monge; Caridad Ruíz Valero; Isidoro Rasines New rare-earth (Y, Yb) bismuth(III) germanates. An initial study of a promising series J. Mater. Chem., 2002, 12, 3626-3630 |
1519098 | CIF | Bi Nb O8 Te2 | P b c a | 5.6109; 8.1277; 31.205 90; 90; 90 | 1423.1 | S. Blanchandin; J.C. Champarnaud-Mesjard; P. Thomas; B. Frit Crystal structure of BiNbTe2O8 Solid State Sciences, 2000, 2, 223-228 |
1537221 | CIF | Bi O6 P0.16 Pb2 V0.84 | P b c a | 5.922; 18.396; 11.864 90; 90; 90 | 1292.48 | Labidi, O.; Conflant, P.; Roussel, P.; Drache, M.; Huve, M.; Wignacourt, J.P. Stabilization of a new delta' polymorph in P-substituted Pb2 Bi V O6: Single crystal structure of Pb2 Bi (V0.84 P0.16) O6 and conduction properties of related materials Journal of Solid State Chemistry, 2005, 178, 2247-2255 |
1533713 | CIF | Bi0.693 Ca3.093 Mn3 O10 | P b c a | 5.3398; 5.3419; 26.8336 90; 90; 90 | 765.42 | Sousa, P.M.; Carvalho, M.D.; Melo Jorge, M.E.; Cruz, M.M.; Costa, F.M.; Godinho, M. Bismuth for calcium substitution in Ca4 Mn3 O10: preparation and study Solid State Sciences, 2003, 5, 943-949 |
7223823 | CIF | Bi1.12 Ge O5 Y0.88 | P b c a | 5.341; 15.232; 11.084 90; 90; 90 | 901.729 | Cascales, C.; Campa, J.A.; Gutierrez Puebla, E.; Monge, M.A.; Ruiz-Valero, C.; Rasines, I. New rare-earth (Y, Yb) bismuth(III) germanates. An initial study of a promising series Journal of Materials Chemistry, 2002, 12, 3626-3630 |
4339985 | CIF | Bi2 Co O7 S | P b c a | 5.4153; 14.2437; 15.7595 90; 90; 90 | 1215.59 | Lü, Minfeng; Colmont, Marie; Kabbour, Houria; Colis, Silviu; Mentré, Olivier Revised bi/m layered oxo-sulfate (m = co, cu): a structural and magnetic study. Inorganic chemistry, 2014, 53, 6969-6978 |
1528796 | CIF | Bi2 Mo O6 | P b c a | 5.506; 16.226; 5.487 90; 90; 90 | 490.211 | Pertlik, F.; Zemann, J. Neubestimmung der Kristallstruktur des Koechlinits Fortschritte der Mineralogie, Beiheft, 1982, 60, 162-163 |
7202527 | CIF | Bi2 Nb O6 | P b c a | 5.428; 5.4261; 16.6564 90; 90; 90 | 490.6 | McCabe, E. E.; Jones, I. P.; Zhang, D.; Hyatt, N. C.; Greaves, C. Crystal structure and electrical characterisation of Bi2NbO5F: an Aurivillius oxide fluoride Journal of Materials Chemistry, 2007, 17, 1193 |
4328874 | CIF | Bi4 Mg O12 P2 | P b c a | 16.6718; 5.2995; 23.2735 90; 90; 90 | 2056.27 | Diana Endara; Marie Colmont; Marielle Huvé; Grégory Tricot; Laurent Carpentier; Olivier Mentré Novel Tailormade Bi4MO4(PO4)2 Structural Type (M = Mg, Zn) Inorganic Chemistry, 2012, 51, 4438-4447 |
1535462 | CIF | Br0.2 I1.8 Sr | P b c a | 15.189; 8.174; 7.84 90; 90; 90 | 973.374 | Hodorowicz, S.A.; Eick, H.A. An X-ray diffraction study of the Sr Brx I2-x system Journal of Solid State Chemistry, 1983, 46, 313-320 |
1535458 | CIF | Br0.3 I1.7 Sr | P b c a | 15.15; 8.14; 7.805 90; 90; 90 | 962.52 | Hodorowicz, S.A.; Eick, H.A. An X-ray diffraction study of the Sr Brx I2-x system Journal of Solid State Chemistry, 1983, 46, 313-320 |
4310280 | CIF | Br12 Cs4 Mo6 S2 | P b c a | 11.511; 18.772; 28.381 90; 90; 90 | 6133 | Stéphane Cordier; Nikolaï G. Naumov; Diala Salloum; Frédéric Paul; Christiane Perrin Synthesis and Characterization of Mo6 Chalcobromides and Cyano-Substituted Compounds Built from a Novel [(Mo6Bri6Yi2)La6]n- Discrete Cluster Unit (Yi= S or Se and La= Br or CN) Inorganic Chemistry, 2004, 43, 219-226 |
4310281 | CIF | Br12 Cs4 Mo6 Se2 | P b c a | 11.624; 18.944; 28.487 90; 90; 90 | 6273 | Stéphane Cordier; Nikolaï G. Naumov; Diala Salloum; Frédéric Paul; Christiane Perrin Synthesis and Characterization of Mo6 Chalcobromides and Cyano-Substituted Compounds Built from a Novel [(Mo6Bri6Yi2)La6]n- Discrete Cluster Unit (Yi= S or Se and La= Br or CN) Inorganic Chemistry, 2004, 43, 219-226 |
4344251 | CIF | Br2 F11 I Sb2 | P b c a | 14.445; 14.034; 12.725 90; 90; 90 | 2579.63 | Birchall, T.; Myers, R.D. Preparation of (I Br2) (Sb2 F11) and (I Br.75 Cl1.25) (Sb Cl6). Their Characterization by X-ray Crystallography and Raman Spectroscopy Inorganic Chemistry, 1983, 22, 1751-1756 |
2102057 | CIF Paper | Br2 H6 N2 Pd | P b c a | 13.3202; 12.7223; 7.05854 90; 90; 90 | 1196.17 | Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S. Structures of [Pd(NH~3~)~2~<i>X</i>~2~] and its chemical transformation in the solid state Acta Crystallographica, Section B: Structural Science, 2000, 56, 419-425 |
2102059 | CIF Paper | Br2 H6 N2 Pd | P b c a | 8.4315; 8.4206; 8.0916 90; 90; 90 | 574.49 | Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S. Structures of [Pd(NH~3~)~2~<i>X</i>~2~] and its chemical transformation in the solid state Acta Crystallographica, Section B: Structural Science, 2000, 56, 419-425 |
4103826 | CIF | Br4 Tc | P b c a | 6.3237; 12.1777; 14.7397 90; 90; 90 | 1135.08 | Frederic Poineau; Efrain E. Rodriguez; Paul M. Forster; Alfred P. Sattelberger; Anthony K. Cheetham; Kenneth R. Czerwinski Preparation of the Binary Technetium Bromides: TcBr3 and TcBr4 Journal of the American Chemical Society, 2009, 131, 910-911 |
8100034 | CIF | Br5 Pd Tl3 | P b c a | 7.8226; 16.812; 17.299 90; 90; 90 | 2275.1 | Heines, Peter; Duchâteau, Manfred; Keller, Hans-Lothar Crystal structure of trithallium-pentabromopalladate(II), Tl~3~PdBr~5~ Zeitschrift für Kristallographie - New Crystal Structures, 2004, 219, 7-8 |
8103932 | CIF | Br6 Ce3 N | P b c a | 11.112; 11.724; 17.02 90; 90; 90 | 2217.32 | Mattausch, H.J.; Simon, A. Crystal structure of tricerium hexabromide nitride, Ce3 Br6 N Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 397-397 |
1527115 | CIF | Br6 Cr4 H46 N12 O8 | P b c a | 22.581; 13.931; 10.001 90; 90; 90 | 3146.07 | Bang, E.; Narasimha, T. The crystal structure of di-mue-hydroxotetrakis-mue-hydroxobis(tetraminechromium III))bis(diamminechromium(III))bromide dihydrate Acta Chemica Scandinavica (1-27,1973-42,1988), 1970, 24, 275-284 |
4344606 | CIF | Br6 H8 N2 O32 Pb8 | P b c a | 10.074; 19.262; 32.57 90; 90; 90 | 6320 | Kong, Fang; Hu, Chun-Li; Liang, Ming-Li; Mao, Jiang-Gao Pb4(OH)4(BrO3)3(NO3): An Example of SHG Crystal in Metal Bromates Containing π-Conjugated Planar Triangle. Inorganic chemistry, 2016, 55, 948-955 |
4344220 | CIF | Br8 Cs2 Re2 | P b c a | 12.625; 12.953; 10.141 90; 90; 90 | 1658.37 | Cotton, F.A.; de Boer, B.G.; Jeremic, M. Some Reactions of the Octahalodirhenate(III) Ions. VIII. Definitive Structural Characterization of the Octabromodirhenate(III) Ion Inorganic Chemistry, 1970, 9, 2143-2146 |
9004098 | CIF | C Ca O5 Te | P b c a | 6.988; 11.201; 10.566 90; 90; 90 | 827.028 | Fischer, R.; Pertlik, F.; Zemann, J. The crystal structure of mroseite, CaTeO2(CO3) The Canadian Mineralogist, 1975, 13, 383-387 |
6000544 | CIF | C Cl3 F | P b c a | 15.5111; 5.8788; 9.5261 90; 90; 90 | 868.65 | Cockcroft, J. K.; Fitch, A. N. Structure of solid trichlorofluoromethane, CFCl3, by powder neutron-diffraction Zeitschrift für Kristallographie, 1994, 209, 488-490 |
1534995 | CIF | C Cl8 W2 | P b c a | 11.956; 12.156; 15.837 90; 90; 90 | 2301.7 | Beck, J.; Wolf, F. W2 Cl7 (C Cl), a polymeric tungsten chlorocarbyne complex Zeitschrift fuer Anorganische und Allgemeine Chemie, 2002, 628, 1453-1454 |
1527607 | CIF | C Cu N S | P b c a | 10.994; 7.224; 6.662 90; 90; 90 | 529.1 | Kabesova, M.; Dunaj-Jurco, M.; Serator, M.; Gazo, J. Crystal structure of copper(I) thiocyanate and its relation to the crystal structure of copper(II) diammine dithiocyanate complex Inorganica Chimica Acta, 1976, 17, 161-165 |
6000568 | CIF | C D2 N2 | P b c a | 6.559; 9.169; 6.775 90; 90; 90 | 407.44 | Torrie, B. H.; Vondreele, R.; Larson, A. C. Structure of solid cyanamide at 13-K Molecular Physics, 1992, 76, 405-410 |
2300260 | CIF | C D7 N O | P b c a | 11.0232; 7.66076; 7.59127 90; 90; 90 | 641.053 | Fortes, A. D.; Wood, I. G.; Knight, K. S. The crystal structure of perdeuterated methanol monoammoniate (CD~3~OD·ND~3~) determined from neutron powder diffraction data at 4.2 and 180K Journal of Applied Crystallography, 2009, 42, 1054-1061 |
2300261 | CIF | C D7 N O | P b c a | 11.21169; 7.74663; 7.68077 90; 90; 90 | 667.096 | Fortes, A. D.; Wood, I. G.; Knight, K. S. The crystal structure of perdeuterated methanol monoammoniate (CD~3~OD·ND~3~) determined from neutron powder diffraction data at 4.2 and 180K Journal of Applied Crystallography, 2009, 42, 1054-1061 |
2300266 | CIF | C D7 N O | P b c a | 11.0386; 7.65471; 7.58467 90; 90; 90 | 640.88 | Fortes, A. D.; Wood, I. G.; Knight, K. S. The crystal structure of perdeuterated methanol hemiammoniate (CD~3~OD·0.5ND~3~) determined from neutron powder diffraction data at 4.2 and 180K Journal of Applied Crystallography, 2010, 43, 328-336 |
2300268 | CIF | C D7 N O | P b c a | 11.20962; 7.74564; 7.6781 90; 90; 90 | 666.66 | Fortes, A. D.; Wood, I. G.; Knight, K. S. The crystal structure of perdeuterated methanol hemiammoniate (CD~3~OD·0.5ND~3~) determined from neutron powder diffraction data at 4.2 and 180K Journal of Applied Crystallography, 2010, 43, 328-336 |
1000362 | CIF | C Eu F3 Na2 O3 | P b c a | 6.596; 10.774; 14.09 90; 90; 90 | 1001.3 | Mercier, N; Leblanc, M A new rare earth fluorocarbonate, Na~2~Eu(CO~3~)F~3~ Acta Crystallographica C (39,1983-), 1994, 50, 1864-1865 |
2010336 | CIF | C Eu F3 Na2 O3 | P b c a | 6.596; 10.774; 14.09 90; 90; 90 | 1001.3 | Mercier, Nicolas; Leblanc, Marc A new rare earth fluorocarbonate, Na~2~Eu(CO~3~)F~3~ Acta Crystallographica, Section C: Crystal Structure Communications, 1994, 50, 1864-1865 |
7157736 | CIF | C H N O | P b c a | 12.9152; 15.907; 18.038 90; 90; 90 | 3705.8 | Liu, Siyuan; Wang, Hang; Wang, Baomin Catalyst-free construction of spiro [benzoquinolizidine-chromanones] <i>via</i> a tandem condensation/1,5-hydride transfer/cyclization process. Organic & biomolecular chemistry, 2020, 18, 8839-8843 |
7153614 | CIF | C H N O S | P b c a | 13.4815; 8.2127; 28.9529 90; 90; 90 | 3205.65 | Sivaraman, Mahalingam; Perumal, Paramasivan T. Synthesis of tetracyclic chromenones via platinum(ii) chloride catalysed cascade cyclization of enediyne-enones. Organic & biomolecular chemistry, 2014, 12, 1318-1327 |
4324803 | CIF | C H N5 | P b c a | 8.177; 6.835; 11.13 90; 90; 90 | 622.1 | Thomas M. Klapötke; Davin G. Piercey 1,1'-Azobis(tetrazole): A Highly Energetic Nitrogen-Rich Compound with a N10 Chain Inorganic Chemistry, 2011, 50, 2732-2734 |
7055455 | CIF | C H O | P b c a | 7.615; 23.48; 36.26 90; 90; 90 | 6483 | Wang, Xiu-Zhen; Yang, Hui-Hui; Li, Wei; Han, Bing-Jie; Liu, Yun-Jun Studies on apoptosis in HeLa cells via the ROS-mediated mitochondrial pathway induced by new dibenzoxanthenes New J. Chem., 2016, 40, 5255 |
4000257 | CIF | C H10 N2 O6 P2 Sn | P b c a | 10.3417; 10.0475; 16.9927 90; 90; 90 | 1765.7 | Chemistry of Materials, 2003 |
1541736 | CIF | C H12 Cl4 Cu N6 O | P b c a | 10.07; 11.603; 18.39 90; 90; 90 | 2148.73 | Savel'eva, Z.A.; Romanenko, G.V.; Larionov, S.V.; Sheludyakova, L.A. Synthesis and structure of a complex with the coordinated triaminoguanidinium(2+) ion, (Cu (TAG H2) Cl3) Cl . (H2 O) Polyhedron, 2000, 19, 1737-1740 |
7231615 | CIF | C H17 As Mn N7 S4 | P b c a | 7.5398; 12.847; 26.646 90; 90; 90 | 2581 | Han, Jingyu; Li, Shufen; Tang, Chunying; Zheng, Wei; Jiang, Wenqing; Jia, Dingxian Hydrazine-solvothermal methods to synthesize polymeric thioarsenates from one-dimensional chains to a three-dimensional framework RSC Advances, 2018, 8, 34078 |
4337656 | CIF | C H2 Ag O8 P2 U | P b c a | 12.0098; 10.3144; 12.226 90; 90; 90 | 1514.48 | Nelson, Anna-Gay D; Rak, Zsolt; Albrecht-Schmitt, Thomas E; Becker, Udo; Ewing, Rodney C. Three new silver uranyl diphosphonates: structures and properties. Inorganic chemistry, 2014, 53, 2787-2796 |
4305057 | CIF | C H2 O7 P2 U | P b c a | 8.6227; 11.3457; 13.8635 90; 90; 90 | 1356.27 | Anna-Gay D. Nelson; Travis H. Bray; Wei Zhan; Richard G. Haire; Todd S. Sayler; Thomas E. Albrecht-Schmitt Further Examples of the Failure of Surrogates to Properly Model the Structural and Hydrothermal Chemistry of Transuranium Elements: Insights Provided by Uranium and Neptunium Diphosphonates Inorganic Chemistry, 2008, 47, 4945-4951 |
4321475 | CIF | C H3 F2 I O2 | P b c a | 7.605; 7.36; 15.017 90; 90; 90 | 840.54 | Rolf Minkwitz; Michael Berkei; Marc Studentkowski; Ralf Ludwig Crystal Structure of (Difluoro)methoxyoxo Iodine(V) IF2(O)OCH3 Inorganic Chemistry, 2000, 39, 4766-4768 |
7221185 | CIF | C H3 N5 O | P b c a | 9.8873; 5.5314; 13.6734 90; 90; 90 | 747.81 | Yin, Xin; Wu, Jin-Ting; Jin, Xin; Xu, Cai-Xia; He, Piao; Li, Tong; Wang, Kun; Qin, Jian; Zhang, Jian-Guo Nitrogen-rich salts of 1-aminotetrazol-5-one: oxygen-containing insensitive energetic materials with high thermal stability RSC Adv., 2015, 5, 60005 |
2103968 | CIF Paper | C H3 Na2 O6 | P b c a | 6.6971; 15.741; 9.1635 90; 90; 90 | 966.01 | Pritchard, Robin Gavin; Islam, Emran Sodium percarbonate between 293 and 100K Acta Crystallographica Section B, 2003, 59, 596-605 |
2103969 | CIF Paper | C H3 Na2 O6 | P b c a | 6.6871; 15.7473; 9.154 90; 90; 90 | 963.95 | Pritchard, Robin Gavin; Islam, Emran Sodium percarbonate between 293 and 100K Acta Crystallographica Section B, 2003, 59, 596-605 |
2103970 | CIF Paper | C H3 Na2 O6 | P b c a | 6.6592; 15.7511; 9.1254 90; 90; 90 | 957.16 | Pritchard, Robin Gavin; Islam, Emran Sodium percarbonate between 293 and 100K Acta Crystallographica Section B, 2003, 59, 596-605 |
2103971 | CIF HKL Paper | C H3 Na2 O6 | P b c a | 6.6521; 15.7579; 9.1062 90; 90; 90 | 954.54 | Pritchard, Robin Gavin; Islam, Emran Sodium percarbonate between 293 and 100K Acta Crystallographica Section B, 2003, 59, 596-605 |
7025522 | CIF | C H4 Ag Cl N2 S | P b c a | 8.464; 7.0191; 16.7986 90; 90; 90 | 998 | Bowmaker, Graham A.; Pakawatchai, Chaveng; Saithong, Saowanit; Skelton, Brian W.; White, Allan H. Structural and spectroscopic studies of some adducts of silver(I) halides with thiourea and N-ethyl substituted thioureas. Dalton transactions (Cambridge, England : 2003), 2010, 39, 4391-4404 |
9004189 | CIF | C H4 B O7 Sm0.1 Y0.9 | P b c a | 9.089; 12.244; 8.926 90; 90; 90 | 993.336 | Grice, J. D.; Ercit, T. S. The crystal structure of moydite The Canadian Mineralogist, 1986, 24, 675-678 |
4113796 | CIF | C H4 Cd N Se | P b c a | 7.09494; 6.79535; 16.7212 90; 90; 90 | 806.17 | Xiaoying Huang; Jing Li; Yong Zhang; Angelo Mascarenhas From 1D Chain to 3D Network: Tuning Hybrid II-VI Nanostructures and Their Optical Properties Journal of the American Chemical Society, 2003, 125, 7049-7055 |
2310363 | CIF | C H4 Cd N2 O6 S2 | P b c a | 13.461; 7.783; 15.967 90; 90; 90 | 1672.81 | Cavalca, L.; Domiano, P.; Gasparri, G.F.; Boldrini, P. The Crystal Structure of Monothiourea-cadmium Sulphate Dihydrate Acta Crystallographica (1,1948-23,1967), 1967, 22, 878-885 |
4000083 | CIF | C H4 Mn N Se | P b c a | 6.711; 6.614; 17.72 90; 90; 90 | 786.5 | Huang, Xiaoying; Heulings, IV, Harry R.; Le, Vina; Li, Jing Inorganic-Organic Hybrid Composites Containing MQ (II-VI) Slabs: A New Class of Nanostructures with Strong Quantum Confinement and Periodic Arrangement Chemistry of Materials, 2001, 13, 3754-3759 |
7104034 | CIF | C H4 N S Zn | P b c a | 17.26305; 6.39336; 6.20451 90; 90; 90 | 684.785 | Ouyang, Xiang; Tsai, Tsung-Yen; Chen, Dong-Hwang; Huang, Qi-Jie; Cheng, Wu-Hsun; Clearfield, Abraham Ab initio structure study from in-house powder diffraction of a novel ZnS(EN)0.5 structure with layered wurtzite ZnS fragment Chemical Communications (Cambridge, United Kingdom), 2003, 886-887 |
1567200 | CIF | C H4 N2 O S Sn | P b c a | 5.817; 16.812; 11.892 90; 90; 90 | 1163 | Kokunov, Yu. V. Tin(II) Fluoride Compounds with Mixed Acidoligands: Synthesis and Crystal Structure of NH4[SnF2(NCS)] Russian Journal of Coordination Chemistry, 2000, 26, 857-860 |
4103602 | CIF | C H4 N6 O3 | P b c a | 9.3989; 7.9263; 15.2618 90; 90; 90 | 1136.98 | Michael Göbel; Konstantin Karaghiosoff; Thomas M. Klapötke; Davin G. Piercey; Jörg Stierstorfer Nitrotetrazolate-2N-oxides and the Strategy of N-Oxide Introduction Journal of the American Chemical Society, 2010, 132, 17216-17226 |
4315265 | CIF | C H4 O7 P2 Pu | P b c a | 8.599; 11.2761; 13.7865 90; 90; 90 | 1336.8 | Juan Diwu; Anna-Gay D. Nelson; Shuao Wang; Charles F. Campana; Thomas E. Albrecht-Schmitt Comparisons of Pu(IV) and Ce(IV) Diphosphonates Inorganic Chemistry, 2010, 49, 3337-3342 |
7239520 | CIF | C H5 Cl N6 O4 | P b c a | 7.762; 9.4; 17.653 90; 90; 90 | 1288 | Lin, Qiu-Han; Li, Yu-Chuan; Qi, Cai; Liu, Wei; Wang, Yuan; Pang, Si-Ping Nitrogen-rich salts based on 5-hydrazino-1H-tetrazole: a new family of high-density energetic materials Journal of Materials Chemistry A, 2013, 1, 6776 |
4113795 | CIF | C H5 N Te Zn | P b c a | 7.179; 6.946; 18.913 90; 90; 90 | 943.1 | Xiaoying Huang; Jing Li; Yong Zhang; Angelo Mascarenhas From 1D Chain to 3D Network: Tuning Hybrid II-VI Nanostructures and Their Optical Properties Journal of the American Chemical Society, 2003, 125, 7049-7055 |
4507696 | CIF | C H5 N3 | P b c a | 8.5022; 9.0863; 15.6786 90; 90; 90 | 1211.23 | Sawinski, Peter Klaus; Meven, Martin; Englert, Ulli; Dronskowski, Richard Single-Crystal Neutron Diffraction Study on Guanidine, CN3H5 Crystal Growth & Design, 2013, 13, 1730 |
4507697 | CIF | C H5 N3 | P b c a | 8.5568; 9.1952; 15.7495 90; 90; 90 | 1239.19 | Sawinski, Peter Klaus; Meven, Martin; Englert, Ulli; Dronskowski, Richard Single-Crystal Neutron Diffraction Study on Guanidine, CN3H5 Crystal Growth & Design, 2013, 13, 1730 |
4003481 | CIF | C H6 B11 Cl6 Na | P b c a | 12.2381; 12.0569; 22.007 90; 90; 90 | 3247.2 | Jørgensen, Mathias; Shea, Patrick T.; Tomich, Anton W.; Varley, Joel B.; Bercx, Marnik; Lovera, Sergio; Černý, Radovan; Zhou, Wei; Udovic, Terrence J.; Lavallo, Vincent; Jensen, Torben R.; Wood, Brandon C.; Stavila, Vitalie Understanding Superionic Conductivity in Lithium and Sodium Salts of Weakly Coordinating Closo-Hexahalocarbaborate Anions Chemistry of Materials, 2020 |
7204654 | CIF | C H6 N O12 P3 Zn4 | P b c a | 14.6797; 10.1204; 16.6015 90; 90; 90 | 2466.39 | Song, Yanning; Zavalij, Peter Y.; Whittingham, M. Stanley Two novel open-framework zinc phosphates: (CH3NH3)Zn4(PO4)3 and (CH3NH3)2Zn5(PO4)4Electronic supplementary information (ESI) available: tables for atomic coordinates and anisotropic parameters and full list of bond lengths and bond angles. See http://www.rsc.org/suppdata/jm/b3/b303910b/ Journal of Materials Chemistry, 2003, 13, 1936 |
2017782 | CIF Paper | C H6 N O3 P | P b c a | 8.977; 9.186; 10.003 90; 90; 90 | 824.9 | Janicki, Rafał; Starynowicz, Przemysław Charge density distribution in aminomethylphosphonic acid Acta Crystallographica Section B, 2010, 66, 559-567 |
2022057 | CIF | C H6 N O3 P | P b c a | 8.977; 9.186; 10.003 90; 90; 90 | 824.9 | Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76 |
4135601 | CIF | C H6 N4 O4 | P b c a | 9.5532; 6.3625; 16.3333 90; 90; 90 | 992.77 | Benz, Maximilian; Klapötke, Thomas M; Krumm, Burkhard; Lommel, Marcus; Stierstorfer, Jörg Nitrocarbamoyl Azide O<sub>2</sub>NN(H)C(O)N<sub>3</sub>: A Stable but Highly Energetic Member of the Carbonyl Azide Family. Journal of the American Chemical Society, 2021, 143, 1323-1327 |
2009787 | CIF Paper | C H7 Ga3 N O13 P3 | P b c a | 10.257; 16.941; 14.13 90; 90; 90 | 2455.3 | Glasser, F.P.; Howie, R.A.; Kan, Q. Methylammonium tris(galliophosphate)hydroxide Acta Crystallographica Section C, 1994, 50, 848-850 |
2103621 | CIF Paper | C H7 N2 O5 P | P b c a | 17.42; 7.421; 8.939 90; 90; 90 | 1155.58 | Wilson, Chick C. Migration of the proton in the strong O—H···O hydrogen bond in urea‒phosphoric acid (1/1) Acta Crystallographica Section B, 2001, 57, 435-439 |
2103622 | CIF Paper | C H7 N2 O5 P | P b c a | 17.549; 7.446; 8.959 90; 90; 90 | 1170.67 | Wilson, Chick C. Migration of the proton in the strong O—H···O hydrogen bond in urea‒phosphoric acid (1/1) Acta Crystallographica Section B, 2001, 57, 435-439 |
2103623 | CIF Paper | C H7 N2 O5 P | P b c a | 17.576; 7.456; 8.963 90; 90; 90 | 1174.57 | Wilson, Chick C. Migration of the proton in the strong O—H···O hydrogen bond in urea‒phosphoric acid (1/1) Acta Crystallographica Section B, 2001, 57, 435-439 |
2103624 | CIF Paper | C H7 N2 O5 P | P b c a | 17.589; 7.458; 8.967 90; 90; 90 | 1176.28 | Wilson, Chick C. Migration of the proton in the strong O—H···O hydrogen bond in urea‒phosphoric acid (1/1) Acta Crystallographica Section B, 2001, 57, 435-439 |
2103625 | CIF Paper | C H7 N2 O5 P | P b c a | 17.595; 7.46; 8.968 90; 90; 90 | 1177.13 | Wilson, Chick C. Migration of the proton in the strong O—H···O hydrogen bond in urea‒phosphoric acid (1/1) Acta Crystallographica Section B, 2001, 57, 435-439 |
2103626 | CIF Paper | C H7 N2 O5 P | P b c a | 17.601; 7.461; 8.968 90; 90; 90 | 1177.69 | Wilson, Chick C. Migration of the proton in the strong O—H···O hydrogen bond in urea‒phosphoric acid (1/1) Acta Crystallographica Section B, 2001, 57, 435-439 |
2103627 | CIF Paper | C H7 N2 O5 P | P b c a | 17.608; 7.462; 8.97 90; 90; 90 | 1178.58 | Wilson, Chick C. Migration of the proton in the strong O—H···O hydrogen bond in urea‒phosphoric acid (1/1) Acta Crystallographica Section B, 2001, 57, 435-439 |
2103628 | CIF Paper | C H7 N2 O5 P | P b c a | 17.614; 7.463; 8.971 90; 90; 90 | 1179.27 | Wilson, Chick C. Migration of the proton in the strong O—H···O hydrogen bond in urea‒phosphoric acid (1/1) Acta Crystallographica Section B, 2001, 57, 435-439 |
2103629 | CIF Paper | C H7 N2 O5 P | P b c a | 17.621; 7.463; 8.972 90; 90; 90 | 1179.87 | Wilson, Chick C. Migration of the proton in the strong O—H···O hydrogen bond in urea‒phosphoric acid (1/1) Acta Crystallographica Section B, 2001, 57, 435-439 |
2103630 | CIF Paper | C H7 N2 O5 P | P b c a | 17.629; 7.465; 8.974 90; 90; 90 | 1180.98 | Wilson, Chick C. Migration of the proton in the strong O—H···O hydrogen bond in urea‒phosphoric acid (1/1) Acta Crystallographica Section B, 2001, 57, 435-439 |
2103631 | CIF Paper | C H7 N2 O5 P | P b c a | 17.639; 7.466; 8.975 90; 90; 90 | 1181.94 | Wilson, Chick C. Migration of the proton in the strong O—H···O hydrogen bond in urea‒phosphoric acid (1/1) Acta Crystallographica Section B, 2001, 57, 435-439 |
2103632 | CIF Paper | C H7 N2 O5 P | P b c a | 17.648; 7.467; 8.976 90; 90; 90 | 1182.84 | Wilson, Chick C. Migration of the proton in the strong O—H···O hydrogen bond in urea‒phosphoric acid (1/1) Acta Crystallographica Section B, 2001, 57, 435-439 |
2103643 | CIF Paper | C H7 N2 O5 P | P b c a | 17.43; 7.43; 8.97 90; 90; 90 | 1161 | Rodrigues, Bernardo Lages; Tellgren, Roland; Fernandes, Nelson G. Experimental electron density of urea‒phosphoric acid (1/1) at 100K Acta Crystallographica Section B, 2001, 57, 353-358 |
2103644 | CIF Paper | C H7 N2 O5 P | P b c a | 17.4527; 7.4465; 8.9589 90; 90; 90 | 1164.31 | Rodrigues, Bernardo Lages; Tellgren, Roland; Fernandes, Nelson G. Experimental electron density of urea‒phosphoric acid (1/1) at 100K Acta Crystallographica Section B, 2001, 57, 353-358 |
2108009 | CIF | C H7 N2 O5 P | P b c a | 17.6492; 7.482; 9.0018 90; 90; 90 | 1188.7 | Kostansek, Edward C.; Busing, William R. A single-crystal neutron-diffraction study of urea-phosphoric acid Acta Crystallographyca B, 1972, 2454-2459 |
7050269 | CIF | C H7 N2 O5 P | P b c a | 7.4613; 8.9753; 17.5018 90; 90; 90 | 1172.05 | Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson Imaging proton migration from X-rays and neutrons New J. Chem., 2004, 28, 718-721 |
7050270 | CIF | C H7 N2 O5 P | P b c a | 7.4667; 8.9827; 17.5438 90; 90; 90 | 1176.68 | Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson Imaging proton migration from X-rays and neutrons New J. Chem., 2004, 28, 718-721 |
7052508 | CIF | C H7 N2 O5 P | P b c a | 7.472; 8.9926; 17.5962 90; 90; 90 | 1182.34 | Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson Imaging proton migration from X-rays and neutrons New J. Chem., 2004, 28, 718-721 |
7052509 | CIF | C H7 N2 O5 P | P b c a | 7.4858; 9.0041; 17.6597 90; 90; 90 | 1190.31 | Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson Imaging proton migration from X-rays and neutrons New J. Chem., 2004, 28, 718-721 |
7052510 | CIF | C H7 N2 O5 P | P b c a | 7.4904; 9.0176; 17.7254 90; 90; 90 | 1197.27 | Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson Imaging proton migration from X-rays and neutrons New J. Chem., 2004, 28, 718-721 |
1567754 | CIF | C H8 F6 N3 O P | P b c a | 7.67243; 8.07957; 24.2351 90; 90; 90 | 1502.33 | Bellas, Michael K.; Matzger, Adam J. Discovery strategy leads to the first melt-castable cocrystal based on an energetic oxidizing salt Chemical Science, 2022, 13, 12100-12106 |
7202108 | CIF | C H9 N9 O4 | P b c a | 12.5217; 8.1036; 16.9859 90; 90; 90 | 1723.57 | Klapötke, Thomas M.; Stierstorfer, Jörg Triaminoguanidinium dinitramide—calculations, synthesis and characterization of a promising energetic compound Physical Chemistry Chemical Physics, 2008, 10, 4340-4346 |
4004063 | CIF | C1.14 H1.43 N0.86 | P b c a | 10.906; 5.7031; 15.132 90; 90; 90 | 941.2 | Zhang, Zi-Peng; Liu, Xin; Liu, Xiaomeng; Lu, Zhong-Wei; Sui, Xin; Zhen, Bo-Yu; Lin, Zheshuai; Chen, Ling; Wu, Li-Ming Driving Nonlinear Optical Activity with Dipolar 2-Aminopyrimidinium Cations in (C4H6N3)+(H2PO3)− Chemistry of Materials, 2022, 34, 1976-1984 |
4304709 | CIF | C10 B F5 N4 Xe | P b c a | 9.918; 16.269; 16.783 90; 90; 90 | 2708 | Karsten Koppe; Hermann-J. Frohn; Hélène P. A. Mercier; Gary J. Schrobilgen [C6F5Xe]+ and [C6F5XeNCCH3]+ Salts of the Weakly Coordinating Borate Anions, [BY4]- (Y = CN, CF3, or C6F5) Inorganic Chemistry, 2008, 47, 3205-3217 |
2106918 | CIF | C10 Cl2 O10 Os3 | P b c a | 25.58; 22.832; 12.036 90; 90; 90 | 7029.54 | Einstein, F.W.B.; Tyers, K.G.; Jones, T.J. Structure of 1,1,1,1,2,2,2,3,3,3-Decacarbonyl-2,3;2,3-di-mue-chloro-tr angulo-triosmium Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1272-1274 |
7239439 | CIF | C10 H Br N O2 | P b c a | 9.9209; 9.2391; 22.868 90; 90; 90 | 2096.1 | Pathak, Sudipta; Kundu, Ashis; Pramanik, Animesh Monobromomalononitrile: an efficient regioselective mono brominating agent towards active methylene compounds and enamines under mild conditions RSC Adv., 2014, 4, 10180 |
7045345 | CIF | C10 H10 Bi Br7 Cl2 N2 | P b c a | 20.2722; 7.6512; 28.2787 90; 90; 90 | 4386.2 | Adonin, Sergey A.; Gorokh, Igor D.; Novikov, Alexander S.; Samsonenko, Denis G.; Plyusnin, Pavel E.; Sokolov, Maxim N.; Fedin, Vladimir P. Bromine-rich complexes of bismuth: experimental and theoretical studies. Dalton transactions (Cambridge, England : 2003), 2018, 47, 2683-2689 |
1505808 | CIF | C10 H10 Br N O2 | P b c a | 12.3702; 8.451; 19.563 90; 90; 90 | 2045.1 | Suárez-Castillo, Oscar R; Beiza-Granados, Lidia; Meléndez-Rodríguez, Myriam; Alvarez-Hernández, Alejandro; Morales-Ríos, Martha S; Joseph-Nathan, Pedro Synthesis of bromoindole alkaloids from Laurencia brongniartii. Journal of natural products, 2006, 69, 1596-1600 |
7210570 | CIF | C10 H10 Br2 N6 O Zn | P b c a | 10.135; 13.562; 20.655 90; 90; 90 | 2839 | Yang, Pan; Wu, Xiang Xia; Huo, Jian Zhong; Ding, Bin; Wang, Ying; Wang, XiuGuang Hydrothermal synthesis and characterization of a series of luminescent Zn(ii) and Cd(ii) coordination polymers with the new versatile multidentate ligand 1,3-di-(1,2,4-triazol-4-yl)benzene CrystEngComm, 2013, 15, 8097 |
2013472 | CIF HKL Paper | C10 H10 Br2 O2 | P b c a | 11.138; 13.57; 14.57 90; 90; 90 | 2202.1 | Steyl, Gideon; Roodt, Andreas 3,7-Dibromohinokitiol: a redetermination Acta Crystallographica Section C, 2003, 59, o525-o527 |
7216317 | CIF | C10 H10 Cd I2 N2 | P b c a | 8.848; 17.79; 18.666 90; 90; 90 | 2938 | Hu, Chunhua; Li, Qi; Englert, Ulli Structural trends in one and two dimensional coordination polymers of cadmium(ii) with halide bridges and pyridine-type ligands CrystEngComm, 2003, 5, 519 |
7216318 | CIF | C10 H10 Cd I2 N2 | P b c a | 8.7603; 17.436; 18.581 90; 90; 90 | 2838.1 | Hu, Chunhua; Li, Qi; Englert, Ulli Structural trends in one and two dimensional coordination polymers of cadmium(ii) with halide bridges and pyridine-type ligands CrystEngComm, 2003, 5, 519 |
4349715 | CIF | C10 H10 Cd O5 | P b c a | 9.3966; 7.8853; 29.851 90; 90; 90 | 2211.81 | Déniz, Mariadel; Pasán, Jorge; Rasines, Beatriz; Lorenzo-Luis, Pablo; Lahoz, Fernando; Vera-Gonzales, Corina; Julve, Miguel; Ruiz-Pérez, Catalina Cadmium(ii) coordination polymers based on substituted malonic acid: synthesis, characterization and photoluminescence properties Inorganic Chemistry Frontiers, 2017, 4, 1384 |
7128522 | CIF | C10 H10 Cl F O2 | P b c a | 11.0279; 7.6848; 24.244 90; 90; 90 | 2054.6 | Hao, Fei; Shang, Xueyun; Liu, Zhenwei; Zhang, He; Lin, Jin-Hong; Xiao, Ji-Chang Rh-catalyzed tunable defluorinative borylation. Chemical communications (Cambridge, England), 2021, 57, 7124-7127 |
2205092 | CIF HKL Paper | C10 H10 Cl N O2 | P b c a | 9.5485; 8.2197; 25.94 90; 90; 90 | 2035.9 | Tai, Xi-Shi; Liu, Wan-Yi; Liu, Yan-Zhen; Li, Yi-Zhi 2-Acetyl-3'-chloroacetanilide Acta Crystallographica Section E, 2005, 61, o389-o390 |
2225467 | CIF HKL Paper | C10 H10 Cl N O3 | P b c a | 10.0308; 11.181; 19.036 90; 90; 90 | 2135 | Gowda, B. Thimme; Foro, Sabine; Saraswathi, B. S.; Fuess, Hartmut <i>N</i>-(3-Chlorophenyl)succinamic acid Acta Crystallographica Section E, 2010, 66, o842 |
4332639 | CIF | C10 H10 Cl2 N4 Pt | P b c a | 7.3055; 17.923; 17.977 90; 90; 90 | 2353.8 | Maheshwari, Vidhi; Bhattacharyya, Debadeep; Fronczek, Frank R.; Marzilli, Patricia A.; Marzilli, Luigi G. Chemistry of HIV-1 Virucidal Pt Complexes Having Neglected Bidentate sp2N-Donor Carrier Ligands with Linked Triazine and Pyridine Rings. Synthesis, NMR Spectral Features, Structure, and Reaction with Guanosine Inorganic Chemistry, 2006, 45, 7182-7190 |
7009280 | CIF | C10 H10 Cl4 Cr2 | P b c a | 11.144; 9.852; 12.139 90; 90; 90 | 1332.7 | Umbarkar, Shubhangi; Sekar, Perumal; Scheer, Manfred Chromium complexes with mixed Group 15 elements as ligands. Synthesis and characterisation of the first cyclo-P2As ligand in [CrCp(CO)2(η3-P2As)] † Journal of the Chemical Society, Dalton Transactions, 2000, 1135 |
7244475 | CIF | C10 H10 Cu F N O4 | P b c a | 7.6004; 14.1706; 20.2294 90; 90; 90 | 2178.75 | Li, Zhongkui; Su, Hao; Zhu, Yanhong; Yan, Li; Li, Hui Structural transformation of copper coordination complexes accompanied with chiral transformation CrystEngComm, 2022 |
2013025 | CIF HKL Paper | C10 H10 F N O2 | P b c a | 9.4933; 9.7792; 20.2345 90; 90; 90 | 1878.51 | Chisholm, Greig; Kennedy, Alan R.; Beaton, Laura; Brook, Eve Structural motifs in acetoacetanilides: the effect of a fluorine substituent Acta Crystallographica Section C, 2002, 58, o645-o648 |
2208532 | CIF HKL Paper | C10 H10 I3 N Pb | P b c a | 15.546; 7.8944; 25.522 90; 90; 90 | 3132.2 | Lemmerer, Andreas; Billing, David G. 1-Naphthylammonium triiodoplumbate(II) Acta Crystallographica Section E, 2006, 62, m904-m906 |
7248102 | CIF | C10 H10 I4 N4 | P b c a | 8.7171; 12.9296; 14.2643 90; 90; 90 | 1607.71 | Zaguzin, Alexander S.; Zaitsev, Artem V.; Korobeynikov, Nikita A.; Novikov, Alexander S.; Usoltsev, Andrey N.; Fedin, Vladimir P.; Adonin, Sergey A. 4,5-Diiodo-1-H-imidazole-derived linker ligand and Cu(i) and Co(ii) coordination polymers based thereupon CrystEngComm, 2024, 26, 1607-1612 |
7214223 | CIF | C10 H10 Mn O5 | P b c a | 9.2037; 7.9073; 29.7366 90; 90; 90 | 2164.12 | Déniz, Mariadel; Hernández-Rodríguez, Irene; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Vallejo, Julia; Julve, Miguel; Lloret, Francesc; Ruiz-Pérez, Catalina Syntheses, crystal structures and magnetic properties of five new manganese(ii) complexes: influence of the conformation of different alkyl/aryl substituted malonate ligands on the crystal packing CrystEngComm, 2014, 16, 2766 |
4346225 | CIF | C10 H10 Mo2 N6 O7 | P b c a | 13.3074; 11.6037; 18.8502 90; 90; 90 | 2910.8 | Lysenko, Andrey B.; Senchyk, Ganna A.; Domasevitch, Konstantin V.; Hauser, Jürg; Fuhrmann, Daniel; Kobalz, Merten; Krautscheid, Harald; Neves, Patrícia; Valente, Anabela A.; Gonçalves, Isabel S Synthesis and Structural Elucidation of Triazolylmolybdenum(VI) Oxide Hybrids and Their Behavior as Oxidation Catalysts. Inorganic chemistry, 2015, 54, 8327-8338 |
7240262 | CIF | C10 H10 N2 | P b c a | 9.612; 7.441; 24.001 90; 90; 90 | 1716.6 | Huang, Jiangkun; Luo, Lan; Xing, Naiguo; Gu, Linghui; Li, Chen; Han, Qiao; Zheng, Shilong; He, Ling Novel synthesis of divergent aryl imidazoles from ketones involving copper-catalyzed α-amination and oxidative C‒C bond cleavage RSC Advances, 2020, 10, 13815-13819 |
2223227 | CIF HKL Paper | C10 H10 N2 O S | P b c a | 12.9391; 10.3967; 14.2938 90; 90; 90 | 1922.86 | He, Li-Min; Cao, Gao; Hu, Ai-Xi 2-(2-Amino-5-methylthiazol-4-yl)phenol Acta Crystallographica Section E, 2009, 65, o2161 |
7236874 | CIF | C10 H10 N2 O2 S4 | P b c a | 23.646; 7.94; 7.2 90; 90; 90 | 1351.8 | Iijima, Kodai; Le Gal, Yann; Higashino, Toshiki; Lorcy, Dominique; Mori, Takehiko Birhodanines and their sulfur analogues for air-stable n-channel organic transistors Journal of Materials Chemistry C, 2017, 5, 9121 |
7233098 | CIF | C10 H10 N2 O3 | P b c a | 11.0905; 10.9922; 16.1833 90; 90; 90 | 1972.89 | Zięba, Sylwia; Dubis, Alina Teresa; Gzella, Andrzej K.; Ławniczak, Paweł; Pogorzelec-Glaser, Katarzyna; Lapinski, Andrzej Toward a new type of proton conductors based on imidazole and aromatic acids Physical Chemistry Chemical Physics, 2019 |
2239887 | CIF HKL | C10 H10 N2 S | P b c a | 5.8231; 14.3214; 21.7365 90; 90; 90 | 1812.71 | Alshammari, Mohammed B.; Smith, Keith; Hegazy, Amany S.; Kariuki, Benson M.; El-Hiti, Gamal A. Crystal structure of 2-ethylquinazoline-4(3<i>H</i>)-thione Acta Crystallographica Section E, 2014, 70, o953 |
2236827 | CIF HKL Paper | C10 H10 N4 | P b c a | 7.6404; 15.1703; 15.9168 90; 90; 90 | 1844.87 | Rivera, Augusto; Jiménez-Cruz, Leonardo; Maldonado, Mauricio; Kučeráková, Monika; Dušek, Michal 2,2'-[1,2-Phenylenebis(azanediyl)]diacetonitrile Acta Crystallographica Section E, 2012, 68, o3429 |
4125843 | CIF | C10 H10 N4 | P b c a | 10.1175; 11.0673; 16.8859 90; 90; 90 | 1890.77 | Calbo, Joaquín; Weston, Claire E.; White, Andrew J. P.; Rzepa, Henry S.; Contreras-García, Julia; Fuchter, Matthew J. Tuning Azoheteroarene Photoswitch Performance through Heteroaryl Design. Journal of the American Chemical Society, 2017, 139, 1261-1274 |
7112066 | CIF | C10 H10 N4 | P b c a | 9.3737; 8.5684; 23.0087 90; 90; 90 | 1848 | Iain D. Roy; Alan R. Burns; Graham Pattison; Boris Michel; Alexandra J. Parker; Hon Wai Lam A second-generation ligand for the enantioselective rhodium-catalyzed addition of arylboronic acids to alkenylazaarenes Chem.Commun., 2014, 50, 2865 |
1542455 | CIF HKL Paper | C10 H10 N4 O | P b c a | 10.2208; 10.8693; 18.1059 90; 90; 90 | 2011.44 | Cunha, Anna C.; Jordão, Alessandro K.; de Souza, Maria C. B. V.; Ferreira, Vitor F.; de Almeida, Maria C. B.; Wardell, James L.; Tiekink, Edward R. T. 1-Anilino-5-methyl-1<i>H</i>-1,2,3-triazole-4-carbaldehyde IUCrData, 2016, 1, x160038 |
2015903 | CIF HKL Paper | C10 H10 N4 O | P b c a | 9.5433; 9.1416; 21.8652 90; 90; 90 | 1907.54 | Ludvík, Jir̆í; Urban, Jir̆í; Fábry, Jan; Císar̆ová, Ivana 4-Amino-3-methyl-6-phenyl-1,2,4-triazin-5(4<i>H</i>)-one (metamitron) and 4-amino-6-methyl-3-phenyl-1,2,4-triazin-5(4<i>H</i>)-one (isometamitron) Acta Crystallographica Section C, 2007, 63, o259-o262 |
1503660 | CIF | C10 H10 N4 O3 | P b c a | 8.973; 8.3478; 28.1826 90; 90; 90 | 2111 | Kong, Kah-Hoe; Tan, Chong-Kiat; Lam, Yulin Traceless Solid-Phase Synthesis of 6-Amino- and 6-Hydroxyimino-1,3,5-triazine-2,4-diones and 1,3,5-Triazine-2,4,6-triones Journal of Combinatorial Chemistry, 2009, 11, 1050 |
2221508 | CIF HKL Paper | C10 H10 N4 O4 | P b c a | 8.4327; 15.116; 16.702 90; 90; 90 | 2129 | Zhang, Tingting; Zhang, Tao; Ren, Yingtao; Liang, Hongze 2,2'-(2,2'-Biimidazole-1,1'-diyl)diethanoic acid Acta Crystallographica Section E, 2009, 65, o904 |
7230611 | CIF | C10 H10 N4 O4 | P b c a | 7.0875; 11.9657; 24.919 90; 90; 90 | 2113.3 | Kumar, Vineet; Goswami, Pramod Kumar; Thaimattam, Ram; Ramanan, Arunachalam Multicomponent solids of uracil derivatives ‒ orotic and isoorotic acids CrystEngComm, 2018, 20, 3490 |
7220202 | CIF | C10 H10 N6 O2 | P b c a | 7.6654; 9.6969; 15.2346 90; 90; 90 | 1132.4 | Sheremetev, Aleksei B.; Lyalin, Boris V.; Kozeev, Andrei M.; Palysaeva, Nadezhda V.; Struchkova, Marina I.; Suponitsky, Kyrill A Practical Anodic Oxidation of Aminofurazans to Azofurazans: an environmentally friendly route RSC Adv., 2015 |
2009336 | CIF HKL Paper | C10 H10 O | P b c a | 8.856; 9.349; 19.778 90; 90; 90 | 1637.5 | Degen, Alexander; Bolte, Michael 4-Phenylbut-3-en-2-one (benzalacetone) Acta Crystallographica Section C, 1999, 55, IUC9900170 |
7201010 | CIF | C10 H10 O10 S2 Sc2 | P b c a | 5.8209; 10.0529; 24.9876 90; 90; 90 | 1462.2 | Perles, Josefina; Snejko, Natalia; Iglesias, Marta; Monge, M. Ángeles 3D scandium and yttrium arenedisulfonate MOF materials as highly thermally stable bifunctional heterogeneous catalysts Journal of Materials Chemistry, 2009, 19, 6504 |
2207170 | CIF HKL Paper | C10 H10 O2 | P b c a | 7.434; 5.972; 17.603 90; 90; 90 | 781.5 | Jian-Ming Gu; Xiu-Rong Hu; Wei-Ming Xu 2,3,6,7-Tetrahydrobenzo[1,2-<i>b</i>;4,5-<i>b</i>']difuran Acta Crystallographica Section E, 2005, 61, o3674-o3675 |
2236770 | CIF HKL Paper | C10 H10 O2 | P b c a | 8.5386; 10.4949; 18.8536 90; 90; 90 | 1689.5 | Chang, Yuan Jay; Chen, Kew-Yu 7-Methoxyindan-1-one Acta Crystallographica Section E, 2012, 68, o3063 |
4128275 | CIF | C10 H10 O2 | P b c a | 8.5386; 10.4949; 18.8536 90; 90; 90 | 1689.5 | Liu, Zong-Ying; Hu, Jiun-Wei; Huang, Chun-Hao; Huang, Teng-Hsing; Chen, Deng-Gao; Ho, Ssu-Yu; Chen, Kew-Yu; Li, Elise Y.; Chou, Pi-Tai Sulfur-Based Intramolecular Hydrogen-Bond: Excited-State Hydrogen-Bond On/Off Switch with Dual Room-Temperature Phosphorescence. Journal of the American Chemical Society, 2019, 141, 9885-9894 |
2210080 | CIF HKL Paper | C10 H10 O3 | P b c a | 14.362; 8.22; 14.36 90; 90; 90 | 1695.3 | Wang, Ruo-Yu; Fang, Mei-Juan; Huang, Yao-Jian; Zheng, Zhong-Hui; Shen, Yue-Mao 7-Hydroxy-4,6-dimethyl-3<i>H</i>-isobenzofuran-1-one Acta Crystallographica Section E, 2006, 62, o4172-o4173 |
2228167 | CIF HKL Paper | C10 H10 O4 | P b c a | 15.269; 7.167; 17.136 90; 90; 90 | 1875.2 | Collas, Alain; Vande Velde, Christophe M. L.; Blockhuys, Frank 3-(2-Formylphenoxy)propanoic acid Acta Crystallographica Section E, 2010, 66, o2662 |
2311283 | CIF Paper | C10 H10 O4 | P b c a | 7.754; 11.346; 21.187 90; 90; 90 | 1864 | Saranya, Matheswaran; Subashini, Annamalai; Arunagiri, Chidambaram; Muthiah, Packianathan Thomas Crystal structure of 3-acet-oxy-2-methyl-benzoic acid. Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o474 |
4508210 | CIF | C10 H10 O6 P2 | P b c a | 7.843; 7.484; 19.078 90; 90; 90 | 1119.8 | Białek, Michał J.; Zaręba, Jan K.; Janczak, Jan; Zoń, Jerzy Chains, Layers, Channels, and More: Supramolecular Chemistry of Potent Diphosphonic Tectons with Tuned Flexibility. The Generation of Pseudopolymorphs, Polymorphs, and Adducts Crystal Growth & Design, 2013, 13, 4039 |
7200770 | CIF | C10 H10 O7 U | P b c a | 8.5125; 11.569; 25.143 90; 90; 90 | 2476.1 | Thuéry, Pierre Uranyl‒organic bilayer assemblies with flexible aromatic di-, tri- and tetracarboxylic acids CrystEngComm, 2009, 11, 1081 |
7237979 | CIF | C10 H10 S6 | P b c a | 11.3175; 14.386; 16.3305 90; 90; 90 | 2658.8 | Mroweh, Nabil; Auban-Senzier, Pascale; Vanthuyne, Nicolas; Canadell, Enric; Avarvari, Narcis Chiral EDT-TTF precursors with one stereogenic centre: substituent size modulation of the conducting properties in the (R-EDT-TTF)2PF6 (R = Me or Et) series Journal of Materials Chemistry C, 2019, 7, 12664 |
2231911 | CIF HKL Paper | C10 H11 Br Cl N O | P b c a | 9.7449; 10.1063; 22.8803 90; 90; 90 | 2253.36 | Moreno-Fuquen, Rodolfo; Quintero, David E.; Zuluaga, Fabio; Kennedy, Alan R.; De Almeida Santos, Regina H. 2-Bromo-<i>N</i>-(4-chlorophenyl)-2-methylpropanamide Acta Crystallographica Section E, 2011, 67, o2580 |
7218906 | CIF | C10 H11 Br N6 O | P b c a | 11.3672; 7.2817; 30.1714 90; 90; 90 | 2497.36 | Seth, Saikat Kumar; Lee, Vannajan Sanghiran; Yana, Janchai; Zain, Sharifuddin M.; Cunha, Anna C.; Ferreira, Vitor F.; Jordão, Alessandro K.; de Souza, Maria C. B. V.; Wardell, Solange M. S. V.; Wardell, James L.; Tiekink, Edward R. T. Crystallographic and computational study of 1-(arylamino)-1,2,3-triazole-4-carbohydrazides CrystEngComm, 2015, 17, 2255 |
2241597 | CIF | C10 H11 Br O4 | P b c a | 8.8487; 8.1514; 29.284 90; 90; 90 | 2112.2 | Suchetan, P. A.; Suneetha, V.; Naveen, S.; Lokanath, N. K.; Krishna Murthy, P. Comparison of the crystal structures of methyl 4-bromo-2-(methoxymethoxy)benzoate and 4-bromo-3-(methoxymethoxy)benzoic acid Acta Crystallographica Section E, 2016, 72, 477-481 |
2311795 | CIF | C10 H11 Br2 Hg N O2 | P b c a | 6.8597; 13.9425; 26.7054 90; 90; 90 | 2554.1 | Truong, Khai Nghi; Merkens, Carina; Englert, Ulli 3-(Pyridin-4-yl)acetylacetone: a donor ligand towards mercury(II) halides and a versatile linker for complex materials. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 981-991 |
2105947 | CIF HKL Paper | C10 H11 Cd I2 N O2 | P b c a | 7.1002; 14.349; 27.54 90; 90; 90 | 2805.8 | Merkens, Carina; Truong, Khai-Nghi; Englert, Ulli 3-(4-Pyridyl)-acetylacetone ‒ a fully featured substituted pyridine and a flexible linker for complex materials Acta Crystallographica Section B, 2014, 70, 705-713 |
7208149 | CIF | C10 H11 Cl N2 O | P b c a | 11.9981; 7.3161; 23.079 90; 90; 90 | 2025.9 | Sánchez, Ignacio; Campo, José Antonio; Heras, José Vicente; Rosario Torres, M.; Cano, Mercedes Pyrazolium salts as a new class of ionic liquid crystals Journal of Materials Chemistry, 2012, 22, 13239 |
2211206 | CIF HKL Paper | C10 H11 Cl N2 O2 | P b c a | 9.707; 12.7121; 16.4203 90; 90; 90 | 2026.21 | Nagarajan Vembu; Elinor C. Spencer; Jean Lee; John G. Kelly; Kevin B. Nolan; Marc Devocelle 5-Chloro-3-hydroxy-2,2-dimethyl-2,3-dihydroquinazolin-4(1<i>H</i>)-one: supramolecular aggregation through a two-dimensional network of N—H···O and O—H···O interactions Acta Crystallographica Section E, 2006, 62, o5003-o5005 |
7218905 | CIF | C10 H11 Cl N6 O | P b c a | 11.4176; 7.2174; 29.6018 90; 90; 90 | 2439.35 | Seth, Saikat Kumar; Lee, Vannajan Sanghiran; Yana, Janchai; Zain, Sharifuddin M.; Cunha, Anna C.; Ferreira, Vitor F.; Jordão, Alessandro K.; de Souza, Maria C. B. V.; Wardell, Solange M. S. V.; Wardell, James L.; Tiekink, Edward R. T. Crystallographic and computational study of 1-(arylamino)-1,2,3-triazole-4-carbohydrazides CrystEngComm, 2015, 17, 2255 |
7055837 | CIF | C10 H11 Cl2 N3 O2 Ru | P b c a | 14.5946; 12.2931; 14.917 90; 90; 90 | 2676.3 | Makhinya, Alexander N.; Il’in, Maxim A.; Yamaletdinov, Ruslan D.; Korolkov, Ilya V.; Baidina, Iraida A. Synthesis and crystal structure of nitrosoruthenium complexes cis-[Ru(NO)Py2Cl2(OH)] and cis-[Ru(NO)Py2Cl2(H2O)]Cl. Photoinduced transformations of cis-[Ru(NO)Py2Cl2(OH)] New J. Chem., 2016, 40, 10267 |
7241633 | CIF | C10 H11 Cu N O5 | P b c a | 7.4851; 13.4109; 21.5161 90; 90; 90 | 2159.8 | Su, Hao; Li, Zhongkui; Tan, Junrui; Ma, Hongwei; Yan, Li; Li, Hui Structural conversion of three copper(ii) complexes with snapshot observations based on the different crystal colours and morphology RSC Advances, 2020, 10, 42964-42970 |
1548685 | CIF HKL Paper | C10 H11 F3 N2 O | P b c a | 9.8152; 10.0783; 22.512 90; 90; 90 | 2226.9 | El-Hiti, Gamal A.; Smith, Keith; Hegazy, Amany S.; Alshammari, Mohammed B.; Kariuki, Benson M. 1,1-Dimethyl-3-[4-(trifluoromethyl)phenyl]urea IUCrData, 2018, 3, x180040 |
7151175 | CIF | C10 H11 Fe N O4 | P b c a | 11.3721; 9.835; 20.671 90; 90; 90 | 2311.9 | Williams, Iwan; Reeves, Keith; Kariuki, Benson M.; Cox, Liam R. Stereoselective synthesis of 2-dienyl-substituted piperidines using an eta4-dienetricarbonyliron complex as the stereocontrolling element in a double reductive amination cascade. Organic & biomolecular chemistry, 2007, 5, 3325-3329 |
2311797 | CIF | C10 H11 Hg I2 N O2 | P b c a | 7.0546; 14.2685; 27.4248 90; 90; 90 | 2760.5 | Truong, Khai Nghi; Merkens, Carina; Englert, Ulli 3-(Pyridin-4-yl)acetylacetone: a donor ligand towards mercury(II) halides and a versatile linker for complex materials. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 981-991 |
4514962 | CIF | C10 H11 I N2 O3 | P b c a | 10.1121; 9.0764; 24.912 90; 90; 90 | 2286.5 | Chen, Zhengwang; Liu, Botao; Liang, Pei; Luo, Haiqing; Zheng, Jing; Wen, Xiaowei; Liu, Tanggao; Luo, Guotian; Ye, Min Construction of N-S and C-N Bonds from Reactions of Benzofuroxans with DMSO or THF. ACS omega, 2019, 4, 281-291 |
2233997 | CIF HKL Paper | C10 H11 I2 N O | P b c a | 10.7019; 7.1483; 32.404 90; 90; 90 | 2478.9 | Liu, Peng-Gang; Wang, Xiao-Ning; Yang, Yong-An; Zhu, Hai-Liang 2,4-Diiodo-6-[(propylimino)methyl]phenol Acta Crystallographica Section E, 2012, 68, o789 |
2016643 | CIF HKL Paper | C10 H11 N | P b c a | 18.326; 10.3875; 8.2618 90; 90; 90 | 1572.7 | Gomes, Clara S. B.; Figueira, Cláudia A.; Gomes, Pedro T.; Duarte, M. Teresa 5-Phenyl-3,4-dihydro-2<i>H</i>-pyrrole: the first example of a planar monosubstituted 1-pyrroline Acta Crystallographica Section C, 2008, 64, o303-o305 |
2101412 | CIF Paper | C10 H11 N O | P b c a | 9.132; 12.931; 15.514 90; 90; 90 | 1832 | Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G. Intermolecular N‒H^{···^}O hydrogen bonds assisted by resonance. Heteroconjugated systems as hydrogen-bond-strengthening functional groups Acta Crystallographica Section B, 1995, 51, 1004-1015 |
4089629 | CIF | C10 H11 N O | P b c a | 9.8639; 8.6409; 19.7464 90; 90; 90 | 1683.04 | Tronnier, Alexander; Poethig, Alexander; Herdtweck, Eberhardt; Strassner, Thomas C∧C* Cyclometalated Platinum(II) NHC Complexes with β-Ketoimine Ligands Organometallics, 2014, 33, 898 |
7111649 | CIF | C10 H11 N O S | P b c a | 10.1145; 8.615; 22.2122 90; 90; 90 | 1935.5 | Banert, Klaus; Hagedorn, Manfred; Wutke, Jens; Ecorchard, Petra; Schaarschmidt, Dieter; Lang, Heinrich Elusive ethynyl azides: trapping by 1,3-dipolar cycloaddition and decomposition to cyanocarbenes Chemical Communications, 2010, 46, 4058 |
2235718 | CIF HKL Paper | C10 H11 N O2 | P b c a | 11.061; 7.584; 22.642 90; 90; 90 | 1899.36 | Li, Zhao-Bo; Shen, Li-Li; Zheng, Jian-An 1-Methyl-4-[(1<i>E</i>)-2-nitroprop-1-en-1-yl]benzene Acta Crystallographica Section E, 2012, 68, o2065 |
7238490 | CIF | C10 H11 N O4 | P b c a | 10.3173; 7.4516; 26.221 90; 90; 90 | 2015.9 | Wang, Lei; Zhao, Lei; Xu, Lingyan; Chen, Ruixin; Yang, Yu Interesting organic supramolecular structures constructed by piperazine/N,N′-dimethylpiperazine with aromatic multicomponent acids: synthon cooperation and structural diversity CrystEngComm, 2012, 14, 6998 |
2237130 | CIF HKL Paper | C10 H11 N O6 | P b c a | 7.9657; 11.347; 23.513 90; 90; 90 | 2125.3 | Balakrishnan, T.; Ramamurthi, K.; Thamotharan, S. Glycine‒phthalic acid (1/1) Acta Crystallographica Section E, 2013, 69, o57 |
7225618 | CIF | C10 H11 N O6 | P b c a | 8.133; 11.3031; 23.884 90; 90; 90 | 2195.6 | Losev, E. A.; Zakharov, B. A.; Boldyreva, E. V. Polymorphic transformations in glycine co-crystals at low temperature and high pressure: two new examples as a follow-up to a glycine‒glutaric acid study CrystEngComm, 2016, 18, 5869 |
7225619 | CIF | C10 H11 N O6 | P b c a | 8.1071; 11.3252; 23.827 90; 90; 90 | 2187.7 | Losev, E. A.; Zakharov, B. A.; Boldyreva, E. V. Polymorphic transformations in glycine co-crystals at low temperature and high pressure: two new examples as a follow-up to a glycine‒glutaric acid study CrystEngComm, 2016, 18, 5869 |
7225620 | CIF | C10 H11 N O6 | P b c a | 8.0808; 11.3449; 23.766 90; 90; 90 | 2178.8 | Losev, E. A.; Zakharov, B. A.; Boldyreva, E. V. Polymorphic transformations in glycine co-crystals at low temperature and high pressure: two new examples as a follow-up to a glycine‒glutaric acid study CrystEngComm, 2016, 18, 5869 |
7225621 | CIF | C10 H11 N O6 | P b c a | 8.0565; 11.3647; 23.719 90; 90; 90 | 2171.7 | Losev, E. A.; Zakharov, B. A.; Boldyreva, E. V. Polymorphic transformations in glycine co-crystals at low temperature and high pressure: two new examples as a follow-up to a glycine‒glutaric acid study CrystEngComm, 2016, 18, 5869 |
7225622 | CIF | C10 H11 N O6 | P b c a | 8.0324; 11.3875; 23.665 90; 90; 90 | 2164.6 | Losev, E. A.; Zakharov, B. A.; Boldyreva, E. V. Polymorphic transformations in glycine co-crystals at low temperature and high pressure: two new examples as a follow-up to a glycine‒glutaric acid study CrystEngComm, 2016, 18, 5869 |
7225623 | CIF | C10 H11 N O6 | P b c a | 8.0056; 11.4027; 23.615 90; 90; 90 | 2155.7 | Losev, E. A.; Zakharov, B. A.; Boldyreva, E. V. Polymorphic transformations in glycine co-crystals at low temperature and high pressure: two new examples as a follow-up to a glycine‒glutaric acid study CrystEngComm, 2016, 18, 5869 |
7225624 | CIF | C10 H11 N O6 | P b c a | 7.9837; 11.4209; 23.589 90; 90; 90 | 2150.9 | Losev, E. A.; Zakharov, B. A.; Boldyreva, E. V. Polymorphic transformations in glycine co-crystals at low temperature and high pressure: two new examples as a follow-up to a glycine‒glutaric acid study CrystEngComm, 2016, 18, 5869 |
7225625 | CIF | C10 H11 N O6 | P b c a | 7.9621; 11.4304; 23.548 90; 90; 90 | 2143.1 | Losev, E. A.; Zakharov, B. A.; Boldyreva, E. V. Polymorphic transformations in glycine co-crystals at low temperature and high pressure: two new examples as a follow-up to a glycine‒glutaric acid study CrystEngComm, 2016, 18, 5869 |
7225626 | CIF | C10 H11 N O6 | P b c a | 7.9445; 11.4431; 23.524 90; 90; 90 | 2138.6 | Losev, E. A.; Zakharov, B. A.; Boldyreva, E. V. Polymorphic transformations in glycine co-crystals at low temperature and high pressure: two new examples as a follow-up to a glycine‒glutaric acid study CrystEngComm, 2016, 18, 5869 |
7225627 | CIF | C10 H11 N O6 | P b c a | 7.8988; 11.3424; 23.327 90; 90; 90 | 2089.9 | Losev, E. A.; Zakharov, B. A.; Boldyreva, E. V. Polymorphic transformations in glycine co-crystals at low temperature and high pressure: two new examples as a follow-up to a glycine‒glutaric acid study CrystEngComm, 2016, 18, 5869 |
2219619 | CIF HKL Paper | C10 H11 N O7 S | P b c a | 7.7504; 14.5638; 21.0615 90; 90; 90 | 2377.3 | Arshad, Muhammad Nadeem; Tahir, M. Nawaz; Khan, Islam Ullah; Shafiq, Muhammad; Siddiqui, Waseeq Ahmad Methyl 3-hydroxy-4-oxo-3,4-dihydro-2<i>H</i>-1,2-benzothiazine-3-carboxylate 1,1-dioxide monohydrate Acta Crystallographica Section E, 2008, 64, o2045 |
4024057 | CIF | C10 H11 N3 | P b c a | 11.3159; 7.5465; 21.013 90; 90; 90 | 1794.4 | Brendan J. Liddle; Rosalice M. Silva; Tyler J. Morin; Felipe P. Macedo; Ruchi Shukla; Sergey V. Lindeman; James R. Gardinier BORAZANs: Tunable Fluorophores Based on 2-(Pyrazolyl)aniline Chelates of Diphenylboron Journal of Organic Chemistry, 2007, 72, 5637-5646 |
2236323 | CIF HKL Paper | C10 H11 N3 O | P b c a | 12.1599; 9.6153; 16.2345 90; 90; 90 | 1898.16 | Sidra, Lala Rukh; Khan, Islam Ullah; Yar, Muhammad; Simpson, Jim 2-(1<i>H</i>-Indol-3-yl)acetohydrazide Acta Crystallographica Section E, 2012, 68, o3140-o3141 |
2239832 | CIF HKL | C10 H11 N3 O S | P b c a | 13.1231; 8.8559; 19.3702 90; 90; 90 | 2251.14 | Pino-Cuevas, Arantxa; Carballo, Rosa; Vázquez-López, Ezequiel M. Crystal structure of 1-(4-formylbenzylidene)-4-methylthiosemicarbazone Acta Crystallographica Section E, 2014, 70, o926 |
2219987 | CIF HKL Paper | C10 H11 N3 O2 | P b c a | 13.244; 8.4865; 17.518 90; 90; 90 | 1968.9 | Liu, Bing; Xu, Weiren; Zhao, Guilong; Wang, Runling; Tang, Lida 1-(4-Methoxyphenyl)-3-methyl-1<i>H</i>-1,2,4-triazol-5(4<i>H</i>)-one Acta Crystallographica Section E, 2008, 64, o2099 |
7058097 | CIF | C10 H11 N3 O2 S | P b c a | 9.7216; 10.6601; 22.1772 90; 90; 90 | 2298.29 | Todorov, Petar T.; Peneva, Petia N.; Georgieva, Stela I.; Rusew, Rusi I.; Shivachev, Boris L.; Georgiev, Anton H. Photochromic and molecular switching behaviour of new Schiff bases containing hydantoin rings: synthesis, characterization and crystal structures New Journal of Chemistry, 2019, 43, 2740 |
1561604 | CIF | C10 H12 As Mn N3 S4 | P b c a | 10.8233; 13.2009; 22.2516 90; 90; 90 | 3179.2 | Yue, Cheng-Yang; Lei, Xiao-Wu; Tian, Ya-Wei; Xu, Jing; Bai, Yi-Qun; Wang, Fei; Zhou, Peng-Fei; Liu, Xiao-Fan; Yi, Fei-Yan Unsaturated Mn complex decorated hybrid thioarsenates: Syntheses, crystal structures and physical properties Journal of Solid State Chemistry, 2016, 235, 183-192 |
7157696 | CIF | C10 H12 B F4 N3 | P b c a | 14.4577; 10.5526; 15.7197 90; 90; 90 | 2398.3 | Byrne, Joseph P.; Albrecht, Martin Anion-cation synergistic metal-free catalytic oxidative homocoupling of benzylamines by triazolium iodide salts. Organic & biomolecular chemistry, 2020, 18, 7379-7387 |
2010675 | CIF HKL Paper | C10 H12 B N O S2 | P b c a | 10.0818; 16.122; 13.7747 90; 90; 90 | 2238.92 | Low, John Nicolson; Musgrave, Oliver, C.; Wardell, James, L. (2-Aminoethoxy)bis(2-thienyl)boron Acta Crystallographica Section C, 2000, 56, e63-e63 |
2022455 | CIF HKL Paper | C10 H12 Br Cl N2 | P b c a | 8.6153; 9.3766; 29.173 90; 90; 90 | 2356.7 | Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. The crystalline forms of nine hydrochloride salts of substituted tryptamines Acta Crystallographica Section C, 2021, 77 |
2223137 | CIF HKL Paper | C10 H12 Br2 O2 | P b c a | 8.125; 14.689; 20.353 90; 90; 90 | 2429 | Zhou, Feng-yan 1,2-Bis(bromomethyl)-4,5-dimethoxybenzene Acta Crystallographica Section E, 2009, 65, o2064 |
4502238 | CIF | C10 H12 Br9 Fe N6 | P b c a | 15.7936; 15.1937; 20.058 90; 90; 90 | 4813.2 | Awwadi, Firas; Haddad, Salim F.; Willett, Roger D.; Twamley, Brendan The Analogy of C−Br···Br−C, C−Br···Br−Fe, and Fe−Br···Br−Fe Contacts: Crystal Structures of (26DAPH)FeBr4and (26DA35DBPH)2FeBr4·Br Crystal Growth & Design, 2010, 10, 158 |
2022457 | CIF HKL Paper | C10 H12 Cl F N2 | P b c a | 8.6708; 9.6684; 25.6854 90; 90; 90 | 2153.28 | Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. The crystalline forms of nine hydrochloride salts of substituted tryptamines Acta Crystallographica Section C, 2021, 77 |
2022459 | CIF HKL Paper | C10 H12 Cl F N2 | P b c a | 8.3572; 10.3493; 24.3824 90; 90; 90 | 2108.86 | Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. The crystalline forms of nine hydrochloride salts of substituted tryptamines Acta Crystallographica Section C, 2021, 77 |
2022633 | CIF HKL Paper | C10 H12 Cl N O | P b c a | 9.5119; 9.6885; 21.8439 90; 90; 90 | 2013.05 | Jones, Roderick C.; Twamley, Brendan Structure of 2-chloro-N-(p-tolyl)propanamide Acta Crystallographica, Section E: Crystallographic Communications, 2018, 74, 1584-1588 |
2022634 | CIF HKL Paper | C10 H12 Cl N O | P b c a | 9.5053; 9.6793; 21.838 90; 90; 90 | 2009.2 | Jones, Roderick C.; Twamley, Brendan Structure of 2-chloro-N-(p-tolyl)propanamide Acta Crystallographica, Section E: Crystallographic Communications, 2018, 74, 1584-1588 |
2232528 | CIF HKL Paper | C10 H12 Cl N O2 | P b c a | 9.6326; 8.665; 25.7944 90; 90; 90 | 2152.97 | Betz, Richard; Gerber, Thomas; Hosten, Eric; Siddegowda, Maravanahalli S.; Yathirajan, Hemmige S. 3-Chloro-<i>N</i>-(4-methoxyphenyl)propanamide Acta Crystallographica Section E, 2011, 67, o2868 |
8102411 | CIF | C10 H12 Cl N O2 | P b c a | 20.935; 13.964; 22.386 90; 90; 90 | 6544 | Richard J. Staples; Julian A. Gingold Crystal structure of isopropyl-N-(3-chlorophenyl)carbamate, C10H12ClNO2, Chloropropham Zeitschrift für Kristallographie - New Crystal Structures, 2009, 224, 121 |
2018205 | CIF HKL Paper | C10 H12 Cl2 N4 O3 | P b c a | 15.963; 7.406; 21.793 90; 90; 90 | 2576.41 | Gutierrez, Julio; Eisenberg, Rodney; Herrensmith, Gabrielle; Tobin, Thomas; Li, Tonglei; Long, Sihui Solvatomorphism in (<i>E</i>)-2-(2,6-dichloro-4-hydroxybenzylidene)hydrazinecarboximidamide Acta Crystallographica Section C, 2011, 67, o310-o314 |
7055838 | CIF | C10 H12 Cl3 N3 O2 Ru | P b c a | 12.4068; 14.0336; 16.9426 90; 90; 90 | 2949.91 | Makhinya, Alexander N.; Il’in, Maxim A.; Yamaletdinov, Ruslan D.; Korolkov, Ilya V.; Baidina, Iraida A. Synthesis and crystal structure of nitrosoruthenium complexes cis-[Ru(NO)Py2Cl2(OH)] and cis-[Ru(NO)Py2Cl2(H2O)]Cl. Photoinduced transformations of cis-[Ru(NO)Py2Cl2(OH)] New J. Chem., 2016, 40, 10267 |
4308720 | CIF | C10 H12 Cu F6 N4 O6 S2 | P b c a | 13.5406; 10.8441; 27.725 90; 90; 90 | 4071 | Japhet Irangu; Michael J. Ferguson; Robert B. Jordan Reaction of Copper(II) with Ferrocene and 1,1'-Dimethylferrocene in Aqueous Acetonitrile: The Copper(II/I) Self-Exchange Rate Inorganic Chemistry, 2005, 44, 1619-1625 |
2202376 | CIF | C10 H12 Cu N10 O10 | P b c a | 14.4717; 6.4247; 18.4846 90; 90; 90 | 1718.63 | Abul-Haj, Mohammad; Quirós, Miguel; Salas, Juan M. Diaquabis(nitrato-κO)bis(4,7-dihydro-1,2,4-triazolo [1,5-a]pyrimidine-7-one-κN^3^)copper(II) Acta Crystallographica, Section E: Structure Reports Online, 2003, 59, m903-m905 |
4025212 | CIF | C10 H12 F3 N O4 | P b c a | 15.151; 8.909; 17.225 90; 90; 90 | 2325 | Alberto Avenoza; Jesús H. Busto; Noelia Canal; Francisco Corzana; Jesús M. Peregrina; Marta Pérez-Fernández; Fernando Rodríguez Cyclobutane Amino Acid Analogues of Furanomycin Obtained by a Formal [2 + 2] Cycloaddition Strategy Promoted by Methylaluminoxane Journal of Organic Chemistry, 2010, 75, 545-552 |
1542342 | CIF | C10 H12 F4 N2 O | P b c a | 7.1579; 12.4992; 24.3054 90; 90; 90 | 2174.6 | Charpentier, Julie; Früh, Natalja; Foser, Simon; Togni, Antonio Tandem Radical Fluoroalkylation-Cyclization: Synthesis of Tetrafluoro Imidazopyridines. Organic letters, 2016, 18, 756-759 |
7157695 | CIF | C10 H12 I N3 | P b c a | 13.9563; 10.5922; 15.5819 90; 90; 90 | 2303.44 | Byrne, Joseph P.; Albrecht, Martin Anion-cation synergistic metal-free catalytic oxidative homocoupling of benzylamines by triazolium iodide salts. Organic & biomolecular chemistry, 2020, 18, 7379-7387 |
4038986 | CIF | C10 H12 I10 N2 Te2 | P b c a | 12.2697; 12.9259; 19.0862 90; 90; 90 | 3027.01 | Faoro, Eliandro; de Oliveira, Gelson Manzoni; Lang, Ernesto Schulz; Pereira, Cesar Bicca Synthesis and structural features of new aryltellurenyl iodides Journal of Organometallic Chemistry, 2010, 695, 1480-1486 |
7021760 | CIF | C10 H12 N O6 P Zn | P b c a | 15.4847; 7.8115; 19.2932 90; 90; 90 | 2333.7 | Cao, Deng-Ke; Liu, Bei; Gu, Yan-Wei; Feng, Jia-Qi; Zhao, Yue Phosphonates containing 8-hydroxyquinoline moiety and their metal complexes: structures, fluorescent and magnetic properties. Dalton transactions (Cambridge, England : 2003), 2013, 42, 12228-12237 |
1543304 | CIF | C10 H12 N2 O | P b c a | 13.6534; 6.92272; 18.544 90; 90; 90 | 1752.75 | Arteaga, Fernando Arteaga; Liu, Zijian; Brewitz, Lennart; Chen, Jianyang; Sun, Bo; Kumagai, Naoya; Shibasaki, Masakatsu Direct Catalytic Asymmetric Mannich-Type Reaction of Alkylamides. Organic letters, 2016, 18, 2391-2394 |
2003794 | CIF Paper | C10 H12 N2 O2 | P b c a | 20.32; 18.618; 5.095 90; 90; 90 | 1927.5 | Sudha, L.; Subramanian, K.; Sivaraman, J.; Sriraghavan, K.; Steiner, Th. 5-Amino-8-methyl-2-quinolone Monohydrate Acta Crystallographica Section C, 1995, 51, 1689-1691 |
2015567 | CIF HKL Paper | C10 H12 N2 O2 | P b c a | 10.146; 7.3091; 25.1662 90; 90; 90 | 1866.28 | Hamdellou, Lamine; Hernandez, Olivier; Meinnel, Jean 4-Dimethylamino-β-nitrostyrene and 4-dimethylamino-β-ethyl-β-nitrostyrene at 100 K Acta Crystallographica Section C, 2006, 62, o557-o560 |
2228373 | CIF HKL Paper | C10 H12 N2 O2 | P b c a | 11.309; 7.6693; 24.684 90; 90; 90 | 2140.9 | Jiang, Jin-He Ethyl 3-benzylidenecarbazate Acta Crystallographica Section E, 2010, 66, o3337 |
7200436 | CIF | C10 H12 N2 O2 | P b c a | 10.3129; 7.4611; 25.3216 90; 90; 90 | 1948.4 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Crystalline-state conformational change of β-nitrostyrenes and its freezing at low temperature CrystEngComm, 2009, 11, 638 |
7200437 | CIF | C10 H12 N2 O2 | P b c a | 10.2801; 7.411; 25.2458 90; 90; 90 | 1923.4 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Crystalline-state conformational change of β-nitrostyrenes and its freezing at low temperature CrystEngComm, 2009, 11, 638 |
7200438 | CIF | C10 H12 N2 O2 | P b c a | 10.2466; 7.3631; 25.1655 90; 90; 90 | 1898.65 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Crystalline-state conformational change of β-nitrostyrenes and its freezing at low temperature CrystEngComm, 2009, 11, 638 |
7200439 | CIF | C10 H12 N2 O2 | P b c a | 10.2078; 7.3313; 25.1387 90; 90; 90 | 1881.29 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Crystalline-state conformational change of β-nitrostyrenes and its freezing at low temperature CrystEngComm, 2009, 11, 638 |
7200440 | CIF | C10 H12 N2 O2 | P b c a | 10.1607; 7.296; 25.1132 90; 90; 90 | 1861.7 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Crystalline-state conformational change of β-nitrostyrenes and its freezing at low temperature CrystEngComm, 2009, 11, 638 |
7220121 | CIF | C10 H12 N2 O2 | P b c a | 10.3118; 7.4555; 25.318 90; 90; 90 | 1946.4 | Gupta, Vinod Kumar; Singh, Ram Adhar An investigation on single crystal growth, structural, thermal and optical properties of a series of organic D‒π‒A push-pull materials RSC Adv., 2015 |
7248589 | CIF | C10 H12 N2 O2 S | P b c a | 11.0048; 9.1927; 21.2407 90; 90; 90 | 2148.8 | Shaiwale, Mayuri; Narayan, Som; Jha, Prafulla K.; Ballabh, Amar A simple and efficient synthesis of a series of N -(thiazol-2-yl)piperidine-2,6-dione compounds and their interesting NLO properties CrystEngComm, 2024 |
1556218 | CIF | C10 H12 N2 O3 | P b c a | 7.4941; 15.8862; 16.1019 90; 90; 90 | 1916.98 | de Robillard, Guillaume; Devillers, Charles H.; Kunz, Doris; Cattey, Hélène; Digard, Eric; Andrieu, Jacques Electrosynthesis of imidazolium carboxylates. Organic letters, 2013, 15, 4410-4413 |
2218935 | CIF HKL Paper | C10 H12 N2 O3 | P b c a | 11.342; 7.6114; 24.986 90; 90; 90 | 2157 | Cheng, Xiang-Wei Ethyl <i>N</i>'-[(<i>E</i>)-4-hydroxybenzylidene]hydrazinecarboxylate at 123K Acta Crystallographica Section E, 2008, 64, o1396 |
2219230 | CIF HKL Paper | C10 H12 N2 O3 | P b c a | 11.2532; 10.431; 17.226 90; 90; 90 | 2022 | Lv, Lu-Ping; Xie, Jian-Wu; Yu, Wen-Bo; Li, Wei-Wei; Hu, Xian-Chao (<i>E</i>)-Methyl <i>N</i>'-[1-(4-hydroxyphenyl)ethylidene]hydrazinecarboxylate Acta Crystallographica Section E, 2008, 64, o1675 |
2234300 | CIF HKL Paper | C10 H12 N2 O3 | P b c a | 14.5445; 8.3832; 16.2341 90; 90; 90 | 1979.41 | Wang, Li-Jiao; Li, Wei-Wei; Yang, Sheng-Yong; Yang, Li 4-(4-Nitrophenyl)morpholine Acta Crystallographica Section E, 2012, 68, o1235 |
8100040 | CIF | C10 H12 N4 Ni O6 | P b c a | 11.89; 7.9087; 14.664 90; 90; 90 | 1378.9 | Kirchmaier, Ralph; Altin, Ergün; Lentz, Axel Crystal structure of diaqua-bis(pyrazole)-μ~2~-squarato(1,3) nickel(II), Ni(C~4~O~4~)(C~3~H~4~N)~2~(H~2~O)~2~ Zeitschrift für Kristallographie - New Crystal Structures, 2004, 219, 135-136 |
7243373 | CIF | C10 H12 N4 O7 | P b c a | 19.1729; 5.8157; 22.9536 90; 90; 90 | 2559.41 | Saunders, Lucy K.; Pallipurath, Anuradha R.; Gutmann, Matthias J.; Nowell, Harriott; Zhang, Ningjin; Allan, David R. A quantum crystallographic approach to short hydrogen bonds. CrystEngComm, 2021, 23, 6180-6190 |
7243374 | CIF | C10 H12 N4 O7 | P b c a | 19.157; 5.791; 22.956 90; 90; 90 | 2546.7 | Saunders, Lucy K.; Pallipurath, Anuradha R.; Gutmann, Matthias J.; Nowell, Harriott; Zhang, Ningjin; Allan, David R. A quantum crystallographic approach to short hydrogen bonds. CrystEngComm, 2021, 23, 6180-6190 |
1557348 | CIF | C10 H12 N4 O8 | P b c a | 6.48; 14.84; 26.79 90; 90; 90 | 2576 | Butts, Craig P.; Eberson, Lennart; Hartshorn, Michael P.; Robinson, Ward T.; Timmerman-Vaughan, David J.; Young, Dawson A. W. Photochemical Nitration by Tetranitromethane. Part XXVI. Adduct Formation in the Photochemical Reaction of 1,2,3-Trimethylbenzene: the Formation of 'Double' Adducts Including Nitronic Esters Acta Chemica Scandinavica, 1996, 50, 29-47 |
2230640 | CIF HKL Paper | C10 H12 N6 | P b c a | 8.1167; 10.6662; 12.7127 90; 90; 90 | 1100.59 | Wolińska, Ewa; Karczmarzyk, Zbigniew; Rykowski, Andrzej; Wysocki, Waldemar 5,5',6,6'-Tetramethyl-3,3'-bi-1,2,4-triazine Acta Crystallographica Section E, 2011, 67, o1613 |
4303161 | CIF | C10 H12 N6 | P b c a | 9.5559; 8.027; 14.798 90; 90; 90 | 1135.1 | Yukinari Sunatsuki; Ryohei Kawamoto; Kunihiro Fujita; Hisashi Maruyama; Takayoshi Suzuki; Hiroyuki Ishida; Masaaki Kojima; Seiichiro Iijima; Naohide Matsumoto Structures and Spin States of Bis(tridentate)-Type Mononuclear and Triple Helicate Dinuclear Iron(II) Complexes of Imidazole-4-carbaldehyde azine Inorganic Chemistry, 2009, 48, 8784-8795 |
2201903 | CIF HKL Paper | C10 H12 O S2 | P b c a | 10.4039; 11.0435; 17.7471 90; 90; 90 | 2039.1 | Anwar Usman; Hoong-Kun Fun; Nemai C. Ganguly; Mrityunjoy Datta; Kumaresh Ghosh 2-(2-Hydroxyphenyl)-1,3-dithiane Acta Crystallographica Section E, 2003, 59, o773-o775 |
2104249 | CIF Paper | C10 H12 O2 | P b c a | 9.1724; 7.185; 27.407 90; 90; 90 | 1806.2 | Lemmerer, Andreas; Báthori, Nikoletta B.; Bourne, Susan A. Chiral carboxylic acids and their effects on melting-point behaviour in co-crystals with isonicotinamide Acta Crystallographica Section B, 2008, 64, 780-790 |
1555107 | CIF | C10 H12 O3 | P b c a | 8.8394; 8.5924; 23.437 90; 90; 90 | 1780.1 | Rashid, Showkat; Bhat, Bilal A.; Mehta, Goverdhan Regenerative γ-Lactone Annulations: A Modular, Iterative Approach to Oligo-tetrahydrofuran Molecular Stairs and Related Frameworks. Organic letters, 2015, 17, 3604-3607 |
2213842 | CIF HKL Paper | C10 H12 O4 | P b c a | 7.2306; 14.1058; 19.403 90; 90; 90 | 1979 | Ghulam Qadeer; Nasim Hasan Rama; Muhammad Azaad Malik; Madeleine Helliwell Methyl 2,6-dimethoxybenzoate Acta Crystallographica Section E, 2007, 63, o3027-o3027 |
4503782 | CIF | C10 H12 O4 | P b c a | 13.9238; 8.0603; 17.796 90; 90; 90 | 1997.2 | Breen, Meghan E.; Tameze, Shella L.; Dougherty, William G.; Kassel, W. Scott; Wheeler, Kraig A. Structural Studies of Enantiomers, Racemates, and Quasiracemates. 2-(3-Bromophenoxy)propionic Acid and 2-(3-Methoxyphenoxy)propionic Acid Crystal Growth & Design, 2008, 8, 3863 |
2228302 | CIF HKL Paper | C10 H13 Br O S | P b c a | 15.7951; 7.4122; 19.007 90; 90; 90 | 2225.3 | Cao, Zhiling; Liu, Weiwei; Yin, Fujun Dimethyl(2-oxo-2-phenylethyl)sulfanium bromide Acta Crystallographica Section E, 2010, 66, o3197 |
1551644 | CIF | C10 H13 Cl F N O2 | P b c a | 24.679; 9.873; 9.253 90; 90; 90 | 2254.5 | Guillon, Jean; Pinaud, Noël; Marchivie, Mathieu; Ronga, Luisa; Benazzouz, Abdelhamid; Moreau, Stéphane Crystal Structure of a Fluoro Analogue of 3,4-(Methylenedioxy)amphetamine X-ray Structure Analysis Online, 2015, 31, 23 |
2016887 | CIF HKL Paper | C10 H13 Cl N2 O3 S | P b c a | 9.3198; 10.3218; 26.2663 90; 90; 90 | 2526.74 | Drebushchak, Tatiana N.; Chukanov, Nikita V.; Boldyreva, Elena V. Two polymorphs of chlorpropamide: the δ-form and the high-temperature ε-form Acta Crystallographica Section C, 2008, 64, o623-o625 |
2229287 | CIF HKL Paper | C10 H13 Cl N2 O4 | P b c a | 7.427; 17.708; 18.748 90; 90; 90 | 2465.7 | Yu, Zhi-Peng; Geng, Wen-Qian; Kong, Lin; Zhou, Hong-Ping 1-(4-Carboxyphenyl)-1<i>H</i>-imidazol-3-ium chloride dihydrate Acta Crystallographica Section E, 2011, 67, o452 |
7228393 | CIF | C10 H13 Cl1.98 N O3 | P b c a | 12.12852; 7.92362; 25.81707 90; 90; 90 | 2481.07 | D'Vries, Richard Fernando; Moreno-Fuquen, Rodolfo; Camps, Ihosvany; Ayala, Alejandro P.; Kennedy, Alan; Reinheimer, Eric W.; Ellena, Javier A. Order-disorder phase transition induced by proton transfer in a co-crystal of 2,4-dichlorobenzoic Acid and Trimethylamine N- oxide CrystEngComm, 2017 |
7228390 | CIF | C10 H13 Cl2 N O3 | P b c a | 12.2017; 7.959; 25.9259 90; 90; 90 | 2517.75 | D'Vries, Richard Fernando; Moreno-Fuquen, Rodolfo; Camps, Ihosvany; Ayala, Alejandro P.; Kennedy, Alan; Reinheimer, Eric W.; Ellena, Javier A. Order-disorder phase transition induced by proton transfer in a co-crystal of 2,4-dichlorobenzoic Acid and Trimethylamine N- oxide CrystEngComm, 2017 |
7228391 | CIF | C10 H13 Cl2 N O3 | P b c a | 12.2769; 8.0018; 26.0006 90; 90; 90 | 2554.23 | D'Vries, Richard Fernando; Moreno-Fuquen, Rodolfo; Camps, Ihosvany; Ayala, Alejandro P.; Kennedy, Alan; Reinheimer, Eric W.; Ellena, Javier A. Order-disorder phase transition induced by proton transfer in a co-crystal of 2,4-dichlorobenzoic Acid and Trimethylamine N- oxide CrystEngComm, 2017 |
7228392 | CIF | C10 H13 Cl2 N O3 | P b c a | 12.2403; 7.9788; 25.9695 90; 90; 90 | 2536.26 | D'Vries, Richard Fernando; Moreno-Fuquen, Rodolfo; Camps, Ihosvany; Ayala, Alejandro P.; Kennedy, Alan; Reinheimer, Eric W.; Ellena, Javier A. Order-disorder phase transition induced by proton transfer in a co-crystal of 2,4-dichlorobenzoic Acid and Trimethylamine N- oxide CrystEngComm, 2017 |
7228394 | CIF | C10 H13 Cl2 N O3 | P b c a | 12.162; 7.9403; 25.8738 90; 90; 90 | 2498.63 | D'Vries, Richard Fernando; Moreno-Fuquen, Rodolfo; Camps, Ihosvany; Ayala, Alejandro P.; Kennedy, Alan; Reinheimer, Eric W.; Ellena, Javier A. Order-disorder phase transition induced by proton transfer in a co-crystal of 2,4-dichlorobenzoic Acid and Trimethylamine N- oxide CrystEngComm, 2017 |
4074245 | CIF | C10 H13 Cl2 O2 Sb | P b c a | 13.334; 8.558; 22.036 90; 90; 90 | 2514.58 | Dostál, Libor; Císařová, Ivana; Jambor, Roman; Růžička, Aleš; Jirásko, Robert; Holeček, Jaroslav Structural Diversity of Organoantimony(III) and Organobismuth(III) Dihalides Containing O,C,O-Chelating Ligands Organometallics, 2006, 25, 4366 |
7210274 | CIF | C10 H13 Cl3 Cu N6 O10 | P b c a | 10.8122; 11.1482; 31.445 90; 90; 90 | 3790.3 | Cao, Jing; Liu, Jia-Cheng; Deng, Wen-Ting; Jin, Neng-Zhi Structurally diverse copper(ii) complexes with pyridazine-integrated with pyrazine‒Schiff base ligand featuring an easily lost proton in the hydrazone backbone CrystEngComm, 2013, 15, 6359 |
2218028 | CIF HKL Paper | C10 H13 Cl5 | P b c a | 12.2386; 9.0701; 23.0822 90; 90; 90 | 2562.25 | Valkonen, Arto; Kolehmainen, Erkki; Nikiforov, Vladimir 2-<i>exo</i>,5-<i>endo</i>,8,8,10-Pentachlorobornane Acta Crystallographica Section E, 2008, 64, o688 |
4074247 | CIF | C10 H13 I2 O2 Sb | P b c a | 14.028; 8.098; 25.426 90; 90; 90 | 2888.36 | Dostál, Libor; Císařová, Ivana; Jambor, Roman; Růžička, Aleš; Jirásko, Robert; Holeček, Jaroslav Structural Diversity of Organoantimony(III) and Organobismuth(III) Dihalides Containing O,C,O-Chelating Ligands Organometallics, 2006, 25, 4366 |
2013753 | CIF HKL Paper | C10 H13 N O | P b c a | 14.2587; 8.5369; 14.9245 90; 90; 90 | 1816.7 | Maria Gdaniec; Teresa Olszewska; Tadeusz Połoński 2,4,6-Trimethylbenzamide Acta Crystallographica Section C, 2004, 60, o41-o43 |
2214108 | CIF HKL Paper | C10 H13 N O | P b c a | 9.145; 13.215; 15.993 90; 90; 90 | 1932.8 | B. Thimme Gowda; Sabine Foro; Hartmut Fuess <i>N</i>-(2,6-Dimethylphenyl)acetamide Acta Crystallographica Section E, 2007, 63, o3154-o3154 |
4072353 | CIF | C10 H13 N O2 Si | P b c a | 12.1828; 9.7269; 18.0635 90; 90; 90 | 2140.54 | Wagler, Jörg; Hill, Anthony F. Ring Opening of Organosilicon-Substituted Benzoxazolinone: A Convenient Route to Chelating Ureato and Carbamido Ligands Organometallics, 2008, 27, 6579 |
1569743 | CIF | C10 H13 N O3 | P b c a | 9.3359; 10.169; 20.658 90; 90; 90 | 1961.2 | Malik, Monika; Senatore, Raffaele; Langer, Thierry; Holzer, Wolfgang; Pace, Vittorio Base-mediated homologative rearrangement of nitrogen-oxygen bonds of <i>N</i>-methyl-<i>N</i>-oxyamides. Chemical science, 2023, 14, 10140-10146 |
2213920 | CIF HKL Paper | C10 H13 N O3 | P b c a | 7.1956; 16.832; 33.054 90; 90; 90 | 4003.4 | Lai, Qing-Lin; Zhao, Qing-Jie; Liu, Zheng; Shen, Jing-Shan 3,5-Dimethoxyacetanilide Acta Crystallographica Section E, 2007, 63, o2782-o2782 |
4022675 | CIF | C10 H13 N O3 S | P b c a | 14.196; 9.713; 15.483 90; 90; 90 | 2134.9 | N. C. Misra; K. Panda; H. Ila; H. Junjappa An Efficient Highly Regioselective Synthesis of 2,3,4-Trisubstituted Pyrroles by Cycloaddition of Polarized Ketene S,S- and N,S- Acetals with Activated Methylene Isocyanides Journal of Organic Chemistry, 2007, 72, 1246-1251 |
2234219 | CIF HKL Paper | C10 H13 N O5 | P b c a | 4.9387; 19.7; 21.616 90; 90; 90 | 2103.1 | Jia, Chunman; Chen, Shangwen; Yuan, Wenbing 4-[(2-Carboxyethyl)amino]benzoic acid monohydrate Acta Crystallographica Section E, 2012, 68, o1098 |
4122847 | CIF | C10 H13 N3 | P b c a | 7.7043; 15.9073; 15.9426 90; 90; 90 | 1953.8 | Longstreet, Ashley R.; Jo, Minyoung; Chandler, Rebecca R.; Hanson, Kenneth; Zhan, Naiqian; Hrudka, Jeremy J.; Mattoussi, Hedi; Shatruk, Michael; McQuade, D. Tyler Ylidenemalononitrile enamines as fluorescent "turn-on" indicators for primary amines. Journal of the American Chemical Society, 2014, 136, 15493-15496 |
8105915 | CIF | C10 H13 N3 | P b c a | 9.4795; 10.7585; 18.8783 90; 90; 90 | 1925.3 | Huang, Guo-Ling; Chen, Xiu-Wen; Chen, Lu; Li, Yi-Biao Crystal structure of 2-tert-butyl-1H-imidazo[4,5-b]pyridine, C10H13N3 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 991-992 |
2227550 | CIF HKL Paper | C10 H13 N3 O S | P b c a | 13.397; 9.1271; 18.799 90; 90; 90 | 2298.7 | Li, Yu-Feng 1-(4-Methoxybenzylidene)-4-methylthiosemicarbazide Acta Crystallographica Section E, 2010, 66, o2728 |
7212179 | CIF | C10 H13 N3 O S | P b c a | 8.914; 13.613; 18.028 90; 90; 90 | 2187.6 | Krasowska, M.; Kochel, A.; Filarowski, A. The conformational analysis of 2-hydroxyaryl Schiff thiosemicarbazones CrystEngComm, 2010, 12, 1955 |
1501708 | CIF | C10 H13 N3 O2 S | P b c a | 11.0859; 13.0805; 15.8132 90; 90; 90 | 2293.06 | Farrugia, Louis J.; Khalaji, Aliakbar Dehno Evidence for side-chain π-delocalization in a planar substituted benzene: an experimental and theoretical charge density study on 2,5-dimethoxybenzaldehyde thiosemicarbazone. The journal of physical chemistry. A, 2011, 115, 12512-12522 |
2220109 | CIF HKL Paper | C10 H13 N3 O2 S | P b c a | 11.0713; 13.0603; 15.7808 90; 90; 90 | 2281.82 | Fun, Hoong-Kun; Jebas, Samuel Robinson; D'Silva, E. Deepak; Patil, P. S.; Dharmaprakash, S. M. 2,5-Dimethoxybenzaldehyde thiosemicarbazone Acta Crystallographica Section E, 2008, 64, o2276 |
2212309 | CIF HKL Paper | C10 H13 N3 S3 Sn | P b c a | 13.068; 11.294; 20.158 90; 90; 90 | 2975 | Junshan Sun; Rufen Zhang; Daqi Wang <i>catena</i>-Poly[[trimethyltin(IV)]-μ-[5-(2-thienylmethyleneamino)-1,3,4-thiadiazole-2-thiolato-κ^2^<i>N</i>^4^:<i>S</i>^2^]] Acta Crystallographica Section E, 2007, 63, m418-m419 |
7208250 | CIF | C10 H13.5 N1.5 O2.5 | P b c a | 12.226; 11.891; 13.689 90; 90; 90 | 1990.1 | André, Vânia; M. da Piedade, M. Fátima; Duarte, M. Teresa Revisiting paracetamol in a quest for new co-crystals CrystEngComm, 2012, 14, 5005 |
7111228 | CIF | C10 H14 | P b c a | 7.0832; 5.9177; 21.2692 90; 90; 90 | 891.53 | Bond, Andrew D. C???H????? interactions in the low-temperature crystal structures of ??,??-unsaturated linear hydrocarbonsElectronic supplementary (ESI) information available: experimental details of crystal growth for 1???4, lattice-energy calculations for 1???4 and the n-alkanes, and definition and determination of the planar packing densities. See http://www.rsc.org/suppdata/cc/b2/b204261d/ Chemical Communications, 2002, 1664 |
4324457 | CIF | C10 H14 B Cl2 N | P b c a | 20.685; 14.1854; 23.3812 90; 90; 90 | 6860.6 | Zachariah M. Heiden; Michael Schedler; Douglas W. Stephan Synthesis and Reactivity of o-Benzylphosphino- and o-α-Methylbenzyl(N,N-dimethyl)amine-Boranes Inorganic Chemistry, 2011, 50, 1470-1479 |
4501720 | CIF | C10 H14 B2 Cl2 N2 O5 Pt | P b c a | 19.0164; 8.3989; 19.303 90; 90; 90 | 3083 | Campos-Gaxiola, José J.; Vega-Paz, Araceli; Román-Bravo, Perla; Höpfl, Herbert; Sánchez-Vázquez, Mario Pyridineboronic Acids as Useful Building Blocks in Combination with Perchloroplatinate(II) and -(IV) Salts: 1D, 2D, and 3D Hydrogen-Bonded Networks Containing X-H···Cl2Pt−(X = C, N+), B(OH)2···Cl2Pt−, and B(OH)2···(HO)2B Synthons Crystal Growth & Design, 2010, 10, 3182 |
7012329 | CIF | C10 H14 Br2 O2 Te | P b c a | 6.8905; 15.5279; 26.0281 90; 90; 90 | 2784.88 | Asahara, Masahiro; Taomoto, Shoichiro; Tanaka, Masahito; Erabi, Tatsuo; Wada, Masanori Dependence of the rotational barrier of the Ar-group in RArTeX2 on the R-group [Ar = 2,6-(MeO)2C6H3; R = Me, Et, i-Pr; X = Cl, Br, I] Dalton Transactions, 2003, 973 |
2200102 | CIF HKL Paper | C10 H14 Cl N3 S | P b c a | 13.189; 8.577; 20.195 90; 90; 90 | 2284.5 | Lynch, Daniel E.; McClenaghan, Ian 4-Chloro-2-methylthio-6-(1-piperidyl)pyrimidine Acta Crystallographica Section E, 2001, 57, o200-o201 |
2235705 | CIF HKL Paper | C10 H14 Cl2 N2 O2 | P b c a | 10.312; 14.997; 15.666 90; 90; 90 | 2422.7 | Gao, Shuang; Zhao, Li-xia; Ye, Fei; Fu, Ying; Xing, Zhi-yong 1-Dichloroacetyl-8a-methyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-<i>a</i>]pyrimidin-6-one Acta Crystallographica Section E, 2012, 68, o1982 |
7012325 | CIF | C10 H14 Cl2 O2 Te | P b c a | 6.7317; 15.2528; 25.9327 90; 90; 90 | 2662.7 | Asahara, Masahiro; Taomoto, Shoichiro; Tanaka, Masahito; Erabi, Tatsuo; Wada, Masanori Dependence of the rotational barrier of the Ar-group in RArTeX2 on the R-group [Ar = 2,6-(MeO)2C6H3; R = Me, Et, i-Pr; X = Cl, Br, I] Dalton Transactions, 2003, 973 |
4343401 | CIF | C10 H14 Cu I3 N4 | P b c a | 9.3242; 16.887; 20.587 90; 90; 90 | 3241.6 | He, Jun; Cao, Peng; Wu, Chao; Huang, Jiahong; Huang, Jian; He, Yonghe; Yu, Lin; Zeller, Matthias; Hunter, Allen D.; Xu, Zhengtao Highly Polarizable Triiodide Anions (I3(-)) as Cross-Linkers for Coordination Polymers: Closing the Semiconductive Band Gap. Inorganic chemistry, 2015, 54, 6087-6089 |
1557788 | CIF | C10 H14 I N2 O2 | P b c a | 8.3415; 10.1215; 25.9996 90; 90; 90 | 2195.11 | Yang, Zhimin; Stein, Richard A.; Ngendahimana, Thacien; Pink, Maren; Rajca, Suchada; Jeschke, Gunnar; Eaton, Sandra S.; Eaton, Gareth R.; Mchaourab, Hassane S.; Rajca, Andrzej Supramolecular Approach to Electron Paramagnetic Resonance Distance Measurement of Spin-Labeled Proteins. The journal of physical chemistry. B, 2020 |
2240518 | CIF HKL | C10 H14 N2 O | P b c a | 11.2453; 10.5272; 17.5339 90; 90; 90 | 2075.69 | El-Hiti, Gamal A.; Smith, Keith; Hegazy, Amany S.; Alanazi, Saud A.; Kariuki, Benson M. Crystal structure of 2,2-dimethyl-<i>N</i>-(pyridin-3-yl)propanamide Acta Crystallographica Section E, 2015, 71, o246-o247 |
2200055 | CIF HKL Paper | C10 H14 N2 O4 | P b c a | 21.825; 12.384; 8.048 90; 90; 90 | 2175.2 | Edwards, Selvin H.; Kahwa, Ishenkumba A.; Mague, Joel T. Ethylenediammonium phthalate Acta Crystallographica Section E, 2001, 57, o20-o21 |
2223366 | CIF HKL Paper | C10 H14 N2 O4 | P b c a | 7.892; 16.374; 18.334 90; 90; 90 | 2369.2 | Lv, Lu-Ping; Yu, Wen-Bo; Tan, Ying; Zhang, Yong-Zhao; Hu, Xian-Chao <i>N</i>'-(4-Hydroxy-3-methoxybenzylidene)acetohydrazide monohydrate Acta Crystallographica Section E, 2009, 65, o2514 |
2207580 | CIF HKL Paper | C10 H14 N2 O5 S3 | P b c a | 9.842; 15.29; 19.434 90; 90; 90 | 2924.5 | Zhen-Guang Zou; Peng Guo; Yin-Xiang Lu <i>N</i>-[2-(Aminosulfonyl)-5,6-dihydro-6-methyl-7,7-dioxo-4<i>H</i>-thieno[2,3-<i>b</i>]thiopyran-4-yl]acetamide Acta Crystallographica Section E, 2005, 61, o4096-o4098 |
7056351 | CIF | C10 H14 N4 | P b c a | 11.469; 9.506; 19.52 90; 90; 90 | 2128.2 | Łakomska, Iwona; babinska, magdalena; Wojtczak, Andrzej; Kozakiewicz, Anna; Sitkowski, Jerzy; Jarzecki, Andrzej A. Experimental and theoretical investigation of the complexation of 5-methyl-7-isobutyl-1,2,4-triazolo[1,5-a]pyrimidine by platinum(II) ion New J. Chem., 2017 |
8107684 | CIF | C10 H14 N4 | P b c a | 15.5356; 9.8551; 25.5551 90; 90; 90 | 3912.61 | Dali, Zhu; Yu, Yu Crystal structure of 6,6a,7,8,9,10-hexahydro-5H-pyrazino [2,3-e]pyrido[1,2-a]pyrazine, C10H14N4 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1137-1139 |
7211942 | CIF | C10 H14 N4 O4 | P b c a | 13.3293; 13.1137; 14.023 90; 90; 90 | 2451.2 | Callear, Samantha K.; Hursthouse, Michael B.; Threlfall, Terence L. A systematic study of the crystallisation products of a series of dicarboxylic acids with imidazole derivatives CrystEngComm, 2010, 12, 898 |
1516376 | CIF | C10 H14 N4 O6 | P b c a | 17.4174; 7.0176; 19.344 90; 90; 90 | 2364.39 | Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking. The journal of physical chemistry. A, 2009, 113, 11354-11366 |
2210274 | CIF HKL Paper | C10 H14 N4 O6 | P b c a | 7.119; 16.922; 20.671 90; 90; 90 | 2490.2 | Zhao, Li-Fang 2-[2-(Methylammonio)ethyliminiomethyl]-4-nitrophenolate nitrate Acta Crystallographica Section E, 2006, 62, o3970-o3971 |
2217000 | CIF HKL Paper | C10 H14 N4 O6 | P b c a | 15.7555; 11.2726; 28.742 90; 90; 90 | 5104.7 | Wang, Yu-Zhou; Wang, Zhi-Guo; Li, Lin 3α,6α-Bis(ethoxycarbonyl)glycoluril (diethyl 2,5-dioxoperhydroimidazo[4,5-<i>d</i>]imidazole-3a,6a-dicarboxylate) Acta Crystallographica Section E, 2008, 64, o125-o125 |
7112736 | CIF | C10 H14 O3 | P b c a | 9.4612; 13.0067; 14.8753 90; 90; 90 | 1830.54 | Gundluru, Mahesh Kumar; Pourpak, Alan; Cui, Xiaoli; Morris, Stephan W.; Webb, Thomas R. Design, synthesis and initial biological evaluation of a novel pladienolide analog scaffold. MedChemComm, 2011, 2, 904-908 |
4067136 | CIF | C10 H15 B N Ti | P b c a | 9.4046; 9.6243; 22.776 90; 90; 90 | 2061.5 | Wolstenholme, David J.; Traboulsee, Kyle T.; Decken, Andreas; McGrady, G. Sean Structure and Bonding of Titanocene Amidoborane Complexes: A Common Bonding Motif with Their β-Agostic Organometallic Counterparts Organometallics, 2010, 29, 5769 |
4075206 | CIF | C10 H15 B7 Co2 O6 | P b c a | 13.883; 14.5367; 17.2427 90; 90; 90 | 3479.8 | Lu, Xiu Lian; McGrath, Thomas D.; Stone, F. Gordon A. Synthesis and Reactivity of 10- and 12-Vertex Cobalt−Monocarborane Anions Containing Multiple Metal Centers Organometallics, 2006, 25, 2590 |
2211153 | CIF HKL Paper | C10 H15 Co N O8 | P b c a | 11.193; 7.731; 30.815 90; 90; 90 | 2666.5 | Ying-Heng Huang; Jin-Hua Cai; Xiu-Ju Yin; Yi-Min Jiang Triaqua[<i>N</i>-(5-formylsalicylidene)glycinato(2{-})-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']cobalt(II) monohydrate Acta Crystallographica Section E, 2006, 62, m2922-m2924 |
7700728 | CIF | C10 H15 Cu K N2 O9 | P b c a | 7.1143; 16.6561; 23.7391 90; 90; 90 | 2813 | Yang, Yu-Chen; Wu, Rui; Yang, Min; Chen, Xi; Weng, Wei-Zheng; Zhou, Zhao-Hui Formation of N-oxido copper ethylenediaminetetraacetate and propanediaminetetraacetate and their selective degradation to iminodiacetate and propanediaminediacetate. Dalton transactions (Cambridge, England : 2003), 2019, 48, 13388-13395 |
2213914 | CIF HKL Paper | C10 H15 Mn N O8 | P b c a | 11.208; 7.89; 31.212 90; 90; 90 | 2760 | Jin-Hua Cai Triaqua[2-(carboxylatomethyliminomethyl)-4-formylphenolato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']manganese(II) monohydrate Acta Crystallographica Section E, 2007, 63, m1631-m1631 |
2210208 | CIF Paper | C10 H15 N Ni O8 | P b c a | 11.158; 7.674; 30.95 90; 90; 90 | 2650.1 | Xu-Hui Liu; Jin-Hua Cai; Yi-Min Jiang; Ying-Heng Huang; Xiu-Ju Yin Triaqua[<i>N</i>-(5-formysalicylidene)glycinato(2‒)-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']nickel(II) monohydrate Acta Crystallographica Section E, 2006, 62, m2119-m2121 |
2241507 | CIF HKL Paper | C10 H15 N O | P b c a | 14.5166; 15.9102; 16.0527 90; 90; 90 | 3707.6 | Golen, James A.; McDonald, Kyle J.; Manke, David R. Crystal structure of 3-(diethylamino)phenol Acta Crystallographica Section E, 2015, 71, o1075 |
2236771 | CIF HKL Paper | C10 H15 N O2 | P b c a | 11.7408; 13.3554; 37.5523 90; 90; 90 | 5888.32 | Molokoane, Pule P.; Schutte, M.; Steyl, G. 2-Ethyl-3-hydroxy-1-isopropyl-4-pyridone Acta Crystallographica Section E, 2012, 68, o3235-o3236 |
7203443 | CIF | C10 H15 N O2 | P b c a | 8.763; 10.924; 20.1019 90; 90; 90 | 1924.29 | Rosamilia, Anthony E.; Giarrusso, Marilena A.; Scott, Janet L.; Strauss, Christopher R. A direct, efficient synthesis of unsymmetrically substituted bis(arylidene)alkanones Green Chemistry, 2006, 8, 1042 |
4518847 | CIF | C10 H15 N O5 Se | P b c a | 8.5156; 14.64; 20.2074 90; 90; 90 | 2519.22 | Iwaoka, Michio; Hiyoshi, Yuta; Arai, Shota; Ito, Takeru Synthesis of 4-Selenothreofuranose Derivatives via Pummerer-Type Reactions of trans-3,4-Dioxygenated Tetrahydroselenophenes Mediated by a Selenonium Intermediate ACS Omega, 2021 |
2210533 | CIF HKL Paper | C10 H15 N O8 Zn | P b c a | 11.232; 7.759; 30.973 90; 90; 90 | 2699.3 | Jin-Hua Cai; Ying-Heng Huang; Yi-Min Jiang Triaqua[<i>N</i>-(5-formysalicylidene)glycinato(2‒)-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']zinc(II) monohydrate Acta Crystallographica Section E, 2006, 62, m2432-m2434 |
2219232 | CIF HKL Paper | C10 H15 N2 Nd O9 | P b c a | 6.642; 14.7273; 26.0161 90; 90; 90 | 2544.86 | Huang, Xiao-Hui; Xu, Xiao-Hong; Pan, Wei-Bo; Zeng, Rong-Hua Poly[aqua[μ-<i>N</i>'-(carboxymethyl)ethylenediamine-<i>N</i>,<i>N</i>,<i>N</i>'-triacetato]neodymium(III)] Acta Crystallographica Section E, 2008, 64, m1194 |
2211872 | CIF HKL Paper | C10 H15 N2 O4 P | P b c a | 9.4345; 8.607; 28.973 90; 90; 90 | 2352.7 | T. Kolev; M. Spiteller; T. van Almsick; H. Mayer-Figge; W.S. Sheldrick 2-(Indol-3-yl)ethylammonium dihydrogenphosphate Acta Crystallographica Section E, 2007, 63, o179-o181 |
2219691 | CIF HKL Paper | C10 H15 N2 O9 Sm | P b c a | 6.6506; 14.7051; 25.967 90; 90; 90 | 2539.5 | Zhou, Guo-Yong; Wu, Gui-Rong; Deng, Zhi-Yong; Chen, Xing-Tian Poly[aqua[μ~3~-<i>N</i>'-(carboxymethyl)ethylenediamine-<i>N</i>,<i>N</i>,<i>N</i>'-triacetato]samarium(III)] Acta Crystallographica Section E, 2008, 64, m1348 |
7212178 | CIF | C10 H15 N3 O2 S | P b c a | 14.688; 12.574; 12.574 90; 90; 90 | 2322.3 | Krasowska, M.; Kochel, A.; Filarowski, A. The conformational analysis of 2-hydroxyaryl Schiff thiosemicarbazones CrystEngComm, 2010, 12, 1955 |
7155038 | CIF | C10 H15 N3 O3 | P b c a | 16.652; 6.8992; 18.61 90; 90; 90 | 2138 | Broadley, Kenneth J.; Burnell, Erica; Davies, Robin H.; Lee, Alan T. L.; Snee, Stephen; Thomas, Eric J. The synthesis of a series of adenosine A3 receptor agonists. Organic & biomolecular chemistry, 2016, 14, 3765-3781 |
7054726 | CIF | C10 H15 N4 O6 P | P b c a | 8.8012; 13.0262; 25.0491 90; 90; 90 | 2871.8 | Gholivand, Khodayar; Molaei, Foroogh Synthesis and structural study of some new phosphorus(v) hydrazide compounds: spectroscopic evidence and a theoretical approach New J. Chem., 2015, 39, 3747 |
1503943 | CIF | C10 H15 N5 O3 | P b c a | 6.936; 17.283; 20.657 90; 90; 90 | 2476.3 | Picon, Sylvain; Tran, Huu Dau Elise; Martin, Marie-Thérèse; Retailleau, Pascal; Zaparucha, Anne; Al-Mourabit, Ali Biomimetically inspired short access to the 2-aminoimidazole-fused tetracyclic core of (+/-)-dibromoagelaspongin. Organic letters, 2009, 11, 2523-2526 |
4306763 | CIF | C10 H16 Ag F3 O3 S3 Si | P b c a | 12.9776; 15.3104; 17.5409 90; 90; 90 | 3485.2 | Chinwon Rim; Hongming Zhang; David Y. Son Silyl-Substituted Thioether Ligands and Their Ag(I) Complexes Inorganic Chemistry, 2008, 47, 11993-12003 |
7061178 | CIF | C10 H16 B2 Cu N16 | P b c a | 13.507; 8.2794; 16.968 90; 90; 90 | 1897.5 | Mei, Haozheng; Xu, Yiqiang; Lei, Guorong; Cao, Wenli; Li, Zhimin; Zhang, Jianguo Synthesis, structure and properties of a high-energy metal–organic framework fuel [Cu(MTZ)2(CTB)2]n New Journal of Chemistry, 2022, 46, 1687-1692 |
7237996 | CIF | C10 H16 Br4 N2 Pb S2 | P b c a | 8.4013; 8.2; 29.0071 90; 90; 90 | 1998.32 | Wei, Wen-Juan; Li, Chao; Li, Lin-Sui; Tang, Yun-Zhi; Jiang, Xing-Xing; Lin, Zhe-Shuai Phase transition, optical and dielectric properties regulated by anion-substitution in a homologous series of 2D hybrid organic‒inorganic perovskites Journal of Materials Chemistry C, 2019, 7, 11964 |
7061955 | CIF | C10 H16 Cd Cl4 N2 S2 | P b c a | 7.5349; 7.3677; 31.746 90; 90; 90 | 1762.4 | Han, Li-Jun; Liu, Jia; Shao, Ting; Jia, Qiang-Qiang; Su, Chang-Yuan; Fu, Da-Wei; Lu, Hai-Feng A Cd-based perovskite with optical-electrical multifunctional response New Journal of Chemistry, 2022, 46, 17928-17933 |
2225694 | CIF HKL Paper | C10 H16 Cl D3 Li N O8 | P b c a | 12.1605; 12.6338; 19.87 90; 90; 90 | 3052.7 | Guzei, Ilia A.; Spencer, Lara C.; Xiao, Lingyun; Burnette, Ronald R. (1,4,7,10-Tetraoxacyclododecane)(trideuteroacetonitrile)lithium perchlorate Acta Crystallographica Section E, 2010, 66, m440-m441 |
1101123 | CIF | C10 H16 Cl2 Cu N4 O4 | P b c a | 14.045; 11.749; 19.701 90; 90; 90 | 3251 | Francisco Hueso-Ureña; Sonia B. Jiménez-Pulido; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas Synthesis and structural studies on 1:1 metal complexes with 1,3-dimethyllumazine and 1,3,6,7-tetramethyllumazine. Crystal structure of two dichloro copper(II) and mercury(II) compounds and a polymeric chloro-nitrato bridged-mercury(II) complex. Polyhedron, 1998, 17, 3409-3418 |
4334665 | CIF | C10 H16 Cl4 P2 Si | P b c a | 12.9646; 15.2875; 16.3211 90; 90; 90 | 3234.8 | William Levason; David Pugh; Gillian Reid Phosphine and Diphosphine Complexes of Silicon(IV) Halides Inorganic Chemistry, 2013, 52, 5185-5193 |
2237683 | CIF HKL Paper | C10 H16 Cl8 N4 Sn | P b c a | 11.9379; 10.3704; 16.7018 90; 90; 90 | 2067.7 | van Megen, Martin; Prömper, Stephan; Reiss, Guido J. Bis(3-azaniumylpyridin-1-ium) hexachloridostannate(IV) dichloride Acta Crystallographica Section E, 2013, 69, m217 |
4312888 | CIF | C10 H16 Cu2 N10 S2 | P b c a | 8.0221; 32.3844; 13.5659 90; 90; 90 | 3524.3 | Jia-Cheng Liu; Guo; Jin-Shun Huang; Xiao-Zeng You Different Oxidation States of Copper(I, I/II, II) Thiocyanate Complexes Containing 1,2,4-Triazole as a Bridging Ligand: Syntheses, Crystal Structures, and Magnetic Properties of 2-D Polymer CuI(admtrz)SCN, Linear Trinuclear [CuI2CuII(admtrz)6(SCN)2](ClO4)2, and Triangular Trinuclear [CuII3(admtrz)4(SCN)3(μ3-OH)(H2O)](ClO4)2.H2O (admtrz = 4-Amino-3,5-dimethyl-1,2,4-triazole) Inorganic Chemistry, 2003, 42, 235-243 |
7154785 | CIF | C10 H16 F N O2 | P b c a | 18.9983; 11.2142; 20.2881 90; 90; 90 | 4322.4 | Goh, Yi Ling; Adsool, Vikrant A. Radical fluorination powered expedient synthesis of 3-fluorobicyclo[1.1.1]pentan-1-amine. Organic & biomolecular chemistry, 2015, 13, 11597-11601 |
1550247 | CIF | C10 H16 Hg2 I4 N4 S2 | P b c a | 10.1454; 15.0815; 15.2995 90; 90; 90 | 2340.94 | Karri, Ramesh; Chalana, Ashish; Das, Ranajit; Rai, Rakesh Kumar; Roy, Gouriprasanna Cytoprotective effects of imidazole-based [S<sub>1</sub>] and [S<sub>2</sub>]-donor ligands against mercury toxicity: a bioinorganic approach. Metallomics : integrated biometal science, 2019, 11, 213-225 |
7125563 | CIF | C10 H16 I4 N2 Pb S2 | P b c a | 8.842; 8.693; 28.995 90; 90; 90 | 2228.7 | Zhu, Xu-Hui; Mercier, Nicolas; Riou, Amédée; Blanchard, Philippe; Frère, Pierre (C4H3SCH2NH3)2(CH3NH3)Pb2I7: non-centrosymmetrical crystal structure of a bilayer hybrid perovskite. Chemical communications (Cambridge, England), 2002, 2160-2161 |
7707736 | CIF | C10 H16 I4 N2 S2 Sn | P b c a | 8.773; 8.658; 28.961 90; 90; 90 | 2199.8 | Jung, Mi-Hee The red light emission in 2D (C<sub>4</sub>SH<sub>3</sub>CH<sub>2</sub>NH<sub>3</sub>)<sub>2</sub>SnI<sub>4</sub> and (C<sub>4</sub>OH<sub>7</sub>CH<sub>2</sub>NH<sub>3</sub>)<sub>2</sub>SnI<sub>4</sub> perovskites. Dalton transactions (Cambridge, England : 2003), 2021, 50, 10261-10274 |
7707737 | CIF | C10 H16 I4 N2 S2 Sn | P b c a | 8.797; 8.688; 29.17 90; 90; 90 | 2229.4 | Jung, Mi-Hee The red light emission in 2D (C<sub>4</sub>SH<sub>3</sub>CH<sub>2</sub>NH<sub>3</sub>)<sub>2</sub>SnI<sub>4</sub> and (C<sub>4</sub>OH<sub>7</sub>CH<sub>2</sub>NH<sub>3</sub>)<sub>2</sub>SnI<sub>4</sub> perovskites. Dalton transactions (Cambridge, England : 2003), 2021, 50, 10261-10274 |
4129065 | CIF | C10 H16 N O | P b c a | 12.98637; 11.75812; 11.72942 90; 90; 90 | 1791.03 | Dragulescu-Andrasi, Alina; Filatov, Alexander S.; Oakley, Richard T.; Li, Xiang; Lekin, Kristina; Huq, Ashfia; Pak, Chongin; Greer, Samuel M.; McKay, Johannes; Jo, Minyoung; Lengyel, Jeff; Hung, Ivan; Maradzike, Elvis; DePrince, A. Eugene; Stoian, Sebastian A.; Hill, Stephen; Hu, Yan-Yan; Shatruk, Michael Radical Dimerization in Plastic Organic Crystal Leads to Structural and Magnetic Bistability with Wide Thermal Hysteresis. Journal of the American Chemical Society, 2019 |
7240421 | CIF | C10 H16 N12 O16 S | P b c a | 16.135; 12.819; 20.762 90; 90; 90 | 4294.3 | Pan, Bochen; Wang, Zhanzhong; Shen, Yichun; Wei, Liangxiao; Wei, Hongyuan; Dang, Leping Solvatomorphism and Phase Transformation of CL-20: Probing Properties and Investigating Mechanisms CrystEngComm, 2020 |
2235644 | CIF HKL Paper | C10 H16 N2 Ni O8 S | P b c a | 12.3035; 11.656; 20.7112 90; 90; 90 | 2970.2 | Boonlue, Sujirat; Theppitak, Chatphorn; Chainok, Kittipong Tetraaqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')nickel(II) sulfate Acta Crystallographica Section E, 2012, 68, m908 |
2012961 | CIF HKL Paper | C10 H16 N2 O2 S2 | P b c a | 14.991; 10.633; 15.064 90; 90; 90 | 2401.2 | Fujihara, Takashi; Ohba, Takeshi; Nagasawa, Akira; Nakayama, Juzo; Yoza, Kenji The stable inner salt 2,2-dimorpholino-2-ethylium-1-dithioate Acta Crystallographica Section C, 2002, 58, o558-o559 |
2015230 | CIF Paper | C10 H16 N2 S2 | P b c a | 8.484; 11.5018; 23.992 90; 90; 90 | 2341.2 | Boris Shivachev; Rosica Petrova; Marin Marinov; Neyko Stoyanov; Anife Ahmedova; Mariana Mitewa Four cycloalkanespiro-4'-imidazolidine-2',5'-dithiones Acta Crystallographica Section C, 2006, 62, o211-o215 |
1501759 | CIF | C10 H16 N6 O4 | P b c a | 16.138; 7.0036; 22.75 90; 90; 90 | 2571.3 | Lee, Jong Hoon; Naumov, Pance; Chung, Ihn Hee; Lee, Sang Cheol Solid-state thermochromism and phase transitions of charge transfer 1,3-diamino-4,6-dinitrobenzene dyes. The journal of physical chemistry. A, 2011, 115, 10087-10096 |
7004357 | CIF | C10 H16 O2 Si2 | P b c a | 7.1274; 12.8608; 27.091 90; 90; 90 | 2483.3 | Harrison, Daniel J.; Edwards, David R.; McDonald, Robert; Rosenberg, Lisa Toward selective functionalisation of oligosilanes: borane-catalysed dehydrogenative coupling of silanes with thiols Dalton Transactions, 2008, 3401-3411 |
4026972 | CIF | C10 H16 O4 | P b c a | 10.477; 15.019; 13.2317 90; 90; 90 | 2082.1 | Alexander O. Terent'ev; Ivan A. Yaremenko; Vladimir V. Chernyshev; Valery M. Dembitsky; Gennady I. Nikishin Selective Synthesis of Cyclic Peroxides from Triketones and H2O2 Journal of Organic Chemistry, 2012, 77, 1833-1842 |
4003443 | CIF | C10 H17 Br Cd N4 S3 | P b c a | 18.702; 17.0024; 10.8512 90; 90; 90 | 3450.5 | He, Lei; Zhou, Lin; Shi, Ping-Ping; Ye, Qiong; Fu, Da-Wei One-Dimensional Cadmium Thiocyanate Perovskite Ferroelastics Tuned by Halogen Substitution Chemistry of Materials, 2019 |
4003447 | CIF | C10 H17 Cd Cl N4 S3 | P b c a | 18.4818; 17.0544; 10.8438 90; 90; 90 | 3417.9 | He, Lei; Zhou, Lin; Shi, Ping-Ping; Ye, Qiong; Fu, Da-Wei One-Dimensional Cadmium Thiocyanate Perovskite Ferroelastics Tuned by Halogen Substitution Chemistry of Materials, 2019 |
4003444 | CIF | C10 H17 Cd F N4 S3 | P b c a | 17.8302; 17.2839; 10.7115 90; 90; 90 | 3301.02 | He, Lei; Zhou, Lin; Shi, Ping-Ping; Ye, Qiong; Fu, Da-Wei One-Dimensional Cadmium Thiocyanate Perovskite Ferroelastics Tuned by Halogen Substitution Chemistry of Materials, 2019 |
4505895 | CIF | C10 H17 Cl Cu N3 | P b c a | 9.1026; 13.6901; 20.269 90; 90; 90 | 2525.8 | Laus, Gerhard; Bentivoglio, Gino; Kahlenberg, Volker; Wurst, Klaus; Nauer, Gerhard; Schottenberger, Herwig; Tanaka, Masato; Siehl, Hans-Ullrich Conformational Flexibility and Cation‒Anion Interactions in 1-Butyl-2,3-dimethylimidazolium Salts Crystal Growth & Design, 2012, 12, 1838 |
4066440 | CIF | C10 H17 Cl N2 O3 Si2 | P b c a | 11.19; 13.114; 19.667 90; 90; 90 | 2886 | Kertsnus-Banchik, Evgenia; Gostevskii, Boris; Botoshansky, Mark; Kalikhman, Inna; Kost, Daniel Dinuclear Silicon Complexes of Uracil, Barbituric Acid, and 5,5-Dimethylbarbituric Acid: Hydrolytic Formation of Cyclic Oligomers(1)† Organometallics, 2010, 29, 5435 |
7048564 | CIF | C10 H17 Cu N3 O9 S | P b c a | 21.9238; 6.6867; 22.2697 90; 90; 90 | 3264.7 | Mahmoud, Abdallah G.; Guedes da Silva, M Fátima C; Mahmudov, Kamran T.; Pombeiro, Armando J. L. Arylhydrazone ligands as Cu-protectors and -catalysis promoters in the azide-alkyne cycloaddition reaction. Dalton transactions (Cambridge, England : 2003), 2019, 48, 1774-1785 |
4348774 | CIF | C10 H17 Cu4 I6 N3 O | P b c a | 8.3751; 18.7073; 32.532 90; 90; 90 | 5097 | Shen, Jun-Ju; Li, Xiang-Xia; Yu, Tan-Lai; Wang, Feng; Hao, Peng-Fei; Fu, Yun-Long Ultrasensitive Photochromic Iodocuprate(I) Hybrid. Inorganic chemistry, 2016, 55, 8271-8273 |
4348775 | CIF | C10 H17 Cu4 I6 N3 O | P b c a | 8.3567; 18.6751; 32.4747 90; 90; 90 | 5068.1 | Shen, Jun-Ju; Li, Xiang-Xia; Yu, Tan-Lai; Wang, Feng; Hao, Peng-Fei; Fu, Yun-Long Ultrasensitive Photochromic Iodocuprate(I) Hybrid. Inorganic chemistry, 2016, 55, 8271-8273 |
2011178 | CIF HKL Paper | C10 H17 La O10 | P b c a | 16.4027; 8.76805; 19.5576 90; 90; 90 | 2812.77 | Benmerad, Belkacem; Guehria-Laidoudi, Achoura; Balegroune, Fadila; Birkedal, Henrik; Chapuis, Gervais Polymeric aqua(glutarato)(hydrogen glutarato)lanthanum(III) monohydrate Acta Crystallographica Section C, 2000, 56, 789-792 |
7157849 | CIF | C10 H17 N O2 S | P b c a | 8.0303; 9.6259; 27.807 90; 90; 90 | 2149.45 | Palate, Kleopas Y.; Epton, Ryan G.; Whitwood, Adrian C.; Lynam, Jason M.; Unsworth, William P. Synthesis of macrocyclic and medium-sized ring thiolactones <i>via</i> the ring expansion of lactams. Organic & biomolecular chemistry, 2021, 19, 1404-1411 |
7152901 | CIF | C10 H17 N O3 | P b c a | 13.826; 9.5792; 16.063 90; 90; 90 | 2127.4 | Li, Guang; Zhang, Xun; Li, Qi; Feng, Pengju; Shi, Yian A concise approach to the spiroiminal fragment of marineosins. Organic & biomolecular chemistry, 2013, 11, 2936-2938 |
7246752 | CIF | C10 H17 N O6 | P b c a | 9.8806; 9.6156; 25.364 90; 90; 90 | 2409.8 | Zhou, Fuli; Body, Carole; Robeyns, Koen; Leyssens, Tom; Shemchuk, Oleksii On the pairwise cocrystallization of racemic compounds CrystEngComm, 2023, 25, 3060-3065 |
4110233 | CIF | C10 H17 N3 O3 S | P b c a | 14.501; 12.686; 47.584 90; 90; 90 | 8754 | Matthew J. Horner; K. Travis Holman; Michael D. Ward Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders Journal of the American Chemical Society, 2007, 129, 14640-14660 |
8100886 | CIF | C10 H18 Br N2 O3 Re | P b c a | 14.496; 13.338; 14.722 90; 90; 90 | 2846.3 | Horn, E.; Onai, S. Crystal structure of aquo-(N,N,N',N'-1,1,4,4-tetramethylethenediamine)- tricarbonyl-manganese(I) tetrafluoroborate, [(H~2~O)(CO)~3~(C~6~H~16~N~2~)Mn](BF~4~) Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 73-76 |
4127410 | CIF | C10 H18 Cl2 Sn2 | P b c a | 6.626; 19.1358; 24.4346 90; 90; 90 | 3098.2 | Hicks, Jamie; Vasko, Petra; Goicoechea, Jose M.; Aldridge, Simon Reversible, Room-Temperature C-C Bond Activation of Benzene by an Isolable Metal Complex. Journal of the American Chemical Society, 2019, 141, 11000-11003 |
2014798 | CIF HKL Paper | C10 H18 Co N13 O7 | P b c a | 9.1229; 12.098; 32.8793 90; 90; 90 | 3628.9 | Sharma, Raj Pal; Sharma, Rajni; Bala, Ritu; Bond, Andrew D. Second-sphere coordination in anion binding: <i>cis</i>-diazidobis(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')cobalt(III) picrate Acta Crystallographica Section C, 2005, 61, m272-m274 |
2001433 | CIF Paper | C10 H18 N2 Na2 O10 | P b c a | 15.945; 9.845; 8.912 90; 90; 90 | 1399 | Font-Bardia, M.; Solans, X.; Font-Altaba, M. Sodium ion complexes with ethylenediaminetetraacetic acid Acta Crystallographica Section C, 1993, 49, 1452-1456 |
8101675 | CIF | C10 H18 N4 O2 | P b c a | 14.775; 5.222; 15.604 90; 90; 90 | 1203.9 | M. Królikowska; J. Garbarczyk Crystal structures of 1,4-di(1-imidazolyl)butane dihydrochloride, (C~10~H~16~N~4~)Cl~2~, and 1,4-di(1-imidazolyl)butane dihydrate, C~10~H~14~N~4~ · 2H~2~O Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 103-104 |
1100165 | CIF | C10 H18 N8 O8 Zn | P b c a | 7.543; 13.1384; 17.2599 90; 90; 90 | 1710.5 | Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Polyhedron, 2004, 23, 743-747 |
4322474 | CIF | C10 H18 O S4 | P b c a | 15.211; 8.5113; 20.548 90; 90; 90 | 2660.3 | Ksenia Krylova; Chandrika P. Kulatilleke; Mary Jane Heeg; Cynthia A. Salhi; L. A. Ochrymowycz; D. B. Rorabacher A Structural Strategy for Generating Rapid Electron-Transfer Kinetics in Copper(II/I) Systems Inorganic Chemistry, 1999, 38, 4322-4328 |
7708498 | CIF | C10 H18 O5 | P b c a | 10.5546; 8.3898; 23.5993 90; 90; 90 | 2089.7 | Arp, Fabian Felix; Ashirov, Rahym; Bhuvanesh, Nattamai; Bluemel, Janet Di(hydroperoxy)adamantane Adducts: Synthesis, Characterization and Application as Oxidizers for the Direct Esterification of Aldehydes Dalton Transactions, 2021 |
4020156 | CIF | C10 H19 B F3 N | P b c a | 10.6045; 11.0631; 19.7482 90; 90; 90 | 2316.8 | Yun Ma; Emil Lobkovsky; David B. Collum Journal of Organic Chemistry, 2005, 70, 2335-2337 |
4514437 | CIF | C10 H19 B10 N O | P b c a | 9.4145; 16.7722; 20.1088 90; 90; 90 | 3175.2 | Baek, Yonghyeon; Kim, Suhui; Son, Jeong-Yu; Lee, Kooyeon; Kim, Dongwook; Lee, Phil Ho Rhodium-Catalyzed Amidation of the Cage B(4)‒H Bond in o-Carboranes with Dioxazolones by Carboxylic Acid-Assisted B(4)‒H Bond Activation ACS Catalysis, 2019, 10418 |
2007925 | CIF Paper | C10 H19 Co N4 O4 | P b c a | 13.4327; 13.1953; 16.7801 90; 90; 90 | 2974.25 | Mareque Rivas, Juan C.; Brammer, Lee N—H···N, N-H···O and N-H···π~CO~ Hydrogen Bonding in [<i>N</i>,<i>N</i>-Bis(2-aminoethyl)-2-aminoethyl]ammonium Tetracarbonylcobaltate(1-) Acta Crystallographica Section C, 1998, 54, 1799-1802 |
2227972 | CIF HKL Paper | C10 H19 Dy N2 O11 | P b c a | 13.3835; 13.0127; 18.6943 90; 90; 90 | 3255.7 | Zhuang, Xiaomei; Long, Qingping; Wang, Jun Poly[[[μ~3~-<i>N</i>'-(carboxymethyl)ethylenediamine-<i>N</i>,<i>N</i>,<i>N</i>'-triacetato]dysprosium(III)] trihydrate] Acta Crystallographica Section E, 2010, 66, m1436 |
4077173 | CIF | C10 H19 Fe N3 O4 Si | P b c a | 14.112; 14.793; 15.233 90; 90; 90 | 3180 | Braunstein, Pierre; Veith, Michael; Blin, Joël; Huch, Volker New Mono- and Polynuclear Iron Silylene and Stannylene Complexes Organometallics, 2001, 20, 627 |
4113581 | CIF | C10 H19 N O4 | P b c a | 8.412; 9.589; 28.063 90; 90; 90 | 2263.6 | Leif Häggman; Cecilia Lindblad; Hans Oskarsson; Ann-Sofi Ullström; Ingmar Persson The Influence of Short Strong Hydrogen Bonding on the Structure and the Physicochemical Properties of Alkyl-N-iminodiacetic Acids in Solid State and Aqueous Systems Journal of the American Chemical Society, 2003, 125, 3631-3641 |
2202540 | CIF HKL Paper | C10 H19 N O9 | P b c a | 11.3774; 12.4823; 18.437 90; 90; 90 | 2618.4 | Chen, Can-Yu; Wei, Zan-Bin; Zhou, Zhao-Hui; Ng, Seik Weng Morpholinium dihydrogen citrate hydrate Acta Crystallographica Section E, 2003, 59, o1030-o1032 |
2239982 | CIF HKL Paper | C10 H19 N3 S | P b c a | 13.6668; 8.3356; 21.4683 90; 90; 90 | 2445.7 | Yamin, Bohari M.; Rodis, Monica Lulo; Chee, Dayang N. B. A Crystal structure of 4-cyclohexyl-1-(propan-2-ylidene)thiosemicarbazide Acta Crystallographica Section E, 2014, 70, o1109 |
2000793 | CIF Paper | C10 H2 F12 | P b c a | 9.203; 9.81; 12.705 90; 90; 90 | 1147 | Lynch, V. M.; Kampa, J. J.; Lagow, R. J.; Davis, B. E. Structure of 1,2,4,5-tetrakis(trifluoromethyl)benzene Acta Crystallographica Section C, 1992, 48, 1339-1341 |
4321341 | CIF | C10 H20 B F4 S6 Tc | P b c a | 12.233; 14.341; 20.726 90; 90; 90 | 3636 | Gregory E. D. Mullen; Philip J. Blower; Daniel J. Price; Anne K. Powell; Mark J. Howard; Michael J. Went Trithiacyclononane as a Ligand for Potential Technetium and Rhenium Radiopharmaceuticals: Synthesis of [M(9S3)(SC2H4SC2H4S)][BF4] (M =99Tc, Re, 188Re) via C-S Bond Cleavage Inorganic Chemistry, 2000, 39, 4093-4098 |
1559844 | CIF | C10 H20 B P | P b c a | 9.2496; 10.5381; 21.9181 90; 90; 90 | 2136.43 | Resendiz-Lara, Diego A.; Annibale, Vincent T.; Knights, Alastair W.; Chitnis, Saurabh S.; Manners, Ian High Molar Mass Poly(alkylphosphinoboranes) via Iron-Catalyzed Dehydropolymerization Macromolecules, 2020 |
7116995 | CIF | C10 H20 B10 | P b c a | 24.322; 8.2628; 15.382 90; 90; 90 | 3091.3 | Ke Cao; Yawen Huang; Junxiao Yang; Ji Wu Palladium catalyzed selective mono-arylation of o-carboranes via B-H activation Chem.Commun., 2015, 51, 7257 |
7111438 | CIF | C10 H20 Cl N2 Sb | P b c a | 11.5242; 10.9946; 21.098 90; 90; 90 | 2673.2 | Gudat, Dietrich; Gans-Eichler, Timo; Nieger, Martin Synthesis and unprecedented oxidation of a cationic Sb-analogue of an Arduengo's carbene Chemical Communications, 2004, 2434-2435 |
7012413 | CIF | C10 H20 Cl2 Hg N2 O9 S2 | P b c a | 7.94; 15.503; 31.611 90; 90; 90 | 3891.1 | Caltagirone, Claudia; Bencini, Andrea; Demartin, Francesco; Devillanova, Francesco A.; Garau, Alessandra; Isaia, Francesco; Lippolis, Vito; Mariani, Palma; Papke, Ulrich; Tei, Lorenzo; Verani, Gaetano Redox chemosensors: coordination chemistry towards CuII, ZnII, CdII, HgII, and PbII of 1-aza-4,10-dithia-7-oxacyclododecane ([12]aneNS2O) and its N-ferrocenylmethyl derivativeElectronic supplementary information (ESI) available: synthetic details including analytical and spectroscopic data for the isolated complexes. Ortep views of the coordination sphere around the metal centres in 1, 2 and 5. See http://www.rsc.org/suppdata/dt/b2/b210806m/ Dalton Transactions, 2003, 901 |
7242315 | CIF | C10 H20 I2 N2 | P b c a | 13.3082; 11.9672; 17.9425 90; 90; 90 | 2857.6 | Mezentsev-Cherkes, Ivan A.; Shestimerova, Tatiana A.; Medved'ko, Aleksei V.; Kalinin, Mikhail A.; Kuznetsov, Alexey N.; Wei, Zheng; Dikarev, Evgeny V.; Vatsadze, Sergey Z.; Shevelkov, Andrei V. Synthesis and supramolecular organization of the iodide and triiodides of a polycyclic adamantane-based diammonium cation: the effects of hydrogen bonds and weak I⋯I interactions CrystEngComm, 2021, 23, 2384-2395 |
7128004 | CIF | C10 H20 N2 Na2 O10 | P b c a | 9.9072; 8.9556; 15.9942 90; 90; 90 | 1419.08 | Zheng, Haoyue; Wang, Yanying; Cao, Peisheng; Wu, Peng Color-tunable ultralong room temperature phosphorescence from EDTA. Chemical communications (Cambridge, England), 2021, 57, 3575-3578 |
7041996 | CIF | C10 H20 N2 O2 Si2 | P b c a | 11.2602; 11.054; 23.4337 90; 90; 90 | 2916.8 | Finger, Lars H.; Venker, Alexander; Schröder, Fabian G; Sundermeyer, Jörg New lithium borates with bistetrazolato(2-) and pyrazinediolato(2-) ligands - potentially interesting lithium electrolyte additives. Dalton transactions (Cambridge, England : 2003), 2017, 46, 3014-3024 |
4125573 | CIF | C10 H20 N2 Se | P b c a | 11.4233; 10.80265; 18.95402 90; 90; 90 | 2338.96 | Campos, Michael P.; Hendricks, Mark P.; Beecher, Alexander N.; Walravens, Willem; Swain, Robert A.; Cleveland, Gregory T.; Hens, Zeger; Sfeir, Matthew Y.; Owen, Jonathan S. A Library of Selenourea Precursors to PbSe Nanocrystals with Size Distributions near the Homogeneous Limit. Journal of the American Chemical Society, 2017, 139, 2296-2305 |
2020290 | CIF HKL Paper | C10 H20 O7 P2 | P b c a | 9.8434; 11.3589; 26.6986 90; 90; 90 | 2985.18 | Said, Musa A.; Ali, Adeeb Al-Sheikh; Hughes, David L. A new route for the synthesis of phosphate esters: 2,2'-[benzene-1,2-diylbis(oxy)]bis(5,5-dimethyl-1,3,2-dioxaphosphinane) 2,2'-dioxide Acta Crystallographica Section C, 2015, 71 |
7029344 | CIF | C10 H21 B9 S | P b c a | 12.6418; 14.1465; 17.4999 90; 90; 90 | 3129.6 | Zakharova, Maria V.; Sivaev, Igor B.; Anufriev, Sergey A.; Timofeev, Sergey V.; Suponitsky, Kyrill Yu; Godovikov, Ivan A.; Bregadze, Vladimir I. A new approach to the synthesis of functional derivatives of nido-carborane: alkylation of [9-MeS-nido-7,8-C2B9H11](-). Dalton transactions (Cambridge, England : 2003), 2014, 43, 5044-5053 |
8103230 | CIF | C10 H21 F3 N2 O3 S Si2 | P b c a | 14.6136; 12.5955; 19.9486 90; 90; 90 | 3671.9 | Carmen Froschauer; Klaus Wurst; Gerhard Laus; Herwig Schottenberger Crystal structure of 1,3-bis(trimethylsilyl)imidazolium trifluoromethanesulfonate, (C9H21N2Si2)(CF3SO3) Zeitschrift für Kristallographie - New Crystal Structures, 2011, 226, 545 |
4112932 | CIF | C10 H21 Fe N4 O2 S2 | P b c a | 16.448; 12.384; 28.996 90; 90; 90 | 5906 | Chao-Yi Chiang; Matthew L. Miller; Joseph H. Reibenspies; Marcetta Y. Darensbourg Bismercaptoethanediazacyclooctane as a N2S2 Chelating Agent and Cys-X-Cys Mimic for Fe(NO) and Fe(NO)2 Journal of the American Chemical Society, 2004, 126, 10867-10874 |
4331217 | CIF | C10 H22 B11 N | P b c a | 12.6628; 14.1099; 18.2836 90; 90; 90 | 3266.7 | Jian Zhang; Zuowei Xie Reaction of 13-Vertex Carborane μ-1,2-(CH2)3-1,2-C2B11H11 with Nucleophiles: Scope and Mechanism Inorganic Chemistry, 2012, 51, 12976-12987 |
4519373 | CIF | C10 H22 Br2 Cu N | P b c a | 13.832; 12.061; 17.097 90; 90; 90 | 2852.25 | Xu, Tingting; Li, Yunyun; Nikl, Martin; Kucerkova, Romana; Zhou, Zhengyang; Chen, Jie; Sun, Yi-Yang; Niu, Guangda; Tang, Jiang; Wang, Qian; Ren, Guohao; Wu, Yuntao Lead-Free Zero-Dimensional Organic-Copper(I) Halides as Stable and Sensitive X-ray Scintillators. ACS applied materials & interfaces, 2022, 14, 14157-14164 |
7231369 | CIF | C10 H22 Br2 Cu N2 O2 | P b c a | 6.68836; 12.3506; 35.1567 90; 90; 90 | 2904.13 | Mardani, Zahra; Kazemshoar-Duzduzani, Reza; Moeini, Keyvan; Hajabbas-Farshchi, Alireza; Carpenter-Warren, Cameron; Slawin, Alexandra M. Z.; Woollins, J. Derek Anticancer activities of a β-amino alcohol ligand and nanoparticles of its copper(ii) and zinc(ii) complexes evaluated by experimental and theoretical methods RSC Advances, 2018, 8, 28810 |
7231368 | CIF | C10 H22 Cl2 Cu N2 O2 | P b c a | 6.63584; 11.8221; 34.9929 90; 90; 90 | 2745.18 | Mardani, Zahra; Kazemshoar-Duzduzani, Reza; Moeini, Keyvan; Hajabbas-Farshchi, Alireza; Carpenter-Warren, Cameron; Slawin, Alexandra M. Z.; Woollins, J. Derek Anticancer activities of a β-amino alcohol ligand and nanoparticles of its copper(ii) and zinc(ii) complexes evaluated by experimental and theoretical methods RSC Advances, 2018, 8, 28810 |
2019201 | CIF Paper | C10 H22 Cl4 N2 Zn | P b c a | 11.3673; 9.5997; 28.6571 90; 90; 90 | 3127.14 | Soudani, Sarra; Aubert, Emmanuel; Jelsch, Christian; Ben Nasr, Cherif The organic‒inorganic hybrid material 1-cyclohexylpiperazine-1,4-diium tetrachloridozincate Acta Crystallographica Section C, 2013, 69, 1304-1306 |
2219233 | CIF HKL Paper | C10 H22 Co N6 O3 S2 | P b c a | 14.1128; 15.3684; 15.9839 90; 90; 90 | 3466.8 | Shang, Wei-Li; Bai, Yan; Ma, Chao-Zhong; Li, Zhi-Min Aqua(hexamethylenetetramine-κ<i>N</i>)bis(methanol-κ<i>O</i>)bis(thiocyanato-κ<i>N</i>)cobalt(II) Acta Crystallographica Section E, 2008, 64, m1184-m1185 |
4519113 | CIF | C10 H22 Mn N2 O2 S4 | P b c a | 15.2336; 16.3399; 13.8528 90; 90; 90 | 3448.2 | Alanazi, Abdulaziz M.; McNaughter, Paul D.; Alam, Firoz; Vitorica-Yrezabal, Inigo J; Whitehead, George F. S.; Tuna, Floriana; O'Brien, Paul; Collison, David; Lewis, David J. Structural Investigations of α-MnS Nanocrystals and Thin Films Synthesized from Manganese(II) Xanthates by Hot Injection, Solvent-Less Thermolysis, and Doctor Blade Routes. ACS omega, 2021, 6, 27716-27725 |
4328351 | CIF | C10 H22 Mo6 N2 O47.5 P4 Rb0.75 | P b c a | 18.409; 16.856; 36.26 90; 90; 90 | 11252 | Hani El Moll; Anne Dolbecq; Israël Martyr Mbomekalle; Jérôme Marrot; Philippe Deniard; Rémi Dessapt; Pierre Mialane Tuning the Photochromic Properties of Molybdenum Bisphosphonate Polyoxometalates Inorganic Chemistry, 2012, 51, 2291-2302 |
2215673 | CIF HKL Paper | C10 H22 N6 Ni O3 S2 | P b c a | 14.069; 15.312; 16.036 90; 90; 90 | 3454.5 | Bai, Yan; Shang, Wei-Li; Zhang, Fu-Lian; Pan, Xiao-Jing; Niu, Xiao-Fang Aqua(hexamethylenetetramine-κ<i>N</i>)bis(methanol)bis(thiocyanato-κ<i>N</i>)nickel(II) Acta Crystallographica Section E, 2007, 63, m2628-m2628 |
7023833 | CIF | C10 H23 Br2 Mg N2 O | P b c a | 11.4772; 12.3357; 22.48 90; 90; 90 | 3182.7 | Xue, Fei; Zhao, Jin; Hor, T. S. Andy Cross-coupling of alkyl halides with aryl or alkyl Grignards catalyzed by dinuclear Ni(II) complexes containing functionalized tripodal amine-pyrazolyl ligands. Dalton transactions (Cambridge, England : 2003), 2013, 42, 5150-5158 |
4310375 | CIF | C10 H23 F4 I N2 Pt | P b c a | 13.9073; 14.3578; 15.9653 90; 90; 90 | 3187.9 | Russell P. Hughes; Monique A. Meyer; Mark D. Tawa; Antony J. Ward; Alex Williamson; Arnold L. Rheingold; Lev N. Zakharov Does α-Fluorination Affect the Structural trans-Influence and Kinetic trans-Effect of an Alkyl Ligand? Molecular Structures of Pd(TMEDA)(CH3)(RF) and a Kinetic Study of the trans to cis Isomerization of Pt(TMEDA)(CH3)2I(RF) [RF= CF2CF3, CFHCF3, CH2CF3] Inorganic Chemistry, 2004, 43, 747-756 |
7213046 | CIF | C10 H23 N O4 | P b c a | 16.008; 15.932; 9.647 90; 90; 90 | 2460.4 | Dega-Szafran, Zofia; Katrusiak, Andrzej; Szafran, Mirosław Conformations of, and NHO hydrogen bond in, piperidine-1-valeric acid and its dihydrate Journal of the Chemical Society, Perkin Transactions 2, 1999, 1967 |
4342810 | CIF | C10 H24 B10 Os | P b c a | 7.7693; 14.0374; 29.9826 90; 90; 90 | 3269.9 | Simonov, Alexandr N.; Boas, John F.; Skidmore, Melissa A.; Forsyth, Craig M.; Mashkina, Elena; Bown, Mark; Bond, Alan M. Redox Levels of a closo-Osmaborane: A Density Functional Theory, Electron Paramagnetic Resonance and Electrochemical Study. Inorganic chemistry, 2015, 54, 4292-4302 |
4072124 | CIF | C10 H24 B9 Fe N S | P b c a | 9.441; 15.717; 22.341 90; 90; 90 | 3315.1 | Perekalin, Dmitry S.; Glukhov, Ivan V.; Holub, Josef; Císařova, Ivana; Štíbr, Bohumil; Kudinov, Alexander R. Iron and Cobalt Complexes with Thiacarborane Ligands Organometallics, 2008, 27, 5273 |
7229541 | CIF | C10 H24 Br4 Cd N2 | P b c a | 12.421; 13.319; 24.209 90; 90; 90 | 4005 | Sun, Xiao-Fen; Wang, Zhongxia; Liao, Wei-Qiang; Li, Peng-Fei; Gao, Jixing; Huang, Yi-Yang; Chen, Hai-Peng; Ye, Heng-Yun; Zhang, Yi Modulating molecular structures and dielectric transitions in organic‒inorganic hybrid crystals RSC Advances, 2017, 7, 52024 |
4115996 | CIF | C10 H24 Cl2 Fe N5 O5 | P b c a | 13.01; 10.853; 23.692 90; 90; 90 | 3345.3 | Christina Hauser; Thorsten Glaser; Eckhard Bill; Thomas Weyhermüller; Karl Wieghardt The Electronic Structures of an Isostructural Series of Octahedral Nitrosyliron Complexes {Fe-NO}6,7,8 Elucidated by Mössbauer Spectroscopy Journal of the American Chemical Society, 2000, 122, 4352-4365 |
4116783 | CIF | C10 H24 Cl2 Mn N5 O4 | P b c a | 13.101; 10.896; 23.203 90; 90; 90 | 3312.2 | Karsten Meyer; Jesper Bendix; Nils Metzler-Nolte; Thomas Weyhermüller; Karl Wieghardt Nitridomanganese(V) and -(VI) Complexes Containing Macrocyclic Amine Ligands Journal of the American Chemical Society, 1998, 120, 7260-7270 |
4033824 | CIF | C10 H24 Cl2 N2 S2 | P b c a | 8.8079; 10.9869; 31.112 90; 90; 90 | 3010.8 | Taschner, Ian S.; Walker, Tia L.; DeHaan, Hunter S.; Schrage, Briana R.; Ziegler, Christopher J.; Taschner, Michael J. Synthesis, Characterization, and Copper(II) Chelates of 1,11-Dithia-4,8-diazacyclotetradecane. The Journal of organic chemistry, 2019, 84, 11091-11102 |
7013713 | CIF | C10 H24 Cl2 N4 Ni O8 | P b c a | 14.4256; 15.3904; 16.1714 90; 90; 90 | 3590.3 | Boiocchi, Massimo; Bonizzoni, Marco; Fabbrizzi, Luigi; Foti, Francesco; Licchelli, Maurizio; Taglietti, Angelo; Zema, Michele The influence of the boat-to-chair conversion on the demetallation of the nickel(II) complex of an open-chain tetramine containing a piperazine fragment. Dalton transactions (Cambridge, England : 2003), 2004, 653-658 |
4349909 | CIF | C10 H24 Cl4 Mn N2 | P b c a | 12.0944; 12.6583; 23.3484 90; 90; 90 | 3574.5 | Wei, Yan-Li; Jing, Jing; Shi, Chao; Ye, Heng-Yun; Wang, Zhong-Xia; Zhang, Yi High quantum yield and unusual photoluminescence behaviour in tetrahedral manganese(ii) based on hybrid compounds Inorganic Chemistry Frontiers, 2018, 5, 2615 |
7702793 | CIF | C10 H24 Cl8 S4 Zr2 | P b c a | 15.8646; 15.4382; 21.6118 90; 90; 90 | 5293.18 | Hart, Richard; Levason, William; Patel, Bhavesh; Reid, Gillian Synthesis, properties and crystal structures of 6-, 7- and 8-coordinate Zr(iv) and Hf(iv) complexes involving thioether and selenoether ligands Journal of the Chemical Society, Dalton Transactions, 2002, 3153 |
7041065 | CIF | C10 H24 Mn N4 O10 | P b c a | 13.4; 13.881; 17.5344 90; 90; 90 | 3261.49 | Frost, Jamie M.; Kettles, Fraser J.; Wilson, Claire; Murrie, Mark Rational serendipity: "undirected" synthesis of a large {MnCu} complex from pre-formed Mn(II) building blocks. Dalton transactions (Cambridge, England : 2003), 2016, 45, 18094-18097 |
7229539 | CIF | C10 H24.05 Br4 Cd N2.05 | P b c a | 12.409; 13.23; 23.79 90; 90; 90 | 3906 | Sun, Xiao-Fen; Wang, Zhongxia; Liao, Wei-Qiang; Li, Peng-Fei; Gao, Jixing; Huang, Yi-Yang; Chen, Hai-Peng; Ye, Heng-Yun; Zhang, Yi Modulating molecular structures and dielectric transitions in organic‒inorganic hybrid crystals RSC Advances, 2017, 7, 52024 |
4347362 | CIF | C10 H25 B9 Rh | P b c a | 19.8685; 14.4875; 24.6277 90; 90; 90 | 7089 | Roy, Dipak Kumar; Borthakur, Rosmita; Prakash, Rini; Bhattacharya, Somnath; Jagan, Rajamony; Ghosh, Sundargopal Hypoelectronic 8-11-Vertex Irida- and Rhodaboranes. Inorganic chemistry, 2016, 55, 4764-4770 |
7244217 | CIF | C10 H25 Cl2 Co N5 | P b c a | 14.5128; 12.7676; 32.102 90; 90; 90 | 5948.3 | Shircliff, Anthony D.; Allbritton, Elisabeth M. A.; Davilla, Dustin J.; Gorbet, Michael-Joseph; Jones, Donald G.; Tresp, David S.; Allen, Michael B.; Shrestha, Alina; Burgess, Gwendolyn E.; Eze, John I.; Fernandez, Andrea T.; Ramirez, Daniel; Shoff, Kody J.; Crispin, Garet G.; Crone, Sarah B.; Flinn, Michael; Tran, Tien; Bryce, Darby S.; Bond, Abbagale L.; Shockey, Dylan W.; Oliver, Allen G.; Krause, Jeanette A.; Prior, Timothy J.; Hubin, Timothy J. Expanding and quantifying the crystal chemistry of the flexible ligand 15aneN5 CrystEngComm, 2022, 24, 1218-1236 |
2022162 | CIF HKL | C10 H25 Cl2 Co N6 O7 | P b c a | 11.5455; 11.8865; 25.3868 90; 90; 90 | 3484 | Arderne, Charmaine; Batchelor, Kyle Fraser; Uprety, Bhawna; Chandran, Rahul; Abrahamse, Heidi Reactivity trends of cobalt(III) complexes towards various amino acids based on the properties of the amino acid alkyl chains Acta Crystallographica Section C, 2020, 76 |
4313584 | CIF | C10 H26 B12 S2 | P b c a | 13.3469; 11.8991; 23.7024 90; 90; 90 | 3764.3 | Roman G. Kultyshev; Shengming Liu; Hoitung T. Leung; Jianping Liu; Sheldon G. Shore Synthesis of Mono- and Dihalogenated Derivatives of (Me2S)2B12H10 and Palladium-Catalyzed Boron-Carbon Cross-Coupling Reactions of the Iodides with Grignard Reagents Inorganic Chemistry, 2003, 42, 3199-3207 |
4331952 | CIF | C10 H26 Cl N4 O6 Pt Tl | P b c a | 10.234; 11.654; 34.629 90; 90; 90 | 4130 | Chen, Wanzhi; Liu, Fenghui; Xu, Duanjun; Matsumoto, Kazuko; Kishi, Shinobu; Kato, Masako Luminescent Amidate-Bridged One-Dimensional Platinum(II)−Thallium(I) Coordination Polymers Assembled via Metallophilic Attraction Inorganic Chemistry, 2006, 45, 5552-5560 |
8102277 | CIF | C10 H26 Cl6 Cu3 N2 O6 | P b c a | 11.1814; 11.4383; 18.8671 90; 90; 90 | 2413.03 | Leonore Wiehl; Jürgen Schreuer; Eiken Haussühl; Peggy Hofmann Crystal structure of diaquabis(m-betaine-O,O')tris-(copper(II) dichloride), (C5H11NO2)2 · 3CuCl2 · 2H2O Zeitschrift für Kristallographie - New Crystal Structures, 2008, 223, 487 |
7012569 | CIF | C10 H27 Ga I2 Si3 | P b c a | 13.4567; 11.788; 24.308 90; 90; 90 | 3855.9 | Uhl, Werner; El-Hamdan, Abdelhakim; Prött, Malte; Spuhler, Philipp; Frenking, Gernot Ga2I2[C(SiMe3)3]2 ‒ an organogallium(ii) halide containing a Ga‒Ga single bond Dalton Transactions, 2003, 1360 |
2019923 | CIF HKL Paper | C10 H28 Br2 Cl Cr N4 O4 | P b c a | 20.656; 17.666; 31.305 90; 90; 90 | 11423 | Moon, Dohyun; Choi, Jong-Ha Synthesis, crystal structure and spectroscopic properties of <i>trans</i>-dibromidobis(2,2-dimethylpropane-1,3-diamine-κ^2^<i>N,N</i>')chromium(III) perchlorate Acta Crystallographica Section C, 2015, 71 |
4336895 | CIF | C10 H28 Br2 N4 O2 | P b c a | 9.2274; 14.67; 25.607 90; 90; 90 | 3466.3 | Pablo Bruna; Andreas Decken; Scott Greer; Friedrich Grein; H. Donald B. Jenkins; Birgit Mueller; Jack Passmore; Tressia A. P. Paulose; J. Mikko Rautiainen; Stephanie Richardson; Melbourne J. Schriver Synthesis of (TDAE)(O2SSO2)(s) and Discovery of (TDAE)(O2SSSSO2)(s) Containing the First Polythionite, [O2SSSSO2]2- Inorganic Chemistry, 2013, 52, 13651-13662 |
2202836 | CIF HKL Paper | C10 H28 Cu N4 O6 | P b c a | 10.482; 11.026; 13.146 90; 90; 90 | 1519.3 | Bian, He-Dong; Xu, Jing-Yuan; Gu, Wen; Yan, Shi-Ping; Liao, Dai-Zheng; Jiang, Zong-Hui Bis(<i>N,N</i>'-dimethylethylenediamine)copper(II) oxalate dihydrate Acta Crystallographica Section E, 2003, 59, m441-m442 |
2102941 | CIF Paper | C10 H28 I4 N2 Pb | P b c a | 9.0078; 8.731; 29.956 90; 90; 90 | 2356 | Billing, David G.; Lemmerer, Andreas Synthesis, characterization and phase transitions in the inorganic‒organic layered perovskite-type hybrids [(C~<i>n~</i>H~2<i>n~+1</i>NH~3~)~2~PbI~4~], <i>n</i> = 4, 5 and 6 Acta Crystallographica Section B, 2007, 63, 735-747 |
2212629 | CIF HKL Paper | C10 H28 N2 O10 S2 | P b c a | 12.584; 11.475; 12.914 90; 90; 90 | 1864.8 | Bai, Guo-Yi; Zhang, Chen-Fang; Simpson, Jim; Chen, Yong; Peng, Hong-Wei (2<i>R</i>,2'<i>S</i>)-2,2'-(Ethane-1,2-diyldiiminio)bis(butane-2,1-diyl) disulfate dihydrate Acta Crystallographica Section E, 2007, 63, o1095-o1096 |
2202475 | CIF HKL Paper | C10 H28 N4 O20 S4 U2 | P b c a | 9.5831; 15.606; 18.1212 90; 90; 90 | 2710.1 | Doran, Michael B.; Norquist, Alexander J.; O'Hare, Dermot Poly[[1,4-bis-(3-aminopropyl)piperazinium] [[dioxouranium(VI)]-di-μ~2~,μ~3~-sulfato]] Acta Crystallographica Section E, 2003, 59, m762-m764 |
2000818 | CIF Paper | C10 H30 Cl2 O3 P4 Pd | P b c a | 14.332; 16.592; 17.42 90; 90; 90 | 4142.4 | Davies, J. A.; Pinkerton, A. A.; Vilmer, M. <i>cis</i>-Di[bis(dimethylphosphino)methane <i>P</i>-oxide-<i>P</i>']dichloropalladium(II) monohydrate Acta Crystallographica Section C, 1992, 48, 1027-1029 |
1557920 | CIF | C10 H30 Cl4 N4 O2 | P b c a | 18.922; 21.706; 8.512 90; 90; 90 | 3496.1 | Springborg, Johan; Kofod, Pauli; Olsen, Carl Erik; Sotofte, Inger Synthesis and Crystal Structure of a Spiro Amine: 3,9,12-Triaza-6-azoniaspiro[5,8]tetradecane Chloride Trihydrochloride Dihydrate Acta Chemica Scandinavica, 1995, 49, 564-570 |
2226897 | CIF HKL Paper | C10 H32 Co N6 O16 S2 | P b c a | 6.6219; 14.4347; 24.759 90; 90; 90 | 2366.59 | Al-Dajani, Mohammad T. M.; Wahab, Habibah A.; Mohamed, Nornisah; Goh, Jia Hao; Fun, Hoong-Kun Bis(2,6-diaminopyridin-1-ium) hexaaquacobalt(II) disulfate dihydrate Acta Crystallographica Section E, 2010, 66, m917-m918 |
2241438 | CIF HKL Paper | C10 H32 I N5 Zr | P b c a | 14.2425; 15.4113; 16.8537 90; 90; 90 | 3699.31 | Clark, Wesley D.; Akurathi, Gopalakrishna; Valle, Henry U.; Hollis, T. Keith Crystal structure of tris(dimethylamido-κ<i>N</i>)bis(dimethylamine-κ<i>N</i>)zirconium(IV) iodide Acta Crystallographica Section E, 2016, 72, 73-75 |
7060063 | CIF | C10 H34 N20 O21 Sr2 | P b c a | 17.068; 17.764; 21.772 90; 90; 90 | 6601 | Wang, Yanna; Yang, Xiaoming; Hu, Jie; Li, Haibo; Li, Zhimin; Zhang, Tonglai Insensitive energetic compounds: alkaline earth metal salts of 5,5′-dinitramino-3,3′-methylene-1H-1,2,4-bistriazolate New Journal of Chemistry, 2020, 44, 19054-19060 |
7000402 | CIF | C10 H35 B18 Co N2 | P b c a | 12.4127; 12.1868; 29.9491 90; 90; 90 | 4530.43 | Šícha, Václav; Plešek, Jaromír; Kvíčalová, Magdalena; Císařová, Ivana; Grüner, Bohumír Boron(8) substituted nitrilium and ammonium derivatives, versatile cobalt bis(1,2-dicarbollide) building blocks for synthetic purposes Dalton Transactions, 2009, 851-860 |
7129587 | CIF | C10 H36 B18 Co N O2 | P b c a | 19.2195; 12.1823; 20.1517 90; 90; 90 | 4718.3 | El Anwar, Suzan; Pazderová, Lucia; Bavol, Dmytro; Bakardjiev, Mario; Ruzickova, Zdenka; Horáček, Ondřej; Fojt, Lukáš; Kucera, Radim; Gruner, Bohumir Structurally rigidified cobalt bis(dicarbollide) derivatives, a chiral platform for labelling of biomolecules and new materials Chemical Communications, 2022 |
7712308 | CIF | C10 H4 N16 O8 | P b c a | 10.7356; 10.1583; 15.31 90; 90; 90 | 1669.6 | Tang, Jie; Xiong, Hualin; Tang, Yongxing; Yang, Hongwei; Cheng, Guangbin The design and synthesis of new advanced energetic materials based on pyrazole-triazole backbones. Dalton transactions (Cambridge, England : 2003), 2023 |
7231582 | CIF | C10 H5 Er O6 | P b c a | 13.9332; 6.7258; 21.795 90; 90; 90 | 2042.5 | Chainok, Kittipong; Ponjan, Nutcha; Theppitak, Chatphorn; Khemthong, Phailyn; Kielar, Filip; Dungkaew, Winya; Zhou, Yan; Batten, Stuart R. Temperature-dependent 3D structures of lanthanide coordination polymers based on dicarboxylate mixed ligands CrystEngComm, 2018, 20, 7446 |
7231578 | CIF | C10 H5 Eu O6 | P b c a | 14.0967; 6.8258; 22.0196 90; 90; 90 | 2118.8 | Chainok, Kittipong; Ponjan, Nutcha; Theppitak, Chatphorn; Khemthong, Phailyn; Kielar, Filip; Dungkaew, Winya; Zhou, Yan; Batten, Stuart R. Temperature-dependent 3D structures of lanthanide coordination polymers based on dicarboxylate mixed ligands CrystEngComm, 2018, 20, 7446 |
7130231 | CIF | C10 H5 F6 N2 P | P b c a | 7.5247; 12.9354; 22.6658 90; 90; 90 | 2206.2 | Dettling, Lea; Papke, Martin; Sklorz, Julian; Buzsaki, Daniel; Kelemen, Zsolt; Weber, Manuela; Nyulaszi, Laszlo; Muller, Christian A New Access to Diazaphospholes via Cycloaddition-Cycloreversion Reactions on Triazaphospholes Chemical Communications, 2022 |
7231581 | CIF | C10 H5 O6 Sm | P b c a | 14.1351; 6.8443; 22.0442 90; 90; 90 | 2132.66 | Chainok, Kittipong; Ponjan, Nutcha; Theppitak, Chatphorn; Khemthong, Phailyn; Kielar, Filip; Dungkaew, Winya; Zhou, Yan; Batten, Stuart R. Temperature-dependent 3D structures of lanthanide coordination polymers based on dicarboxylate mixed ligands CrystEngComm, 2018, 20, 7446 |
7231573 | CIF | C10 H5 O6 Tb | P b c a | 14.0391; 6.7782; 21.9289 90; 90; 90 | 2086.75 | Chainok, Kittipong; Ponjan, Nutcha; Theppitak, Chatphorn; Khemthong, Phailyn; Kielar, Filip; Dungkaew, Winya; Zhou, Yan; Batten, Stuart R. Temperature-dependent 3D structures of lanthanide coordination polymers based on dicarboxylate mixed ligands CrystEngComm, 2018, 20, 7446 |
7225178 | CIF | C10 H53 Ce Fe2 N6 O87 P2 W20 | P b c a | 24.5009; 21.006; 35.5102 90; 90; 90 | 18275.9 | Xue, Han; Zhang, Zhong; Pan, Rui; Yang, Bai-Feng; Liu, Hong-Sheng; Yang, Guo-Yu Supramolecular nanotubes constructed from 3d‒4f heterometallic sandwiched polyoxotungstate dimers CrystEngComm, 2016, 18, 4643 |
4328352 | CIF | C10 H53.5 Cs1.25 K Mo6 N5.75 O39.25 P4 | P b c a | 18.8861; 17.0627; 31.6438 90; 90; 90 | 10197.1 | Hani El Moll; Anne Dolbecq; Israël Martyr Mbomekalle; Jérôme Marrot; Philippe Deniard; Rémi Dessapt; Pierre Mialane Tuning the Photochromic Properties of Molybdenum Bisphosphonate Polyoxometalates Inorganic Chemistry, 2012, 51, 2291-2302 |
7225179 | CIF | C10 H57 Fe2 La N6 O89 P2 W20 | P b c a | 24.4846; 21.2236; 35.6854 90; 90; 90 | 18544 | Xue, Han; Zhang, Zhong; Pan, Rui; Yang, Bai-Feng; Liu, Hong-Sheng; Yang, Guo-Yu Supramolecular nanotubes constructed from 3d‒4f heterometallic sandwiched polyoxotungstate dimers CrystEngComm, 2016, 18, 4643 |
7227444 | CIF | C10 H6 Br2 | P b c a | 11.692; 7.545; 20.193 90; 90; 90 | 1781.3 | Białkowska, Magda; Chaładaj, Wojciech; Deperasińska, Irena; Drzewiecka-Antonik, Aleksandra; Koziol, Anna E.; Makarewicz, Artur; Kozankiewicz, Bolesław Single molecules of terrylene in di-substituted naphthalenes crystallizing in the herringbone pattern RSC Adv., 2017, 7, 2780 |
7227445 | CIF | C10 H6 Cl2 | P b c a | 11.631; 7.417; 19.691 90; 90; 90 | 1698.7 | Białkowska, Magda; Chaładaj, Wojciech; Deperasińska, Irena; Drzewiecka-Antonik, Aleksandra; Koziol, Anna E.; Makarewicz, Artur; Kozankiewicz, Bolesław Single molecules of terrylene in di-substituted naphthalenes crystallizing in the herringbone pattern RSC Adv., 2017, 7, 2780 |
7205050 | CIF | C10 H6 Cl2 Hg2 N12 | P b c a | 16.1407; 6.9435; 30.3299 90; 90; 90 | 3399.2 | Yang, En-Cui; Feng, Yan; Liu, Zhong-Yi; Liu, Tian-Yu; Zhao, Xiao-Jun Diverse mixed-ligand metal complexes with in situ generated 5-(pyrazinyl)tetrazolate chelating-bridging ligand: in situ synthesis, crystal structures, magnetic and luminescent properties CrystEngComm, 2011, 13, 230 |
7219190 | CIF | C10 H6 Cl4 N4 O4 | P b c a | 9.4206; 12.0251; 24.0488 90; 90; 90 | 2724.34 | Hu, Yanjing; Li, Zhiqiang; Zhao, Yiran; Yang, Yu; Liu, Faqian; Wang, Lei Using Halogen•••Halogen Interactions or C/N‒H•••Cl Hydrogen Bonding to Direct Crystal Packing in Tetrachlorophthalic Acid with N‒heterocyclic Compounds RSC Adv., 2014 |
7100254 | CIF | C10 H6 Co N12 | P b c a | 8.2299; 9.3483; 17.8999 90; 90; 90 | 1377.14 | E. Colacio; Raikko Kivekas; Antonio Rodriguez Unique Self-Assembled 2D Metal-Tetrazolate networks: Crystal Structure and Magnetic Properties of [M(pmtz)2] (M=Co(II) and Fe(II); Hpmzt=5 (pyrimidyl)tetrazole) Chemical Communications, 2005 |
7003926 | CIF | C10 H6 Co0.5 N12 Ni0.5 | P b c a | 8.2427; 9.2387; 17.919 90; 90; 90 | 1364.6 | Rodríguez-Diéguez, A.; Palacios, M. A.; Sironi, A.; Colacio, E. A rational design by hydrothermal methods of a tetrazolate-bridged bimetallic spin-canted antiferromagnet. Synthesis, X-ray structure and magnetic properties of [CoNi(pmtz)4] (Hpmtz− = 5-(pyrimidyl)tetrazole) Dalton Transactions, 2008, 2887-2893 |
4346249 | CIF | C10 H6 Cu N12 | P b c a | 8.2412; 9.5237; 17.8 90; 90; 90 | 1397.1 | Dolai, Malay; Biswas, Surajit; Escuer, Albert; Ali, Mahammad Mn(II)- and Co(II)-Catalyzed Transformation of 2-Cyanopyrimidine to Methylimidate by Sodium Azide: Isolation, Structural Characterization, and Magnetic Studies on 2D Mn(II)- and Cu(II)-Complexes. Inorganic chemistry, 2015, 54, 7030-7037 |
2216664 | CIF HKL Paper | C10 H6 Eu O6 | P b c a | 13.9501; 6.8696; 21.8409 90; 90; 90 | 2093.05 | Qin He; Bao-Jun Huang Poly[di-μ~4~-benzene-1,4-dicarboxylato-μ~6~-succinato-dieuropium(III)] Acta Crystallographica Section E, 2007, 63, m2922-m2922 |
7153869 | CIF | C10 H6 F N O2 | P b c a | 10.892; 7.9279; 19.835 90; 90; 90 | 1712.8 | Chen, Hao; Yao, Erdong; Xu, Chi; Meng, Xiao; Ma, Yuguo Unusual regio- and stereo-selectivity in Diels-Alder reactions between bulky N-phenylmaleimides and anthracene derivatives. Organic & biomolecular chemistry, 2014, 12, 5102-5107 |
7100255 | CIF | C10 H6 Fe N12 | P b c a | 8.0193; 8.7837; 18.0385 90; 90; 90 | 1270.62 | E. Colacio; Raikko Kivekas; Antonio Rodriguez Unique Self-Assembled 2D Metal-Tetrazolate networks: Crystal Structure and Magnetic Properties of [M(pmtz)2] (M=Co(II) and Fe(II); Hpmzt=5 (pyrimidyl)tetrazole) Chemical Communications, 2005 |
2217207 | CIF HKL Paper | C10 H6 Ho O6 | P b c a | 13.8147; 6.785; 21.7103 90; 90; 90 | 2034.97 | Qin He; Bao-Jun Huang Poly[di-μ~4~-benzene-1,4-dicarboxylato-μ~6~-succinato-diholmium(III)] Acta Crystallographica Section E, 2008, 64, m237-m237 |
2212270 | CIF HKL Paper | C10 H6 I2 | P b c a | 11.942; 8.0583; 21.0592 90; 90; 90 | 2026.6 | Novak, Igor 2,3-Diiodonaphthalene Acta Crystallographica Section E, 2007, 63, o440-o441 |
2216280 | CIF HKL Paper | C10 H6 La O6 | P b c a | 14.2014; 7.0513; 22.11 90; 90; 90 | 2214.06 | Qin He; Bao-Jun Huang Poly[bis(μ~4~-benzene-1,4-dicarboxylato)-μ~6~-succinato-dilanthanum(III)] Acta Crystallographica Section E, 2007, 63, m2879-m2879 |
2213730 | CIF HKL Paper | C10 H6 N12 Ni | P b c a | 8.2054; 9.1736; 17.846 90; 90; 90 | 1343.3 | Liu, Ju-Tao; Fan, Sheng-Di Poly[bis[μ~2~-5-(pyrimidin-2-yl)tetrazolato]nickel(II)] Acta Crystallographica Section E, 2007, 63, m1632-m1632 |
2215039 | CIF HKL Paper | C10 H6 N12 Zn | P b c a | 8.349; 9.476; 17.828 90; 90; 90 | 1410.5 | Zhang, Xiu-Ling; Zhang, Cun-Lan; Qiu, Yu-E; An, Ning Poly[bis[μ~2~-5-(pyrimidin-2-yl)tetrazolato]zinc(II)] Acta Crystallographica Section E, 2007, 63, m2423-m2423 |
4502528 | CIF | C10 H6 N12 Zn | P b c a | 8.34; 9.4598; 17.8056 90; 90; 90 | 1404.8 | Zhang, Jian-Yong; Cheng, Ai-Ling; Sun, Qian; Yue, Qi; Gao, En-Qing Syntheses, Structures, and Properties of Honeycomb and Square Grid Coordination Polymers with In Situ Formed 5-(2′-Pyrimidyl)tetrazolate Crystal Growth & Design, 2010, 10, 2908 |
2231257 | CIF HKL Paper | C10 H6 N2 O | P b c a | 11.9; 9.1978; 14.521 90; 90; 90 | 1589.4 | Kitamura, Mitsuru; Sakata, Rie; Matsumoto, Taisuke 1-Diazonaphthalen-2(1<i>H</i>)-one Acta Crystallographica Section E, 2011, 67, o1951 |
7208995 | CIF | C10 H6 N4 O2 | P b c a | 5.1519; 11.244; 16.37 90; 90; 90 | 948.3 | Curtis, Scott; Ilkun, Olesya; Brown, Amy; Silchenko, Svitlana; Gerasimchuk, Nikolay Synthesis, spectroscopic and structural characterization of the first phenyl bis-cyanoximes: non-chelating extended ionisable building block ligands for new MOFs CrystEngComm, 2013, 15, 152 |
2218066 | CIF HKL Paper | C10 H6 O6 Tb | P b c a | 13.948; 6.8724; 21.844 90; 90; 90 | 2093.9 | Yu, Chun-Hui Poly[bis(μ~4~-benzene-1,4-dicarboxylato)(μ~4~-succinato)diterbium(III)] Acta Crystallographica Section E, 2008, 64, m735 |
1519757 | CIF | C10 H7 Br Cl2 N2 O | P b c a | 12.6226; 12.3709; 14.1124 90; 90; 90 | 2203.7 | Gurry, Michael; Sweeney, Martin; McArdle, Patrick; Aldabbagh, Fawaz One-pot hydrogen peroxide and hydrohalic Acid induced ring closure and selective aromatic halogenation to give new ring-fused benzimidazoles. Organic letters, 2015, 17, 2856-2859 |
7156598 | CIF | C10 H7 Br I N | P b c a | 10.5281; 7.794; 25.907 90; 90; 90 | 2125.8 | Wang, Fang; Zhang, Xinying; He, Yan; Fan, Xuesen Selective synthesis of pyrrolidin-2-ones and 3-iodopyrroles via the ring contraction and deformylative functionalization of piperidine derivatives. Organic & biomolecular chemistry, 2018, 17, 156-164 |
2235029 | CIF HKL Paper | C10 H7 Br O2 | P b c a | 10.8301; 7.463; 21.7213 90; 90; 90 | 1755.62 | Fun, Hoong-Kun; Quah, Ching Kheng; Abdel-Aziz, Hatem A. 1-(5-Bromo-1-benzofuran-2-yl)ethanone Acta Crystallographica Section E, 2012, 68, o1682 |
2214772 | CIF HKL Paper | C10 H7 Cl O2 | P b c a | 9.55; 10.303; 17.695 90; 90; 90 | 1741.1 | Anna Kozakiewicz; Andrzej Prewysz-Kwinto; Andrzej Wojtczak 1-(1-Benzofuran-2-yl)-2-chloroethanone Acta Crystallographica Section E, 2007, 63, o3469-o3469 |
2224467 | CIF HKL Paper | C10 H7 Cl2 N O3 | P b c a | 13.1618; 14.6993; 22.8406 90; 90; 90 | 4418.95 | Shakuntala, K.; Gowda, B. Thimme; Tokarčík, Miroslav; Kožíšek, Jozef <i>N</i>-(2,5-Dichlorophenyl)maleamic acid Acta Crystallographica Section E, 2009, 65, o3119 |
4348192 | CIF | C10 H7 Cu2 I N6 O0 | P b c a | 13.5477; 20.56; 8.7151 90; 90; 90 | 2427.5 | Wen, Tian; Zhang, De-Xiang; Ding, Qing-Rong; Zhang, Hua-Bin; Zhang, Jian Two luminescent Cu(i) coordination polymers based on the 1-(4-tetrazolephenyl)imidazole ligand for sensing of nitrobenzene Inorganic Chemistry Frontiers, 2014, 1, 389 |
2009999 | CIF Paper | C10 H7 F N2 O3 | P b c a | 12.072; 8.349; 18.819 90; 90; 90 | 1896.8 | DesMarteau, D. D.; Pennington, W. T.; Resnati, G. Fluorinated barbituric acid derivatives Acta Crystallographica Section C, 1994, 50, 1305-1308 |
2242139 | CIF HKL Paper | C10 H7 F N6 O8 | P b c a | 7.7463; 13.235; 25.642 90; 90; 90 | 2628.9 | Mohana, Marimuthu; Thomas Muthiah, Packianathan; McMillen, Colin D. Crystal structure and hydrogen-bonding patterns in 5-fluorocytosinium picrate Acta Crystallographica Section E, 2017, 73, 361-364 |
2208322 | CIF HKL Paper | C10 H7 K O6 S | P b c a | 14.23; 6.945; 21.808 90; 90; 90 | 2155.2 | Sierosławski, Krzysztof; Ślepokura, Katarzyna; Lis, Tadeusz Potassium (4-methyl-2-oxo-2<i>H</i>-chromen-7-yloxy)sulfate Acta Crystallographica Section E, 2006, 62, m560-m562 |
2004742 | CIF Paper | C10 H7 N O4 | P b c a | 7.573; 21.152; 11.756 90; 90; 90 | 1883.1 | Feeder, N.; Jones, W. Structures of Five ω-Phthalimidoaliphatic Carboxylic Acids Acta Crystallographica Section C, 1996, 52, 913-919 |
7034845 | CIF | C10 H7 N7 O3 Pb | P b c a | 12.941; 6.9454; 26.594 90; 90; 90 | 2390.3 | Chen, Jun; Zhang, Qing; Liu, Zhi-Fa; Wang, Shuai-Hua; Xiao, Yu; Li, Rong; Xu, Jian-Gang; Zhao, Ya-Ping; Zheng, Fa-Kun; Guo, Guo-Cong Color tunable and near white-light emission of two solvent-induced 2D lead(ii) coordination networks based on a rigid ligand 1-tetrazole-4-imidazole-benzene. Dalton transactions (Cambridge, England : 2003), 2015, 44, 10089-10096 |
4303741 | CIF | C10 H8 Ag N2 O4 Re | P b c a | 11.3441; 13.2; 15.3016 90; 90; 90 | 2291.3 | Haisheng Lin; Xiaomeng Wu; Paul A. Maggard Ligand-Based Modification of the Structures and Optical Properties of New Silver(I)-Rhenate(VII) Oxide/Organic Hybrid Solids Inorganic Chemistry, 2009, 48, 11265-11276 |
4323045 | CIF | C10 H8 Ag N3 O3 | P b c a | 11.2884; 11.3981; 16.5299 90; 90; 90 | 2126.8 | Ming-Liang Tong; Xiao-Ming Chen; Bao-Hui Ye; Seik Weng Ng Helical Silver(I)-2,4'-Bipyridine Chains Organized into 2-D Networks by Metal-Counterion or Metal-Metal Bonding. Structures of [Ag(2,4'-bipyridine)]X (X = NO~3~ or ClO~4~) Inorganic Chemistry, 1998, 37, 5278-5281 |
7037013 | CIF | C10 H8 Al1.1 Cl6 Ga0.9 N2 | P b c a | 15.581; 11.971; 18.613 90; 90; 90 | 3472 | Sevastianova, Tatiana N.; Bodensteiner, Michael; Maulieva, Albina F.; Davydova, Elena I.; Virovets, Alexander V.; Peresypkina, Eugenia V.; Balázs, Gábor; Graßl, Christian; Seidl, Michael; Scheer, Manfred; Frenking, Gernot; Berezovskaya, Ekaterina A.; Kazakov, Igor V.; Khoroshilova, Olesya V.; Timoshkin, Alexey Y. Versatile structures of group 13 metal halide complexes with 4,4'-bipy: from 1D coordination polymers to 2D and 3D metal-organic frameworks. Dalton transactions (Cambridge, England : 2003), 2015, 44, 20648-20658 |
7037011 | CIF | C10 H8 Al2 Cl6 N2 | P b c a | 15.5509; 11.952; 18.5778 90; 90; 90 | 3452.95 | Sevastianova, Tatiana N.; Bodensteiner, Michael; Maulieva, Albina F.; Davydova, Elena I.; Virovets, Alexander V.; Peresypkina, Eugenia V.; Balázs, Gábor; Graßl, Christian; Seidl, Michael; Scheer, Manfred; Frenking, Gernot; Berezovskaya, Ekaterina A.; Kazakov, Igor V.; Khoroshilova, Olesya V.; Timoshkin, Alexey Y. Versatile structures of group 13 metal halide complexes with 4,4'-bipy: from 1D coordination polymers to 2D and 3D metal-organic frameworks. Dalton transactions (Cambridge, England : 2003), 2015, 44, 20648-20658 |
4308914 | CIF | C10 H8 Br Cu2 N4 O5 | P b c a | 13.156; 7.7171; 26.148 90; 90; 90 | 2654.7 | Xian-Ming Zhang; Rui-Qin Fang Hydrothermal Syntheses and Structures of Two Mixed-Valence Copper(I,II) 2-Pyrazinecarboxylate Coordination Polymers Inorganic Chemistry, 2005, 44, 3955-3959 |
2206058 | CIF HKL Paper | C10 H8 Br N S | P b c a | 12.726; 11.629; 13.705 90; 90; 90 | 2028.2 | Xu, Fengying; Chen, Zihui; Zhang, Fushi; Wang, Ru-Ji; Zhao, Fuqun 4-(4-Bromo-5-methylthiophen-2-yl)pyridine Acta Crystallographica Section E, 2005, 61, o1672-o1673 |
8104640 | CIF | C10 H8 Br N3 | P b c a | 7.214; 12.735; 21.305 90; 90; 90 | 1957.3 | Khan, Arshad; Usman, Rabia; Khan, Amjad; Refat, Moamen S.; Alosaimi, Abeer M.; Bakare, Safyah B.; Alghamdi, Mohammed T. The crystal structure of 4-(3-bromophenyl)pyrimidin-2-amine, C10H8BrN3 Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 975-976 |
7061874 | CIF | C10 H8 Br2 Co N2 Te2 | P b c a | 13.9956; 15.6522; 27.3451 90; 90; 90 | 5990.3 | da Silva, Felipe Dornelles; Bortolotto, Tanize; Tirloni, Bárbara; Daudt, Natália de Freitas; Lang, Ernesto Schulz; Cargnelutti, Roberta Bis(2-pyridyl)ditellane as a precursor to CoII, CuI and CuII complex formation: structural characterization and photocatalytic studies New Journal of Chemistry, 2022, 46, 18165-18172 |
2205571 | CIF HKL Paper | C10 H8 Br4 Cu2 N4 O6 | P b c a | 10.044; 7.2816; 25.006 90; 90; 90 | 1828.8 | Twamley, Brendan Bis(μ-4-nitropyridine <i>N</i>-oxide-κ^2^<i>O</i>:<i>O</i>)bis[dibromocopper(II)] Acta Crystallographica Section E, 2005, 61, m619-m621 |
2204570 | CIF Paper | C10 H8 Br4 O2 | P b c a | 16.8495; 12.1086; 12.357 90; 90; 90 | 2521.1 | Mehmet Akkurt; Ísmail Çelik; Ramazan Erenler; Osman Çakmak; Cem Cüneyt Ersanlı; Orhan Büyükgüngör <i>trans,trans,trans</i>-2,3,5,8-Tetrabromo-1,4-dihydroxy-1,2,3,4-tetrahydronaphthalene Acta Crystallographica Section E, 2004, 60, o2096-o2098 |
7215212 | CIF | C10 H8 Cd N4 O6 S2 | P b c a | 6.9658; 18.5806; 21.667 90; 90; 90 | 2804.3 | Anantharaman, Ganapathi; Singh, Namita Coordination Polymers Built with Transition Metal Sulphates and Angular 2,5-bis(imidazol-1-yl)thiophene (thim2): Synthesis, Structure and Photoluminescent Properties CrystEngComm, 2014 |
7202445 | CIF | C10 H8 Cd3 N4 O11 | P b c a | 14.3; 13.041; 18.23 90; 90; 90 | 3399.6 | Wang, Shuang; Zhang, Lirong; Li, Guanghua; Huo, Qisheng; Liu, Yunling Assembly of two 3-D metal‒organic frameworks from Cd(II) and 4,5-imidazoledicarboxylic acid or 2-ethyl-4,5-imidazoledicarboxylic acid CrystEngComm, 2008, 10, 1662 |
2000228 | CIF Paper | C10 H8 Cl Cu N O4 | P b c a | 8.783; 9.304; 26.993 90; 90; 90 | 2205.8 | Wang, J.-L.; Tian, G.-H.; Miao, F. M.; Liu, H.-Q.; Chen, R.-T. Structure of the complex [<i>N</i>-(<i>p</i>-chlorophenyl)iminodiacetato]copper(II) Acta Crystallographica Section C, 1991, 47, 2205-2207 |
2200081 | CIF HKL Paper | C10 H8 Cl N | P b c a | 12.721; 7.8961; 16.617 90; 90; 90 | 1669.1 | Lynch, Daniel E.; McClenaghan, Ian 2-Chloro-4-methylquinoline Acta Crystallographica Section E, 2001, 57, o54-o55 |
2101506 | CIF Paper | C10 H8 Cl N O2 | P b c a | 61.08; 12.115; 7.674 90; 90; 90 | 5679 | Nigović, B.; Kojić-Prodić, B.; Antolić, S.; Tomić, S.; Puntarec, V.; Cohen, J. D. Structural studies on monohalogenated derivatives of the phytohormone indole-3-acetic acid (auxin) Acta Crystallographica Section B, 1996, 52, 332-343 |
2231012 | CIF HKL Paper | C10 H8 Cl N O2 | P b c a | 12.884; 7.173; 20.805 90; 90; 90 | 1922.7 | Saraswathi, B. S.; Foro, Sabine; Gowda, B. Thimme <i>N</i>-(3-Chlorophenyl)succinimide Acta Crystallographica Section E, 2011, 67, o1977 |
1519180 | CIF | C10 H8 Cl2 N4 | P b c a | 7.23; 15.594; 19.618 90; 90; 90 | 2211.8 | Blake, Alexander J.; Light, Mark E.; Hursthouse, Michael B. C10H8Cl2N4 Crystal Structure Report Archive, 1997, 1206 |
4311633 | CIF | C10 H8 Cl2 N4 Pt | P b c a | 9.2; 16.633; 16.176 90; 90; 90 | 2475.31 | Akbey Dogan; Biprajit Sarkar; Axel Klein; Falk Lissner; Thomas Schleid; Jan Fiedler; Stanislav Záliš; Vimal K. Jain; Wolfgang Kaim Complex Reduction Chemistry of (abpy)PtCl2, abpy = 2,2'-Azobispyridine: Formation of Cyclic [(μ,η2:η1-abpy)PtCl]22+ with a New Coordination Mode for abpy and a Near-Infrared Ligand-to-Ligand Intervalence Charge Transfer Absorption of the One-Electron Reduced State Inorganic Chemistry, 2004, 43, 5973-5980 |
4022027 | CIF | C10 H8 Cl3 N2 O P | P b c a | 12.028; 12.923; 16.482 90; 90; 90 | 2561.8 | Anatoliy P. Marchenko; Georgyi N. Koidan; Aleksandr N. Kostyuk; Andrei A. Tolmachev; Evgenij G. Kapustin; Aleksandr M. Pinchuk A Representative of P,P,P-Trihalogenylides: Synthesis and Structure Journal of Organic Chemistry, 2006, 71, 8633-8636 |
7037012 | CIF | C10 H8 Cl6 Ga2 N2 | P b c a | 15.5909; 11.9714; 18.6015 90; 90; 90 | 3471.9 | Sevastianova, Tatiana N.; Bodensteiner, Michael; Maulieva, Albina F.; Davydova, Elena I.; Virovets, Alexander V.; Peresypkina, Eugenia V.; Balázs, Gábor; Graßl, Christian; Seidl, Michael; Scheer, Manfred; Frenking, Gernot; Berezovskaya, Ekaterina A.; Kazakov, Igor V.; Khoroshilova, Olesya V.; Timoshkin, Alexey Y. Versatile structures of group 13 metal halide complexes with 4,4'-bipy: from 1D coordination polymers to 2D and 3D metal-organic frameworks. Dalton transactions (Cambridge, England : 2003), 2015, 44, 20648-20658 |
2014776 | CIF HKL Paper | C10 H8 Cr N3 O2 S2 | P b c a | 11.0511; 14.1558; 15.2486 90; 90; 90 | 2385.4 | Torben Birk; Henning Osholm Sørensen; Jesper Bendix Two square-pyramidal chromium(V)‒nitride complexes: bis(2-methylquinolin-8-olato)nitridochromium(V) and nitridobis(2-sulfidopyridine <i>N</i>-oxide)chromium(V) Acta Crystallographica Section C, 2005, 61, m231-m233 |
6000579 | CIF | C10 H8 Cu Mo N2 O4 | P b c a | 12.4823; 9.1699; 19.5647 90; 90; 90 | 2239.4 | Randy S. Rarig; Robert Lam; Peter Y. Zavalij; J. Katana Ngala; Robert L. LaDuca,; John E. Greedan; Jon Zubieta Ligand influences on copper molybdate networks: The structures and magnetism of [Cu(3,4 '-bpy)MoO4], [Cu(3,3 '-bpy)(0.5)MoO4], and [Cu(4,4 '-bpy)(0.5)MoO4].1.5H(2)O Inorganic Chemistry, 2002, 41, 2124-2133 |
4303140 | CIF | C10 H8 Cu N2 O4 Re | P b c a | 10.8513; 12.9419; 15.6976 90; 90; 90 | 2204.52 | Haisheng Lin; Paul A. Maggard Ligand-Mediated Interconversion of Multiply-Interpenetrating Frameworks in CuI/ReVII-Oxide Hybrids Inorganic Chemistry, 2009, 48, 8940-8946 |
1554489 | CIF | C10 H8 F N3 | P b c a | 7.4865; 11.7277; 20.913 90; 90; 90 | 1836.1 | Zhao, Mingzhu; Cai, Juewang; Zhao, Xiaoming Silver-promoted selective fluorination of 2-aminopyrimidines: synthesis of 5-fluoro-2-aminopyrimidine derivatives Organic Chemistry Frontiers, 2019, 6, 426 |
4077537 | CIF | C10 H8 Fe N6 | P b c a | 9.0587; 9.0587; 50.2953 90; 90; 90 | 4127.23 | Shafir, Alexandr; Power, Maurice P.; Whitener, Glenn D.; Arnold, John Synthesis, Structure, and Properties of 1,1‘-Diamino- and 1,1‘-Diazidoferrocene Organometallics, 2000, 19, 3978 |
7225041 | CIF | C10 H8 Fe S Te2 | P b c a | 13.514; 10.494; 16.226 90; 90; 90 | 2301.1 | Karjalainen, Minna M.; Sanchez-Perez, Clara; Rautiainen, J. Mikko; Oilunkaniemi, Raija; Laitinen, Risto S. Chalcogen‒chalcogen secondary bonding interactions in trichalcogenaferrocenophanes CrystEngComm, 2016, 18, 4538 |
7005855 | CIF | C10 H8 La2 N4 O14 S | P b c a | 6.879; 14.067; 33.802 90; 90; 90 | 3270.9 | Sun, Yan-Qiong; Yang, Guo-Yu Organic-inorganic hybrid materials constructed from inorganic lanthanide sulfate skeletons and organic 4,5-imidazoledicarboxylic acid. Dalton transactions (Cambridge, England : 2003), 2007, 3771-3781 |
7111581 | CIF | C10 H8 N2 Na0.25 O6 W2 | P b c a | 7.4683; 7.391; 22.5781 90; 90; 90 | 1246.27 | Islah-u-din,; Fox, Matthew R.; Martin, Hélène; Gainsford, Graeme J.; Kennedy, John; Markwitz, Andreas; Telfer, Shane G.; Jameson, Geoffrey B.; Tallon, Jeffery L. Synthesis and structure of Na±intercalated WO3(4,4′-bipyridyl)0.5 Chemical Communications, 2010, 46, 4261 |
7111582 | CIF | C10 H8 N2 Na0.26 O6 W2 | P b c a | 7.48501; 7.40943; 22.6257 90; 90; 90 | 1254.81 | Islah-u-din,; Fox, Matthew R.; Martin, Hélène; Gainsford, Graeme J.; Kennedy, John; Markwitz, Andreas; Telfer, Shane G.; Jameson, Geoffrey B.; Tallon, Jeffery L. Synthesis and structure of Na±intercalated WO3(4,4′-bipyridyl)0.5 Chemical Communications, 2010, 46, 4261 |
2219602 | CIF HKL Paper | C10 H8 N2 O2 | P b c a | 6.877; 8.996; 15.171 90; 90; 90 | 938.6 | Ma, Qi; Lu, Li-Ping; Zhu, Miao-Li 1,2-Bis(2-furylmethylene)hydrazine Acta Crystallographica Section E, 2008, 64, o2026 |
4028219 | CIF | C10 H8 N2 O2 | P b c a | 12.0523; 7.62; 19.0289 90; 90; 90 | 1747.6 | Fabrício F. Naciuk; Julio C. Milan; Almir Andreão; Paulo C. M. L. Miranda Exploitation of a Tuned Oxidation with N-Haloimides in the Synthesis of Caulibugulones A-D Journal of Organic Chemistry, 2013, 78, 5026-5030 |
8103169 | CIF | C10 H8 N2 O2 S | P b c a | 11.9394; 7.6572; 22.4747 90; 90; 90 | 2054.69 | Heng-Yu Qian; Quan-Ling Wang; Zhi-Gang Yin; Chun-Xia Zhang Crystal structure of N'-(2-thienylmethylene)-furan-2-carbohydrazide, C10H8N2O2S Zeitschrift für Kristallographie - New Crystal Structures, 2011, 226, 419 |
2242336 | CIF HKL Paper | C10 H8 N2 O2 Zn | P b c a | 8.956; 10.697; 20.331 90; 90; 90 | 1947.8 | Li, Xiao-Yan; Peng, Yong-Qiong; Li, Juan; Fu, Wei-Wei; Liu, Yang; Li, Yu-Ming Assembly of Zn^II^ and Cd^II^ coordination polymers with different dimensionalities based on the semi-flexible 3-(1<i>H</i>-benzimidazol-2-yl)propanoic acid ligand Acta Crystallographica Section E, 2018, 74, 28-33 |
7220194 | CIF | C10 H8 N2 O3 | P b c a | 9.6734; 7.8964; 25.315 90; 90; 90 | 1933.7 | Wong, Fung Fuh; Huang, Jiann-Jyh; Lu, Shi-Han; Chung, Yu Hsuan Vilsmeier‒Haack reagent-promoted formyloxylation of α-chloro-N-arylacetamides by formamide RSC Adv., 2015 |
2009876 | CIF Paper | C10 H8 N2 O3 S2 V | P b c a | 11.227; 14.155; 15.476 90; 90; 90 | 2459.4 | Higes-Rolando, F.J.; Perez-Florindo, A.; Valenzuela-Calahorro, C.; Martin-Ramos, J.D.; Romero-Garzon, J. Oxobis(<i>N</i>-oxopyridine-2-thiolato-<i>N</i>,<i>O</i>)vanadium(IV) Acta Crystallographica Section C, 1994, 50, 1049-1052 |
7111580 | CIF | C10 H8 N2 O6 W2 | P b c a | 7.47709; 7.38736; 22.56247 90; 90; 90 | 1246.26 | Islah-u-din,; Fox, Matthew R.; Martin, Hélène; Gainsford, Graeme J.; Kennedy, John; Markwitz, Andreas; Telfer, Shane G.; Jameson, Geoffrey B.; Tallon, Jeffery L. Synthesis and structure of Na±intercalated WO3(4,4′-bipyridyl)0.5 Chemical Communications, 2010, 46, 4261 |
4118108 | CIF | C10 H8 N4 Ni O2 | P b c a | 16.7015; 6.6866; 17.7346 90; 90; 90 | 1980.53 | Ashley M. Wright; Guang Wu; Trevor W. Hayton Formation of N2O from a Nickel Nitrosyl: Isolation of the cis-[N2O2]2- Intermediate Journal of the American Chemical Society, 2012, 134, 9930-9933 |
1553166 | CIF | C10 H8 N4 O | P b c a | 7.008; 13.515; 19.467 90; 90; 90 | 1843.8 | Li, Pan; Zhao, Jingjing; Xia, Chungu; Li, Fuwei The development of carbene-stabilized N‒O radical coupling strategy in metal-free regioselective C‒H azidation of quinoline N-oxides Organic Chemistry Frontiers, 2015, 2, 1313 |
2214286 | CIF HKL Paper | C10 H8 N4 O4 | P b c a | 8.1416; 12.7121; 20.7789 90; 90; 90 | 2150.6 | Wagner, Paweł; Kubicki, Maciej 2-Methyl-4-nitro-1-(4-nitrophenyl)-1<i>H</i>-imidazole Acta Crystallographica Section E, 2007, 63, o3083-o3083 |
7208054 | CIF | C10 H8 N5 | P b c a | 6.4648; 9.841; 30.508 90; 90; 90 | 1940.9 | Chu, Wenjuan; Wu, Benlai; Tang, Mingsheng; Fan, Yaoting; Hou, Hongwei A novel dodecanuclear cadmium(ii) macrocycle with a 3D framework: synthesis, structure and properties CrystEngComm, 2012, 14, 4414 |
2201889 | CIF HKL Paper | C10 H8 O2 | P b c a | 8.3865; 18.273; 10.652 90; 90; 90 | 1632.4 | A. Thiruvalluvar; S. Silvarani; A. Vadivelu; K. Sithik Ali; V. R. Venkataraman 2-Acetylbenzo[<i>b</i>]furan Acta Crystallographica Section E, 2003, 59, o395-o396 |
7051247 | CIF | C10 H8 O2 | P b c a | 8.8316; 5.9003; 15.6123 90; 90; 90 | 813.54 | Laxmi Madhavi, N. N.; Bilton, Clair; Howard, Judith A. K.; Allen, Frank H.; Nangia, Ashwini; Desiraju, Gautam R. Seeking structural repetitivity in systems with interaction interference: crystal engineering in the gem-alkynol family New Journal of Chemistry, 2000, 24, 1 |
7204878 | CIF | C10 H8 O2 | P b c a | 13.962; 6.052; 19.542 90; 90; 90 | 1651.3 | Dai, Chaoyang; Yuan, Zheng; Collings, Jonathan C.; Fasina, Tolulope M.; Thomas, Rhodri Ll.; Roscoe, Karl P.; Stimson, Lorna M.; Yufit, Dmitry S.; Batsanov, Andrei S.; Howard, Judith A. K.; Marder, Todd B. Crystal engineering with p-substituted 4-ethynylbenzenes using the C?H?O supramolecular synthon CrystEngComm, 2004, 6, 184 |
1562416 | CIF | C10 H8 O2 S2 | P b c a | 14.212; 6.005; 23.945 90; 90; 90 | 2043.5 | Fucci, Rosa; Vande Velde, Christophe M. L. Strategic design and synthesis of star-shaped organic linkers for mesoporous MOFs. Faraday discussions, 2021, 231, 97-111 |
2105260 | CIF HKL Paper | C10 H8 O3 | P b c a | 11.744; 7.601; 18.102 90; 90; 90 | 1615.9 | Britton, Doyle; Young, Jr, Victor G.; Noland, Wayland E.; Pinnow, Matthew J.; Clark, Christopher M. Four polymorphs (polytypes) of 5,6-dimethylbenzofurazan 1-oxide Acta Crystallographica Section B, 2012, 68, 536-542 |
1543125 | CIF HKL Paper | C10 H8 O4 | P b c a | 13.217; 9.831; 13.627 90; 90; 90 | 1771 | Bai, Jun-Hua; Dong, Jin-Long 7-Hydroxy-4-(hydroxymethyl)coumarin IUCrData, 2016, 1, x160598 |
7236466 | CIF | C10 H9 Au Cl2 N2 | P b c a | 15.0499; 7.55959; 19.0308 90; 90; 90 | 2165.15 | von Arx, Tobias; Szentkuti, Alexander; Zehnder, Thomas N.; Blacque, Olivier; Venkatesan, Koushik Stable N-heterocyclic carbene (NHC) cyclometalated (C^C) gold(iii) complexes as blue–blue green phosphorescence emitters Journal of Materials Chemistry C, 2017, 5, 3765 |
1516172 | CIF | C10 H9 B F2 N4 | P b c a | 12.306; 9.48; 18.766 90; 90; 90 | 2189.3 | Yu, Changjiang; Jiao, Lijuan; Zhang, Ping; Feng, Zeya; Cheng, Chi; Wei, Yun; Mu, Xiaolong; Hao, Erhong Highly Fluorescent BF2 Complexes of Hydrazine-Schiff Base Linked Bispyrrole. Organic letters, 2014, 16, 3048-3051 |
1559532 | CIF | C10 H9 Br Cl2 | P b c a | 9.263; 11.423; 20.091 90; 90; 90 | 2125.9 | Sydnes, Leiv K.; Pettersen, Anita; Drablos, Finn; Romming, Christian Long-Range NMR Coupling between a Cyclopropyl Proton and a Proton next to the Ring in a Number of 2,2-Disubstituted 1,1-Dihalocyclopropanes Acta Chemica Scandinavica, 1991, 45, 902-913 |
4086543 | CIF | C10 H9 Br Co F6 P | P b c a | 12.8061; 11.8486; 16.9221 90; 90; 90 | 2567.7 | Vanicek, Stefan; Kopacka, Holger; Wurst, Klaus; Müller, Thomas; Hassenrück, Christopher; Winter, Rainer F.; Bildstein, Benno Monofunctionalized Cobaltocenium Compounds by Dediazoniation Reactions of Cobaltoceniumdiazonium Bis(hexafluorophosphate) Organometallics, 2016, 35, 2101 |
1551599 | CIF | C10 H9 Br N4 O | P b c a | 23.6829; 7.5558; 24.1777 90; 90; 90 | 4326.4 | HWANG, Long-Chih; CHUANG, Chung-Lin; SU, Chun-Wei; LEE, Gene-Hsiang Packing of Two Independent Molecules: 3-Amino-2-benzyl-6-bromo-1,2,4-triazin-5(2<i>H</i>)-one X-ray Structure Analysis Online, 2016, 32, 33 |
4027631 | CIF | C10 H9 Br O2 | P b c a | 9.0384; 7.883; 27.4231 90; 90; 90 | 1953.89 | Shah Jaimin Balkrishna; Ch Durga Prasad; Piyush Panini; Michael R. Detty; Deepak Chopra; Sangit Kumar Isoselenazolones as Catalysts for the Activation of Bromine: Bromolactonization of Alkenoic Acids and Oxidation of Alcohols Journal of Organic Chemistry, 2012, 77, 9541-9552 |
7005933 | CIF | C10 H9 Br2 N Pd S | P b c a | 8.5895; 16.0336; 17.2939 90; 90; 90 | 2381.7 | Yen, Swee Kuan; Koh, Lip Lin; Huynh, Han Vinh; Hor, T. S. Andy Pd(II) complexes of N,S-heterocyclic carbenes with pendant and coordinated allyl function and their Suzuki coupling activities. Dalton transactions (Cambridge, England : 2003), 2007, 3952-3958 |
7111643 | CIF | C10 H9 Cl2 N O S | P b c a | 10.0743; 10.8754; 20.7109 90; 90; 90 | 2269.13 | Banert, Klaus; Hagedorn, Manfred; Wutke, Jens; Ecorchard, Petra; Schaarschmidt, Dieter; Lang, Heinrich Elusive ethynyl azides: trapping by 1,3-dipolar cycloaddition and decomposition to cyanocarbenes Chemical Communications, 2010, 46, 4058 |
2224583 | CIF HKL Paper | C10 H9 Cl2 N O2 | P b c a | 9.7171; 8.2834; 27.4857 90; 90; 90 | 2212.3 | Jotani, Mukesh M.; Jasinski, Jerry P.; Baldaniya, Bharat B.; Butcher, Ray J. <i>N</i>-(3,4-Dichlorophenyl)-3-oxobutanamide Acta Crystallographica Section E, 2010, 66, o58-o59 |
8106459 | CIF | C10 H9 Cl2 N2 O4 | P b c a | 11.151; 7.0923; 29.243 90; 90; 90 | 2312.7 | Qi, Bo-Shu; Sun, Xiao-Nan; Yang, Huan-Huan; Fu, Ying; Ye, Fei Crystal structure of 2-dichloromethyl-2-p-nitrophenyl-1,3-dioxolane, C10H9Cl2NO4 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 137-138 |
4000901 | CIF | C10 H9 Cu N2 O2 | P b c a | 11.924; 5.2521; 14.989 90; 90; 90 | 938.7 | Vidjayacoumar, Balamurugan; Emslie, David J. H.; Clendenning, Scott B.; Blackwell, James M.; Britten, James F.; Rheingold, Arnold Investigation of AlMe3, BEt3, and ZnEt2as Co-Reagents for Low-Temperature Copper Metal ALD/Pulsed-CVD Chemistry of Materials, 2010, 22, 4844 |
2217412 | CIF HKL Paper | C10 H9 F N2 O2 | P b c a | 7.096; 11.348; 22.661 90; 90; 90 | 1824.8 | Kashif, M. Kaleem; Hussain, Abid; Khawar Rauf, M.; Ebihara, Masahiro; Hameed, Shahid 5-(4-Fluorophenyl)-5-methylimidazolidine-2,4-dione Acta Crystallographica Section E, 2008, 64, o444-o444 |
2240071 | CIF HKL Paper | C10 H9 F N4 O4 | P b c a | 12.6487; 7.0786; 23.72 90; 90; 90 | 2123.77 | Kathikeyan, Ammasai; Thomas Muthiah, Packianathan; Perdih, Franc Crystal structure of 4-amino-5-fluoro-2-oxo-2,3-dihydropyrimidin-1-ium 3-hydroxypyridine-2-carboxylate Acta Crystallographica Section E, 2014, 70, 328-330 |
4024198 | CIF | C10 H9 F5 N O4 P | P b c a | 11.1322; 9.4331; 25.1364 90; 90; 90 | 2639.6 | Jinhua Song; Hiroshi Yamataka; Zvi Rappoport Dialkoxyphosphinyl-Substituted Enols of Carboxamides Journal of Organic Chemistry, 2007, 72, 7605-7624 |
2216982 | CIF HKL Paper | C10 H9 N O | P b c a | 12.6542; 10.9976; 23.6264 90; 90; 90 | 3288 | Fazaeli, Yousef; Amini, Mostafa M.; Shan Gao; Ng, Seik Weng 8-Hydroxy-2-methylquinoline Acta Crystallographica Section E, 2008, 64, o97-o97 |
2231611 | CIF HKL Paper | C10 H9 N O | P b c a | 7.4348; 14.0589; 15.6401 90; 90; 90 | 1634.8 | Yuan, Maosen; Wang, Qi; Zhang, Yuejun; Wang, Junru Spiro[cyclopropane-1,3'-indolin]-2'-one Acta Crystallographica Section E, 2011, 67, o2456 |
7116946 | CIF | C10 H9 N O | P b c a | 15.005; 12.061; 18.219 90; 90; 90 | 3297.2 | Yanli Xu; Weigao Hu; Xiaodong Tang; Jinwu Zhao; Wanqing Wu; Huanfeng Jiang Palladium-catalyzed Csp2-H carbonylation of aromatic oximes: selective access to benzo[d][1,2]oxazin-1-ones and 3-methyleneisoindolin-1-ones Chem.Commun., 2015, 51, 6843 |
1519805 | CIF | C10 H9 N O S | P b c a | 14.2845; 5.4226; 22.7593 90; 90; 90 | 1762.92 | Huth, Susanne L.; Hursthouse, Michael B. (6-Thien-2-ylpyrid-3-yl)methanol Crystal Structure Report Archive, 2007, 373 |
4034107 | CIF | C10 H9 N O2 | P b c a | 8.431; 9.685; 20.623 90; 90; 90 | 1684 | Li, Ming; Wang, Jia-Hui; Li, Wei; Lin, Cheng-Dong; Zhang, Lin-Bao; Wen, Li-Rong N-Phenoxyamides as Multitasking Reagents: Base-Controlled Selective Construction of Benzofurans or Dihydrobenzofuro[2,3- d]oxazoles. The Journal of organic chemistry, 2019, 84, 8523-8530 |
1504118 | CIF | C10 H9 N O2 S | P b c a | 9.4658; 10.2821; 19.9354 90; 90; 90 | 1940.28 | Palsuledesai, Charuta C.; Murru, Siva; Sahoo, Santosh K.; Patel, Bhisma K. Acyl-isothiocyanates as efficient thiocyanate transfer reagents. Organic letters, 2009, 11, 3382-3385 |
2204438 | CIF HKL Paper | C10 H9 N O3 S | P b c a | 11.12; 10.529; 16.253 90; 90; 90 | 1902.9 | Graham Smith; Urs D. Wermuth; David J. Young; Jonathan M. White Zwitterionic 5-amino-2-naphthalenesulfonic acid Acta Crystallographica Section E, 2004, 60, o2014-o2016 |
2223428 | CIF HKL Paper | C10 H9 N O3 S | P b c a | 9.4337; 10.6359; 18.6775 90; 90; 90 | 1874.02 | Mahmood, Ayyaz; Rashid, Ayoub; Arshad, Muhammad Nadeem; Sharif, Hafiz Muhammad Adeel; Khan, Islam Ullah 1-Ammonionaphthalene-2-sulfonate Acta Crystallographica Section E, 2009, 65, o2505 |
2010768 | CIF HKL Paper | C10 H9 N3 O | P b c a | 8.752; 10.525; 20.619 90; 90; 90 | 1899.3 | Novoa de Armas, Héctor; Blaton, Norbert M.; Peeters, Oswald M.; De Ranter, Camiel J.; Pita, Beatriz; Sotelo, Eddy; Ravinã, Enrique; Suárez, Margarita 5-Amino-6-phenyl-1,6-dihydropyridazin-3(2<i>H</i>)-one Acta Crystallographica Section C, 2000, 56, 345-346 |
2101092 | CIF Paper | C10 H9 N3 O | P b c a | 7.36; 7.469; 33.061 90; 90; 90 | 1817.4 | Prout, K.; Bannister, C.; Burns, K.; Chen, M.; Warrington, B. H.; Vinter, J. G. Crystal and molecular structures of pyridazinone cardiovascular agents Acta Crystallographica Section B, 1994, 50, 71-85 |
2219201 | CIF HKL Paper | C10 H9 N3 O | P b c a | 9.3129; 8.1166; 24.0475 90; 90; 90 | 1817.73 | Özel Güven, Özden; Tahtacı, Hakan; Coles, Simon J.; Hökelek, Tuncer 1-Phenyl-2-(1<i>H</i>-1,2,4-triazol-1-yl)ethanone Acta Crystallographica Section E, 2008, 64, o1604 |
7233071 | CIF | C10 H9 N3 O | P b c a | 10.5391; 9.15; 19.861 90; 90; 90 | 1915.3 | Zhang, Dongsheng; Fan, Yingzhu; Yan, Zhongliang; Nie, Yi; Xiong, Xingquan; Gao, Lizhu Reactions of α-haloacroleins with azides: highly regioselective synthesis of formyl triazoles Green Chemistry, 2019, 21, 4211 |
4329338 | CIF | C10 H9 N3 O2 | P b c a | 8.2524; 20.189; 11.2555 90; 90; 90 | 1875.3 | Daniel Lässig; Jörg Lincke; Renata Gerhardt; Harald Krautscheid Solid-State Syntheses of Coordination Polymers by Thermal Conversion of Molecular Building Blocks and Polymeric Precursors Inorganic Chemistry, 2012, 51, 6180-6189 |
4329339 | CIF | C10 H9 N3 O2 | P b c a | 10.6417; 21.0934; 17.095 90; 90; 90 | 3837.3 | Daniel Lässig; Jörg Lincke; Renata Gerhardt; Harald Krautscheid Solid-State Syntheses of Coordination Polymers by Thermal Conversion of Molecular Building Blocks and Polymeric Precursors Inorganic Chemistry, 2012, 51, 6180-6189 |
2237571 | CIF HKL Paper | C10 H9 N3 O3 | P b c a | 8.3246; 14.9567; 16.4461 90; 90; 90 | 2047.68 | Ouzidan, Younès; Kandri Rodi, Youssef; Kandri Rodi, Adiba; Essassi, El Mokhtar; Saadi, Mohamed; El Ammari, Lahcen 1-Allyl-5-nitro-1<i>H</i>-benzimidazol-2(3<i>H</i>)-one Acta Crystallographica Section E, 2013, 69, o431 |
2224425 | CIF HKL Paper | C10 H9 N3 S | P b c a | 14.562; 8.1252; 16.211 90; 90; 90 | 1918.1 | Zeng, Xiu-Xiu; Ye, Ting-Hong; Lun, Dong-Wen; Yu, Luo-Ting; Yang, Li 3-Amino-4,6-dimethylthieno[2,3-<i>b</i>]pyridine-2-carbonitrile Acta Crystallographica Section E, 2009, 65, o3138 |
2021772 | CIF HKL Paper | C10 H9 N5 O | P b c a | 12.251; 7.457; 20.863 90; 90; 90 | 1906 | Fusco, Sandra; Capasso, Domenica; Centore, Roberto; Di Gaetano, Sonia; Parisi, Emmanuele A new biologically active molecular scaffold: crystal structure of 7-(3-hydroxyphenyl)-4-methyl-2<i>H</i>-[1,2,4]triazolo[3,2-<i>c</i>][1,2,4]triazole and selective antiproliferative activity of three isomeric triazolo‒triazoles Acta Crystallographica Section C, 2019, 75, 1398-1404 |
2013400 | CIF HKL Paper | C10 N12 O6 | P b c a | 6.43; 13.709; 17.134 90; 90; 90 | 1510.3 | Averkiev, Boris B.; Antipin, Mikhail Yu.; Sheremetev, Aleksey B.; Timofeeva, Tatiana V. Four 3-cyanodifurazanyl ethers: potential propellants Acta Crystallographica Section C, 2003, 59, o383-o387 |
7208386 | CIF | C10.62 H32.32 Ge7 N5.31 O17 | P b c a | 17.445; 13.883; 24.348 90; 90; 90 | 5897 | Inge, A. Ken; Sun, Junliang; Moraga, Francisca; Guo, Bing; Zou, Xiaodong Three low-dimensional open-germanates based on the 44 net CrystEngComm, 2012, 14, 5465 |
7238000 | CIF | C10.71 H24.71 I4 N2 Pb S1.29 | P b c a | 8.81; 8.678; 28.972 90; 90; 90 | 2215 | Wei, Wen-Juan; Li, Chao; Li, Lin-Sui; Tang, Yun-Zhi; Jiang, Xing-Xing; Lin, Zhe-Shuai Phase transition, optical and dielectric properties regulated by anion-substitution in a homologous series of 2D hybrid organic‒inorganic perovskites Journal of Materials Chemistry C, 2019, 7, 11964 |
7127196 | CIF | C10.86 H10.29 O1.14 | P b c a | 7.2898; 15.8113; 25.4414 90; 90; 90 | 2932.41 | Gao, Bingjian; Zou, Suchen; Yang, Guoqing; Ding, Yongzheng; Huang, Hanmin Carbonylative cycloaddition between two different alkenes enabled by reactive directing groups: expedited construction of bridged polycyclic skeletons. Chemical communications (Cambridge, England), 2020, 56, 12198-12201 |
1528957 | CIF | C10.878 H29.634 Ga I1.122 Si3 | P b c a | 13.4043; 11.6463; 24.321 90; 90; 90 | 3796.76 | Viefhaus, T.; Schwarz, W.; Locke, K.; Huebler, K.; Weidlein, J. Das unterschiedliche Reaktionsverhalten von basefreiem Tris(trimethylsilyl)methyl-Lithium gegenueber den Trihalogeniden der Erdmetalle und des Eisens Zeitschrift fuer Anorganische und Allgemeine Chemie, 2001, 627, 715-725 |
4516073 | CIF | C10.91 H12.73 Cl1.09 O0.91 Ti | P b c a | 12.489; 11.4556; 14.6289 90; 90; 90 | 2092.94 | Boyde, Nicholas C.; Steelman, Grant W.; Hanusa, Timothy P. Multicomponent Mechanochemical Synthesis of Cyclopentadienyl Titanium <i>tert</i>-Butoxy Halides, Cp <sub> <i>x</i> </sub> TiX <sub> <i>y</i> </sub> (O <sup> <i>t</i> </sup> Bu)<sub>4-(<i>x</i>+<i>y</i>)</sub> (<i>x</i>, <i>y</i> = 1, 2; X = Cl, Br). ACS omega, 2018, 3, 8149-8159 |
1571292 | CIF | C100 H122 Ag2 N4 O14 S8 Zr2 | P b c a | 26.4396; 12.2954; 32.4346 90; 90; 90 | 10544 | Liu, Chao; Li, Liang-Jun; Mu, Wen-Lei; Tian, Yi-Qi; Yu, Weidong; Li, Lanyan; Yan, Jun Ag1+ Incorporation via Zr4±Anchored Metalloligand: Fine-Tuning the Catalytic Ag Sites in Zr/Ag Bimetallic Clusters for Enhanced eCO2RR-to-CO activity Chemical Science, 2024 |
7043491 | CIF | C100 H124 Mg2 N4 O14 | P b c a | 21.5029; 19.1115; 27.069 90; 90; 90 | 11124.1 | Reiner, Benjamin R.; Foxman, Bruce M.; Wade, Casey R. Electrochemical and Structural Investigation of the Interactions between Naphthalene Diimides and Metal Cations Dalton Trans., 2017 |
7106930 | CIF | C100 H160 Cu2 N8 O12 | P b c a | 23.49; 16.875; 24.537 90; 90; 90 | 9726 | Maria Castellano; Jesus Ferrando-Soria; Emilio Pardo; Miguel Julve; Francesc Lloret; Corine Mathoniere; Jorge Pasan; Catalina Ruiz-Perez; Laura Canadillas-Delgado; Rafael Ruiz-Garcia; Joan Cano Photoswitching of the antiferromagnetic coupling in an oxamato-based dicopper(II) anthracenophane Chem.Commun., 2011, 47, 11035 |
7029197 | CIF | C100 H74 N16 O17 Zn4 | P b c a | 18.737; 20.667; 23.441 90; 90; 90 | 9077 | Jia, Hongliang; Li, Yanlin; Xiong, Zhifang; Wang, Chengjie; Li, Gang Five metal-organic frameworks from 3,4-dimethylphenyl substituted imidazole dicarboxylate: syntheses, structures and properties. Dalton transactions (Cambridge, England : 2003), 2014, 43, 3704-3715 |
4069372 | CIF | C100 H92 Br4 Cl4 F12 Ir4 N8 O16 S4 | P b c a | 24.131; 31.7; 35.12 90; 90; 90 | 26865 | Jia, Wei-Guo; Han, Ying-Feng; Lin, Yue-Jian; Weng, Lin-Hong; Jin, Guo-Xin Stepwise Formation of Half-Sandwich Iridium-Based Rectangles Containing 2,5-Diarylamino-1,4-benzoquinone Derivatives Linkers Organometallics, 2009, 28, 3459 |
4069371 | CIF | C100 H92 Cl8 F12 Ir4 N8 O16 S4 | P b c a | 24.014; 31.496; 35.049 90; 90; 90 | 26509 | Jia, Wei-Guo; Han, Ying-Feng; Lin, Yue-Jian; Weng, Lin-Hong; Jin, Guo-Xin Stepwise Formation of Half-Sandwich Iridium-Based Rectangles Containing 2,5-Diarylamino-1,4-benzoquinone Derivatives Linkers Organometallics, 2009, 28, 3459 |
7109096 | CIF | C100.5 H173 Cr7 F8 N Ni O33.5 S | P b c a | 27.3418; 32.3342; 30.4098 90; 90; 90 | 26884.6 | Harapriya Rath; Grigore A. Timco; Valdis Corradini; Alberto Ghirri; Umberto del Pennino; Antonio Fernandez; Robin G. Pritchard; Christopher A. Muryn; Marco Affronte; Richard E. P. Winpenny Studies of hybrid organic-inorganic [2] and [3]rotaxanes bound to Au surfaces Chem.Commun., 2013, 49, 3404 |
4330313 | CIF | C101 H104 Cl2 Mg2 N26 O16 | P b c a | 18.091; 18.431; 30.877 90; 90; 90 | 10295 | Sk Asif Ikbal; Sanfaori Brahma; Sankar Prasad Rath Building-up Remarkably Stable Magnesium Porphyrin Polymers Self-Assembled via Bidentate Axial Ligands: Synthesis, Structure, Surface Morphology, and Effect of Bridging Ligands Inorganic Chemistry, 2012, 51, 9666-9676 |
7002625 | CIF | C101 H164 Al4 O12 S4 | P b c a | 14.9642; 28.4632; 50.1873 90; 90; 90 | 21376.2 | Shekar, Sukesh; Taylor, Mamie M.; Twamley, Brendan; Wehmschulte, Rudolf J. Synthesis of aryloxyaluminium hydrides and their conversion into aryloxyalumoxanes (ArOAlO)n Dalton Transactions, 2009, 9322 |
7107411 | CIF | C101 H50 N2 O5 | P b c a | 32.301; 11.246; 36.097 90; 90; 90 | 13112 | Liangbing Gan; Shuming Liu; Yuanhua Shao Synthesis of a green [60]fullerene derivative through cage-opening reactions Chem.Commun., 2012, 48, 2531 |
4031770 | CIF | C101 H57 B2 F40 N2 O4 | P b c a | 22.6937; 25.4639; 31.677 90; 90; 90 | 18305 | Kurata, Ryohei; Tanaka, Kazuyoshi; Ito, Akihiro Isolation and Characterization of Persistent Radical Cation and Dication of 2,7-Bis(dianisylamino)pyrene. The Journal of organic chemistry, 2016, 81, 137-145 |
7108166 | CIF | C102 Ge N9 O36 W10 | P b c a | 17.7471; 31.6276; 48.1971 90; 90; 90 | 27052.9 | Kosei Sugahara; Toshihiro Kimura; Keigo Kamata; Kazuya Yamaguchi; Noritaka Mizuno A highly negatively charged Y-Keggin germanodecatungstate efficient for Knoevenagel condensation Chem.Commun., 2012, 48, 8422-8424 |
7241332 | CIF | C102 H120 N6 O27 S4 Zn3 | P b c a | 26.971; 23.006; 35.506 90; 90; 90 | 22031 | KNIAZEVA, Mariia; Ovsyannikov, Alexander; Islamov, Daut; Samigullina, Aida I.; Gubaidullin, Aidar Timergalievich; Dorovatovskii, Pavel; Solovieva, Svetlana; Igor, Antipin S.; Ferlay, Sylvie Nuclearity control in calix[4]arene based zinc (II) coordination complexes CrystEngComm, 2020 |
7711704 | CIF | C102 H134 B3 Cr F12 N14 | P b c a | 20.8456; 34.2952; 28.337 90; 90; 90 | 20258.2 | Stein, Laura; Wang, Cui; Förster, Christoph; Resch-Genger, Ute; Heinze, Katja Bulky ligands protect molecular ruby from oxygen quenching Dalton Transactions, 2022 |
4107768 | CIF | C102 H136 D12 Fe2 N10 | P b c a | 24.789; 24.031; 15.525 90; 90; 90 | 9248 | Ryan E. Cowley; Jérôme Elhaïk; Nathan A. Eckert; William W. Brennessel; Eckhard Bill; Patrick L. Holland A Bridging Hexazene (RNNNNNNR) Ligand from Reductive Coupling of Azides Journal of the American Chemical Society, 2008, 130, 6074-6075 |
7112078 | CIF | C102 H152 K2 N6 O12 | P b c a | 20.9918; 20.793; 23.169 90; 90; 90 | 10112.9 | Andreas A. Danopoulos; Pierre Braunstein 'Janus-type' organopotassium chemistry observed in deprotonation of mesoionic imidazolium aminides and amino N-heterocyclic carbenes: coordination and organometallic polymers Chem.Commun., 2014, 50, 3055 |
1563092 | CIF | C102 H162.41 Cr8 Cu F20 N3 O36.2 | P b c a | 28.1451; 28.482; 36.1611 90; 90; 90 | 28988 | Lockyer, Selena; Chiesa, Alessandro; Timco, Grigore A.; Bennett, Thomas M.; Vitorica-Yrzebal, Inigo; McInnes, Eric J. L.; Carretta, Stefano; Winpenny, Richard E. P. Targeting Molecular Quantum Memory with Embedded Error Correction Chemical Science, 2021 |
7109101 | CIF | C102 H176 Cr7 F8 N Ni O34 S | P b c a | 30.2347; 27.492; 32.197 90; 90; 90 | 26762.5 | Harapriya Rath; Grigore A. Timco; Valdis Corradini; Alberto Ghirri; Umberto del Pennino; Antonio Fernandez; Robin G. Pritchard; Christopher A. Muryn; Marco Affronte; Richard E. P. Winpenny Studies of hybrid organic-inorganic [2] and [3]rotaxanes bound to Au surfaces Chem.Commun., 2013, 49, 3404 |
4311251 | CIF | C102 H192 Mn22 N4 O78 | P b c a | 25.229; 20.655; 33.56 90; 90; 90 | 17488 | Muralee Murugesu; James Raftery; Wolfgang Wernsdorfer; George Christou; Euan K. Brechin Synthesis, Structure, and Magnetic Properties of a [Mn22] Wheel-like Single-Molecule Magnet Inorganic Chemistry, 2004, 43, 4203-4209 |
4339859 | CIF | C102 H192 Mn22 N4 O78 | P b c a | 25.229; 20.655; 33.56 90; 90; 90 | 17488 | Manoli, Maria; Prescimone, Alessandro; Bagai, Rashmi; Mishra, Abhudaya; Murugesu, Muralee; Parsons, Simon; Wernsdorfer, Wolfgang; Christou, George; Brechin, Euan K. High-spin Mn wheels. Inorganic chemistry, 2007, 46, 6968-6979 |
4035951 | CIF | C102 H24 Lu3 N3 O S2 | P b c a | 25.423; 15.6051; 28.953 90; 90; 90 | 11486 | Shen, Wangqiang; Yang, Le; Wu, Yongbo; Bao, Lipiao; Li, Ying; Jin, Peng; Fang, Hongyun; Xie, Yunpeng; Lu, Xing Reactions between N-Heterocyclic Carbene and Lutetium-Metallofullerenes: High Regioselectivity Directed by Electronic Effect in Addition to Steric Hindrance. The Journal of organic chemistry, 2019, 84, 606-612 |
4333052 | CIF | C102 H85 Mn7 N8 O25 | P b c a | 27.695; 22.43; 30.293 90; 90; 90 | 18818 | Mishra, Abhudaya; Wernsdorfer, Wolfgang; Abboud, Khalil A.; Christou, George [Mn7O5(OR)2(O2CPh)9(terpy)] (R = Me, CH2Ph) Complexes with a Fused Cubane/Butterfly Core and anS= 6 Ground-State Spin Inorganic Chemistry, 2006, 45, 10197-10206 |
4087973 | CIF | C103 H108 Fe2 P4 | P b c a | 20.69; 20.374; 40.538 90; 90; 90 | 17088 | Malvolti, Floriane; Rouxel, Cédric; Triadon, Amédée; Grelaud, Guillaume; Richy, Nicolas; Mongin, Olivier; Blanchard-Desce, Mireille; Toupet, Loic; Razak, Fazira I. Abdul; Stranger, Robert; Samoc, Marek; Yang, Xinwei; Wang, Genmiao; Barlow, Adam; Cifuentes, Marie P.; Humphrey, Mark G.; Paul, Frédéric 2,7-Fluorenediyl-Bridged Complexes Containing Electroactive “Fe(η5-C5Me5)(κ2-dppe)C≡C‒” End Groups: Molecular Wires and Remarkable Nonlinear Electrochromes Organometallics, 2015, 34, 5418 |
7016097 | CIF | C103 H108 Fe2 P4 | P b c a | 20.69; 20.374; 40.538 90; 90; 90 | 17088 | Malvolti, Floriane; Rouxel, Cedric; Mongin, Olivier; Hapiot, Philippe; Toupet, Loic; Blanchard-Desce, Mireille; Paul, Frédéric Optical electron transfer through 2,7-diethynylfluorene spacers in mixed-valent complexes containing electron-rich "(η(2)-dppe)(η(5)-C(5)Me(5))Fe" endgroups. Dalton transactions (Cambridge, England : 2003), 2011, 40, 6616-6618 |
7029924 | CIF | C103 H86 Cl12 Co10 N12 O31 P2 | P b c a | 20.433; 21.915; 27.106 90; 90; 90 | 12138 | Langley, Stuart K.; Helliwell, Madeleine; Teat, Simon J.; Winpenny, Richard E. P. Synthesis and characterisation of cobalt(II) phosphonate cage complexes utilizing carboxylates and pyridonates as co-ligands. Dalton transactions (Cambridge, England : 2003), 2012, 41, 12807-12817 |
4103798 | CIF | C104 H104 Li2 O2 P6 S6 U | P b c a | 29.658; 21.8217; 29.9635 90; 90; 90 | 19392 | Thibault Cantat; Thérèse Arliguie; Anne Noël; Pierre Thuéry; Michel Ephritikhine; Pascal Le Floch; Nicolas Mézailles The U=C Double Bond: Synthesis and Study of Uranium Nucleophilic Carbene Complexes Journal of the American Chemical Society, 2009, 131, 963-972 |
7000495 | CIF | C104 H137 Cr2 N2 O12.5 | P b c a | 21.5322; 18.5174; 24.3085 90; 90; 90 | 9692.3 | Redshaw, Carl; Homden, Damien; Hughes, David L.; Wright, Joseph A.; Elsegood, Mark R. J. New structural motifs in chromium(iii) calix[4 and 6]arene chemistry Dalton Transactions, 2009, 1231-1242 |
7114445 | CIF | C104 H72 Cu4 N8 O20 | P b c a | 23.358; 15.008; 25.479 90; 90; 90 | 8932 | Liu, Gao-Feng; Ye, Bao-Hui; Ling, Yong-Hua; Chen, Xiao-Ming Interlocking of molecular rhombi into a 2D polyrotaxane network via π‒π interactions. Crystal structure of [Cu2(bpa)2(phen)2(H2O)]2·2H2O (bpa2‒ = biphenyl-4,4′-dicarboxylate, phen = 1,10-phenanthroline) Chemical Communications, 2002, 1442 |
2010392 | CIF Paper | C104 H88 Au2 Cl6 Fe3 P6 | P b c a | 19.142; 20.759; 23.645 90; 90; 90 | 9396 | Houlton, A.; Mingos, D.M.P.; Murphy, D.M.; Williams, D.J. [Au~2~Cl~2~(fdpp)~3~], a Structural Intermediate in the Assembly of Gold‒Phosphine Chain Polymers Acta Crystallographica Section C, 1995, 51, 30-32 |
4331113 | CIF | C104.5 H148 N8 O8 Rh2 | P b c a | 22.4517; 28.7074; 31.8954 90; 90; 90 | 20557.5 | Géza Szigethy; David W. Shaffer; Alan F. Heyduk Coordination Effects on Electron Distributions for Rhodium Complexes of the Redox-Active Bis(3,5-di-tert-butyl-2-phenolate)amide Ligand Inorganic Chemistry, 2012, 51, 12606-12618 |
7124673 | CIF | C105 H105 N5 | P b c a | 32.7165; 16.1948; 39.103 90; 90; 90 | 20718.2 | Qiao, Bo; Anderson, Joseph R.; Pink, Maren; Flood, Amar H. Size-matched recognition of large anions by cyanostar macrocycles is saved when solvent-bias is avoided. Chemical communications (Cambridge, England), 2016, 52, 8683-8686 |
7019327 | CIF | C105.5 H76 Cd2 N10 Ni2 O20.5 | P b c a | 59.431; 9.3517; 41.7871 90; 90; 90 | 23224.5 | Smythe, Nathan C.; Butler, Derek P.; Moore, Curtis E.; McGowan, William R.; Rheingold, Arnold L.; Beauvais, Laurance G. A heterobimetallic metal-organic framework with tunable reactive metal sites: synthesis, characterization, and reactivity. Dalton transactions (Cambridge, England : 2003), 2012, 41, 7855-7858 |
7057948 | CIF | C106 H108 Ag14 F24 N6 O22 S6 | P b c a | 17.109; 26.729; 29.365 90; 90; 90 | 13429 | Li, Yan-Ling; Xu, Qing-Qing; Li, Si; Huang, Ren-Wu; Liu, Xiao-Fei; Wei, Yong-Li; Zang, Shuang-Quan Investigating the influence of a CrO42−/Cr2O72− template in the formation of a series of silver‒chalcogenide clusters New Journal of Chemistry, 2019, 43, 115 |
2204890 | CIF HKL Paper | C106 H112 K2 N16 Ni7 O20 | P b c a | 14.3214; 24.855; 29.709 90; 90; 90 | 10575.2 | Skovgaard, Signe; Bond, Andrew D.; McKenzie, Christine J. Dipotassium hexakis({2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato}nickel(II)) tetracyanonickelate(II) methanol hexasolvate dihydrate Acta Crystallographica Section E, 2005, 61, m135-m137 |
4134765 | CIF | C106 H136 F12 Ir4 N4 O26 S4 | P b c a | 21.999; 18.835; 27.602 90; 90; 90 | 11437 | Cui, Peng-Fei; Lin, Yue-Jian; Li, Zhen-Hua; Jin, Guo-Xin Dihydrogen Bond Interaction Induced Separation of Hexane Isomers by Self-Assembled Carborane Metallacycles. Journal of the American Chemical Society, 2020 |
4103421 | CIF | C107 H192 Cr7 F8 Fe N O35 | P b c a | 29.828; 27.8513; 32.3305 90; 90; 90 | 26858.5 | Beatriz Ballesteros; Thomas B. Faust; Chin-Fa Lee; David A. Leigh; Christopher A. Muryn; Robin G. Pritchard; David Schultz; Simon J. Teat; Grigore A. Timco; Richard E. P. Winpenny Synthesis, Structure, and Dynamic Properties of Hybrid Organic-Inorganic Rotaxanes Journal of the American Chemical Society, 2010, 132, 15435-15444 |
4131012 | CIF | C108 H102 Ag4 N2 P4 | P b c a | 19.6169; 27.203; 37.155 90; 90; 90 | 19827 | Hau, Sam C. K.; Yeung, Margaret C.-L.; Yam, Vivian W.-W.; Mak, Thomas C. W. Assembly of Heterometallic Silver(I)-Copper(I) Alkyl-1,3-diynyl Clusters via Inner-Core Expansion. Journal of the American Chemical Society, 2016, 138, 13732-13739 |
7009555 | CIF | C108 H105 B2 Cl2 Co2 N16 O19.5 Pb2 | P b c a | 44.812; 27.865; 18.344 90; 90; 90 | 22906 | Furutachi, Hideki; Fujinami, Shuhei; Suzuki, Masatatsu; Ōkawa, Hisashi Dinuclear CoIIMII (M = Pb or Co) complexes having a “Co(salen)” entity in a macrocyclic framework: ligand modulation effect and neighboring metal(II) effect upon oxygenation at the “Co(salen)” center Journal of the Chemical Society, Dalton Transactions, 2000, 2761 |
4300508 | CIF | C108 H88 Cl2 Fe2 N2 O8 | P b c a | 13.751; 23.133; 27.455 90; 90; 90 | 8734 | Inorganic Chemistry, 2006 |
7206269 | CIF | C108 H92 Mn4 N8 O26 S4 | P b c a | 24.492; 16.886; 25.983 90; 90; 90 | 10746 | Chen, Haiyan; Xiao, Dongrong; He, Jianghong; Li, Zhifu; Zhang, Guangju; Sun, Dianzhen; Yuan, Ruo; Wang, Enbo; Luo, Qun-Li A series of novel entangled coordination frameworks with inherent features of self-threading, polyrotaxane and polycatenane CrystEngComm, 2011, 13, 4988 |
4339860 | CIF | C109 H208 Br8 Mn22 N4 O81 | P b c a | 25.1814; 20.8101; 33.712 90; 90; 90 | 17666 | Manoli, Maria; Prescimone, Alessandro; Bagai, Rashmi; Mishra, Abhudaya; Murugesu, Muralee; Parsons, Simon; Wernsdorfer, Wolfgang; Christou, George; Brechin, Euan K. High-spin Mn wheels. Inorganic chemistry, 2007, 46, 6968-6979 |
7047160 | CIF | C109 H56 Cl2 F36 Ir2 N12 | P b c a | 23.6369; 18.4262; 24.0732 90; 90; 90 | 10484.8 | Tong, Bihai; Wang, Han; Chen, Man; Zhou, Shixiong; Hu, Yuanyuan; Zhang, Qianfeng; He, Gufeng; Fu, Lianshe; Shi, Huatian; Jin, Long; Zhou, Huidong High efficiency green OLEDs based on homoleptic iridium complexes with steric phenylpyridazine ligands. Dalton transactions (Cambridge, England : 2003), 2018, 47, 12243-12252 |
7707060 | CIF | C11 H0 Cd F N4 S3 | P b c a | 16.4557; 10.7894; 19.3242 90; 90; 90 | 3431 | Wang, Yu-Zhen; Zhang, Zhi-Xu; Su, Chang-Yuan; Zhang, Tie; Fu, Da-Wei; Zhang, Yi A-site cation with high vibrational motion in ABX<sub>3</sub> perovskite effectively induces dielectric phase transition. Dalton transactions (Cambridge, England : 2003), 2021, 50, 3841-3847 |
7056617 | CIF | C11 H10 B Cl2 F2 N7 | P b c a | 9.7915; 10.7841; 28.665 90; 90; 90 | 3026.8 | Yousaf, Muhammad; Yutronkie, Nathan J.; Castañeda, Raúl; Klein, Jacob A.; Brusso, Jaclyn Boratriazines: inducing luminescence through boron incorporation into a terpy-type framework New J. Chem., 2017 |
7215812 | CIF | C11 H10 Br N O3 | P b c a | 12.936; 12.022; 14.578 90; 90; 90 | 2267.1 | Zou, You-Quan; Guo, Wei; Liu, Feng-Lei; Lu, Liang-Qiu; Chen, Jia-Rong; Xiao, Wen-Jing Visible-light-induced photocatalytic formyloxylation reactions of 3-bromooxindoles with water and DMF: the scope and mechanism Green Chemistry, 2014, 16, 3787 |
7026636 | CIF | C11 H10 Br2 Co N2 S2 | P b c a | 12.7216; 14.0186; 16.9669 90; 90; 90 | 3025.9 | Belén Lago, Ana; Amoedo, Almudena; Carballo, Rosa; García-Martínez, Emilia; Vázquez-López, Ezequiel M Metal coordination and in situ S-C bond cleavage of the bis(2-pyridylthio)methane ligand. Dalton transactions (Cambridge, England : 2003), 2010, 39, 10076-10087 |
1502379 | CIF | C11 H10 Br2 N4 O2 | P b c a | 14.934; 9.5657; 17.7739 90; 90; 90 | 2539.08 | Hewlett, Nicole M.; Tepe, Jetze J. Total synthesis of the natural product (±)-dibromophakellin and analogues. Organic letters, 2011, 13, 4550-4553 |
1559530 | CIF | C11 H10 Br2 O2 | P b c a | 8.082; 15.591; 18.264 90; 90; 90 | 2301.4 | Sydnes, Leiv K.; Pettersen, Anita; Drablos, Finn; Romming, Christian Long-Range NMR Coupling between a Cyclopropyl Proton and a Proton next to the Ring in a Number of 2,2-Disubstituted 1,1-Dihalocyclopropanes Acta Chemica Scandinavica, 1991, 45, 902-913 |
7115270 | CIF | C11 H10 Br2 O3 | P b c a | 10.6547; 14.1169; 16.878 90; 90; 90 | 2538.6 | Tian-Yang Yu; Yao Wang; Xiu-Qin Hu; Peng-Fei Xu Triphenylphosphine oxide-catalyzed stereoselective poly- and dibromination of unsaturated compounds Chem.Commun., 2014, 50, 7817 |
7119105 | CIF | C11 H10 Cl I2 N O2 Pt S | P b c a | 12.2175; 11.5867; 45.0661 90; 90; 90 | 6379.6 | Meng, Ting; Tang, Shang-Feng; Qin, Qi-Pin; Liang, Yue-Lan; Wu, Chen-Xuan; Wang, Chen-Yu; Yan, Hou-Tian; Dong, Jia-Xin; Liu, Yan-Cheng Evaluation of the effect of iodine substitution of 8-hydroxyquinoline on its platinum(ii)complex: cytotoxicity, cell apoptosis and telomerase inhibition Med. Chem. Commun., 2016, 7, 1802 |
2232562 | CIF HKL Paper | C11 H10 Cl N O3 | P b c a | 12.131; 7.399; 25.466 90; 90; 90 | 2285.8 | Shakuntala, K.; Vrábel, Viktor; Gowda, B. Thimme; Kožíšek, Jozef <i>N</i>-(4-Chloro-2-methylphenyl)maleamic acid Acta Crystallographica Section E, 2011, 67, o3317 |
7200870 | CIF | C11 H10 Cl N5 | P b c a | 13.0426; 7.8693; 22.6276 90; 90; 90 | 2322.41 | Kaiser, Carlos R.; Pais, Karla C.; de Souza, Marcus V. N.; Wardell, James L.; Wardell, Solange M. S. V.; Tiekink, Edward R. T. Assessing the persistence of the N‒H⋯N hydrogen bonding leading to supramolecular chains in molecules related to the anti-malarial drug, chloroquine CrystEngComm, 2009, 11, 1133-1140 |
7055029 | CIF | C11 H10 Cl2 Cu N2 Se2 | P b c a | 11.9328; 12.2111; 18.6534 90; 90; 90 | 2718 | Cargnelutti, Roberta; da Silva, Felipe Dornelles; Abram, Ulrich; Lang, Ernesto Schulz Metal complexes with bis(2-pyridyl)diselenoethers: structural chemistry and catalysis New J. Chem., 2015, 39, 7948 |
1559531 | CIF | C11 H10 Cl2 O2 | P b c a | 8.129; 14.956; 18.431 90; 90; 90 | 2240.8 | Sydnes, Leiv K.; Pettersen, Anita; Drablos, Finn; Romming, Christian Long-Range NMR Coupling between a Cyclopropyl Proton and a Proton next to the Ring in a Number of 2,2-Disubstituted 1,1-Dihalocyclopropanes Acta Chemica Scandinavica, 1991, 45, 902-913 |
7036542 | CIF | C11 H10 Cl6 Ga2 N2 | P b c a | 9.87; 14.98; 24.874 90; 90; 90 | 3678 | Vasko, Petra; Kinnunen, Virva; O Moilanen, Jani; Roemmele, Tracey L.; Boeré, René T; Konu, Jari; Tuononen, Heikki M. Group 13 complexes of dipyridylmethane, a forgotten ligand in coordination chemistry. Dalton transactions (Cambridge, England : 2003), 2015, 44, 18247-18259 |
4038751 | CIF | C11 H10 F3 N O | P b c a | 8.6036; 11.7912; 21.27 90; 90; 90 | 2157.8 | Chernykh, Anton V.; Olifir, Oleksandr S.; Kuchkovska, Yuliya O.; Volochnyuk, Dmitriy M.; Yarmolchuk, Vladimir S.; Grygorenko, Oleksandr O. Fluoroalkyl-Substituted Cyclopropane Derivatives: Synthesis and Physicochemical Properties. The Journal of organic chemistry, 2020, 85, 12692-12702 |
4344703 | CIF | C11 H10 Fe I N O5 | P b c a | 12.149; 13.696; 16.327 90; 90; 90 | 2716.7 | Song, Li-Cheng; Xu, Kai-Kai; Han, Xiao-Feng; Zhang, Ji-Wei Synthetic and Structural Studies of 2-Acylmethyl-6-R-Difunctionalized Pyridine Ligand-Containing Iron Complexes Related to [Fe]-Hydrogenase. Inorganic chemistry, 2016, 55, 1258-1269 |
4505394 | CIF | C11 H10 I N3 O2 S | P b c a | 10.755; 18.3; 26.828 90; 90; 90 | 5280.2 | Kirchner, Michael T.; Reddy, L. Sreenivas; Desiraju, Gautam R.; Jetti, Ram K. R.; Boese, Roland Structural Variations and Polymorphism of Some Derivatives of 6-Amino-2-phenylsulfonylimino- 1,2-dihydropyridine Crystal Growth & Design, 2004, 4, 701 |
7157719 | CIF | C11 H10 N O | P b c a | 15.014; 10.0228; 21.573 90; 90; 90 | 3246.4 | Luo, Yan; Chen, Chun-Hua; Zhu, Fan; Mo, Dong-Liang Synthesis of α-aminooxy amides through [3 + 3] cycloaddition and Sc(OTf)<sub>3</sub>-catalyzed double C-N bond cleavage in a one-pot reaction. Organic & biomolecular chemistry, 2020, 18, 8209-8218 |
7245268 | CIF | C11 H10 N O | P b c a | 7.3602; 6.965; 50.466 90; 90; 90 | 2587.08 | Yamada, Takahiro; Hashimoto, Yoshimitsu; Tanaka, Kosaku; Morita, Nobuyoshi; Tamura, Osamu Cationic palladium(ii)-catalyzed synthesis of substituted pyridines from α,β-unsaturated oxime ethers RSC Advances, 2022, 12, 21548-21557 |
4325794 | CIF | C11 H10 N2 | P b c a | 9.3869; 18.1191; 21.187 90; 90; 90 | 3603.5 | Marco G. Crestani; Gerald F. Manbeck; William W. Brennessel; Theresa M. McCormick; Richard Eisenberg Synthesis and Characterization of Neutral Luminescent Diphosphine Pyrrole- and Indole-Aldimine Copper(I) Complexes Inorganic Chemistry, 2011, 50, 7172-7188 |
7024037 | CIF | C11 H10 N2 | P b c a | 9.449; 18.186; 21.204 90; 90; 90 | 3643.7 | Gomes, Clara S. B.; Suresh, D.; Gomes, Pedro T.; Veiros, Luis F.; Duarte, M. Teresa; Nunes, Teresa G.; Oliveira, M Conceição Sodium complexes containing 2-iminopyrrolyl ligands: the influence of steric hindrance in the formation of coordination polymers. Dalton transactions (Cambridge, England : 2003), 2010, 39, 736-748 |
2008198 | CIF Paper | C11 H10 N2 O | P b c a | 14.283; 17.083; 7.723 90; 90; 90 | 1884.4 | Leopoldo Suescun; Raúl A. Mariezcurrena; Alvaro W. Mombrú; Danilo Davyt; Eduardo Manta 3-(3-Indolyl)acrylamide Acta Crystallographica Section C, 1999, 55, 211-213 |
2222591 | CIF HKL Paper | C11 H10 N2 O | P b c a | 11.2918; 7.2275; 23.3359 90; 90; 90 | 1904.48 | Shah Bakhtiar, Nasir; Abdullah, Zanariah; Ng, Seik Weng 2-(<i>p</i>-Tolyloxy)pyrimidine Acta Crystallographica Section E, 2009, 65, o1859 |
2004386 | CIF Paper | C11 H10 N2 O S | P b c a | 8.446; 23.76; 10.454 90; 90; 90 | 2098 | Hansell, D. P.; Robinson, K. J.; Wallis, J. D.; Povey, D. C. <i>N</i>-[3-Methyl-2(3<i>H</i>)-thiazolylidene]benzamide Containing a Short Intramolecular S···O Contact Acta Crystallographica Section C, 1996, 52, 136-139 |
4512848 | CIF | C11 H10 N2 O S | P b c a | 12.2113; 8.9422; 19.5495 90; 90; 90 | 2134.7 | Phukan, Nithi; Baruah, Jubaraj B. Polymorphs of Thiazole-Derived Imines Connected to Hydroxyaromatics Crystal Growth & Design, 2015, 15, 1843 |
2022298 | CIF HKL Paper | C11 H10 N2 O2 S | P b c a | 6.921; 7.2371; 42.396 90; 90; 90 | 2123.5 | Shishkina, Svitlana V.; Konovalova, Irina S.; Kovalenko, Sergiy M.; Kravchenko, Dmitriy V.; Bunyatyan, Natalya D. Polymorphism of methyl 4-amino-3-phenylisothiazole-5-carboxylate: an experimental and theoretical study Acta Crystallographica Section C, 2021, 77, 40-48 |
2215066 | CIF HKL Paper | C11 H10 N2 O3 | P b c a | 11.402; 7.9941; 24.039 90; 90; 90 | 2191.1 | Yao, Xiao-Ling; Jing, Zuo-Liang (<i>E</i>)-<i>N</i>'-[(5-Methylfuran-2-yl)methylene]furan-2-carbohydrazide Acta Crystallographica Section E, 2007, 63, o3900-o3900 |
1545406 | CIF | C11 H10 N2 O5 | P b c a | 4.8748; 17.909; 23.571 90; 90; 90 | 2057.8 | Chan, Chieh-Kai; Tsai, Yu-Lin; Chang, Meng-Yang Construction of Nitrated Benzo[3.3.1]bicyclic Acetal/Ketal Core via Nitration of o-Carbonyl Allylbenzenes. Organic letters, 2017, 19, 1358-1361 |
7225577 | CIF | C11 H10 N2 S | P b c a | 9.3748; 7.8979; 26.98 90; 90; 90 | 1997.6 | Zeng, Fanxun; Liu, Pengjian; Li, Z.; Shao, Xusheng; Xu, Xiaoyong Catalyst-Free and Selective Synthesis of 2-Aminothiophenes and 2-Amino-4,5-dihydrothiophenes from 4-Thiazolidinones in Water RSC Adv., 2016 |
7212233 | CIF | C11 H10 N4 | P b c a | 11.7861; 7.229; 23.2069 90; 90; 90 | 1977.27 | Petitjean, Anne; Xing, Liyan; Wang, Ruiyao Functional formamidines: pyridine substituents make an exception in the usual doubly hydrogen-bonded formamidine dimer CrystEngComm, 2010, 12, 1397 |
1542689 | CIF | C11 H10 N4 O3 | P b c a | 10.487; 13.0919; 16.145 90; 90; 90 | 2216.6 | Pawar, Govind Goroba; Brahmanandan, Abhilashamole; Kapur, Manmohan Palladium(II)-Catalyzed, Heteroatom-Directed, Regioselective C-H Nitration of Anilines Using Pyrimidine as a Removable Directing Group. Organic letters, 2016, 18, 448-451 |
1559849 | CIF HKL Paper | C11 H10 O | P b c a | 4.9306; 15.7882; 21.0651 90; 90; 90 | 1639.82 | Nazarenko, Alexander Y. Naphthalen-1-ylmethanol IUCrData, 2020, 5, x201646 |
7239714 | CIF | C11 H10 O2 S | P b c a | 11.2374; 10.3578; 16.9587 90; 90; 90 | 1973.9 | Chen, Shihao; Li, Yaping; Wang, Ming; Jiang, Xuefeng General sulfone construction via sulfur dioxide surrogate control Green Chemistry, 2020, 22, 322-326 |
2236184 | CIF HKL Paper | C11 H10 O3 | P b c a | 9.8514; 8.9757; 21.917 90; 90; 90 | 1938 | Lin, Hong-Yi; Chang, Che-Wei; Tsai, Hsing-Yang; Luo, Ming-Hui; Chen, Kew-Yu 3-Oxo-2,3-dihydro-1<i>H</i>-inden-4-yl acetate Acta Crystallographica Section E, 2012, 68, o3075-o3076 |
2236961 | CIF HKL Paper | C11 H10 O3 | P b c a | 6.894; 13.2079; 20.0964 90; 90; 90 | 1829.9 | Koh, Dongsoo 8-Methoxy-2<i>H</i>-chromene-3-carbaldehyde Acta Crystallographica Section E, 2012, 68, o3419 |
2237129 | CIF HKL Paper | C11 H10 O3 | P b c a | 16.9888; 5.4501; 19.735 90; 90; 90 | 1827.28 | Slater, Kara A.; Andersh, Brad; Flint, Edward B.; Ferrence, Gregory M. 6-Phenyloxane-2,4-dione Acta Crystallographica Section E, 2013, 69, o69 |
2206499 | CIF HKL Paper | C11 H11 Ag B F4 N5 S2 | P b c a | 8.7063; 14.7402; 24.965 90; 90; 90 | 3203.8 | Hou, Bao-Hong; Zhou, Li-Na; Wei, Hong-Yuan; Wang, Jing-Kang; Chen, Wei <i>catena</i>-Poly[[[(acetonitrile-κ<i>N</i>)silver(I)]-μ-bis(pyrimidin-2-ylsulfanyl)methane-κ^2^<i>N</i>^1^:<i>N</i>^1'^] tetrafluoroborate] Acta Crystallographica Section E, 2005, 61, m1658-m1659 |
1516760 | CIF | C11 H11 Br O2 S | P b c a | 7.4039; 12.927; 24.736 90; 90; 90 | 2367.5 | Weatherhead-Kloster, Robin A; Corey, E. J. Theory-guided discovery of unique chemical transformations of cyclopropenes. Organic letters, 2006, 8, 171-174 |
7128600 | CIF | C11 H11 Cl F N O | P b c a | 9.503; 9.161; 24.001 90; 90; 90 | 2089 | Riley, William; Jones, Andrew C.; Singh, Kuldip; Browne, Duncan L.; Stuart, Alison M. Accessing novel fluorinated heterocycles with the hypervalent fluoroiodane reagent by solution and mechanochemical synthesis. Chemical communications (Cambridge, England), 2021, 57, 7406-7409 |
2227358 | CIF HKL Paper | C11 H11 Cl N4 O | P b c a | 15.165; 8.0452; 19.349 90; 90; 90 | 2360.7 | Xu, Feng; Yang, Zhenzhen; Jiang, Junrong; Shi, Lei 1-[3-(4-Chlorophenyl)-6-methyl-1,6-dihydro-1,2,4,5-tetrazin-1-yl]ethanone Acta Crystallographica Section E, 2010, 66, o2651 |
4504557 | CIF | C11 H11 Cl4 N3 O Pt | P b c a | 27.37; 6.884; 15.483 90; 90; 90 | 2917.2 | Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi N−H···Cl2−M Synthon as a Structure-Directing Tool: Crystal Structures of Some Perchlorometallates Crystal Growth & Design, 2006, 6, 216 |
4076912 | CIF | C11 H11 Cr N O3 S2 | P b c a | 7.0727; 13.0378; 29.0898 90; 90; 90 | 2682.4 | Goh, Lai Yoong; Weng, Zhiqiang; Leong, Weng Kee; Leung, Pak Hing Synthetic and Structural Study of Cyclopentadienylchromium Dithiocarbamate Complexes and Their Thermolytic Derivatives Organometallics, 2002, 21, 4398 |
4314155 | CIF | C11 H11 Cu N O4 S | P b c a | 16.411; 7.4816; 19.545 90; 90; 90 | 2399.7 | Ke-liang Pang; Dong Guo; Chun-ying Duan; Hong Mo; Qing-jin Meng Generation of an Equilibrating Collection of Crystalline Solids from a Dynamic Combinational Library Inorganic Chemistry, 2003, 42, 5453-5455 |
4322828 | CIF | C11 H11 Cu N6 | P b c a | 18.132; 14.927; 8.629 90; 90; 90 | 2335 | José M. Domínguez-Vera; Fernando Cámara; José M. Moreno; Enrique Colacio; Helen Stoeckli-Evans A New Mononuclear Copper(II) Complex Containing Two Imidazolyl Moieties as Precursor of Self-Assembled and NiIICuIINiII Heterobimetallic Complexes Inorganic Chemistry, 1998, 37, 3046-3050 |
2209448 | CIF HKL Paper | C11 H11 F N2 O S | P b c a | 9.4664; 9.5316; 23.823 90; 90; 90 | 2149.5 | Chen-Xia Yu; Chang-Sheng Yao; Shu-Jiang Tu; Xiang-Shan Wang; Hong Jiang 3-(3-Fluorobenzyl)-2-thioxo-2,3,5,6-tetrahydropyrimidin-4(1<i>H</i>)-one Acta Crystallographica Section E, 2006, 62, o2981-o2982 |
4032522 | CIF | C11 H11 I N2 | P b c a | 16.3855; 7.3631; 18.7465 90; 90; 90 | 2261.73 | Beyeh, Ngong Kodiah; Jo, Hyun Hwa; Kolesnichenko, Igor; Pan, Fangfang; Kalenius, Elina; Anslyn, Eric V.; Ras, Robin H. A.; Rissanen, Kari Recognition of Viologen Derivatives in Water by N-Alkyl Ammonium Resorcinarene Chlorides. The Journal of organic chemistry, 2017, 82, 5198-5203 |
4101853 | CIF | C11 H11 I N2 | P b c a | 16.4397; 7.3508; 18.6167 90; 90; 90 | 2249.7 | Benjamin J. Coe; Simon P. Foxon; Elizabeth C. Harper; Madeleine Helliwell; James Raftery; Catherine A. Swanson; Bruce S. Brunschwig; Koen Clays; Edith Franz; Javier Garín; Jesús Orduna; Peter N. Horton; Michael B. Hursthouse Evolution of Linear Absorption and Nonlinear Optical Properties in V-Shaped Ruthenium(II)-Based Chromophores Journal of the American Chemical Society, 2010, 132, 1706-1723 |
1547801 | CIF | C11 H11 I O2 Se | P b c a | 12.931; 10.477; 18.151 90; 90; 90 | 2459.1 | Maity, Pintu; Paroi, Bidisha; Ranu, Brindaban C. Transition-Metal-Free Iodine Catalyzed Selenocayanation of Styrenyl Bromides and an Easy Access to Benzoselenophenes via Intermediacy of Styrenyl Selenocyanate. Organic letters, 2017, 19, 5748-5751 |
7115020 | CIF | C11 H11 N O | P b c a | 12.3331; 7.3853; 20.023 90; 90; 90 | 1823.77 | Dunn, Peter J.; Higginson, Paul; Sridharan, Visuvanthar; Graham, Alison B.; Grigg, Ronald; Thornton-Pett, Mark A novel route to substituted 4-methylene-4,5-dihydroisoxazoles mediated by hafnium(iv) chloride Chemical Communications, 2001, 1968 |
2101960 | CIF Paper | C11 H11 N O2 | P b c a | 6.216; 38.627; 8.031 90; 90; 90 | 1928.3 | Nigović, Biljana; Antolić, Snježana; Kojić-Prodić, Biserka; Kiralj, Rudolf; Magnus, Volker; Salopek, Branka Correlation of structural and physico-chemical parameters with the bioactivity of alkylated derivatives of indole-3-acetic acid, a phytohormone (auxin) Acta Crystallographica Section B, 2000, 56, 94-111 |
4022751 | CIF | C11 H11 N O2 | P b c a | 7.4907; 13.1495; 18.5332 90; 90; 90 | 1825.5 | Philip J. Parsons; Alexander J. Waters; Daryl S. Walter; Johnathan Board A New Route to Highly Functionalized Heterocyclic Rings Journal of Organic Chemistry, 2007, 72, 1395-1398 |
7248317 | CIF | C11 H11 N O2 Se | P b c a | 12.9756; 7.1286; 22.9309 90; 90; 90 | 2121.1 | Crocetti, Letizia; Catarzi, Francesca; Giovannoni, Maria Paola; Vergelli, Claudia; Bartolucci, Gianluca; Pallecchi, Marco; Paoli, Paola; Rossi, Patrizia; Lippi, Martina; Schepetkin, Igor A.; Quinn, Mark T.; Guerrini, Gabriella Ebselen analogues with dual human neutrophil elastase (HNE) inhibitory and antiradical activity RSC Medicinal Chemistry, 2024 |
7159638 | CIF | C11 H11 N O4 S | P b c a | 12.9083; 8.1492; 20.8706 90; 90; 90 | 2195.4 | Sun, Li; Li, Jiyu; Wu, Yafei; Li, Ying; Chen, Junqi; Xia, Xiaoye; Yuan, Chunhao; Guo, Hongchao; Mao, Biming Palladium-catalyzed [4 + 2] cycloaddition of 2-methylidenetrimethylene carbonate or methylene cyclic carbamate with sulfamate-derived cyclic imines. Organic & biomolecular chemistry, 2023, 21, 8107-8111 |
4324483 | CIF | C11 H11 N2 O5 Re | P b c a | 13.5512; 13.6051; 15.1648 90; 90; 90 | 2795.86 | Marina Sagnou; Dimitra Benaki; Charalampos Triantis; Theodoros Tsotakos; Vassilis Psycharis; Catherine P. Raptopoulou; Ioannis Pirmettis; Minas Papadopoulos; Maria Pelecanou Curcumin as the OO Bidentate Ligand in "2 + 1" Complexes with the [M(CO)3]+ (M = Re,99mTc) Tricarbonyl Core for Radiodiagnostic Applications Inorganic Chemistry, 2011, 50, 1295-1303 |
4030559 | CIF | C11 H11 N3 | P b c a | 9.8175; 10.663; 18.25 90; 90; 90 | 1910.5 | Xu, Hao; Ma, Shuang; Xu, Yuanqing; Bian, Longxiang; Ding, Tao; Fang, Xiaomin; Zhang, Wenkai; Ren, Yanrong Copper-catalyzed one-pot synthesis of 1,2,4-triazoles from nitriles and hydroxylamine. The Journal of organic chemistry, 2015, 80, 1789-1794 |
4029933 | CIF | C11 H11 N3 O | P b c a | 19.096; 8.8874; 24.908 90; 90; 90 | 4227.2 | Rajam, Sridhar; Jadhav, Abhijit V.; Li, Qian; Sarkar, Sujan K.; Singh, Pradeep N. D.; Rohr, Ahleah; Pace, Tamara C. S.; Li, Rui; Krause, Jeanette A.; Bohne, Cornelia; Ault, Bruce S.; Gudmundsdottir, Anna D. Triplet sensitized photolysis of a vinyl azide: direct detection of a triplet vinyl azide and nitrene. The Journal of organic chemistry, 2014, 79, 9325-9334 |
7051488 | CIF | C11 H11 N3 O | P b c a | 7.565; 14.423; 19.793 90; 90; 90 | 2159.6 | New Journal of Chemistry, 1999 |
7225028 | CIF | C11 H11 N3 O S | P b c a | 7.1114; 14.9091; 20.5365 90; 90; 90 | 2177.37 | Sukhikh, Taisiya Sergeevna; Bashirov, Denis Aleksandrovich; Ogienko, Darya; Kuratieva, Natalia; Sherin, Peter Sergeevich; Rakhmanova, Marianna I.; Chulanova, Elena Aleksandrovna; Gritsan, Nina Pavlovna; Konchenko, Sergey Nikolaevich; Zibarev, Andrey Viktorovich Novel luminescent β-ketoimine derivative of 2,1,3-benzothiadiazole: synthesis, complexation with Zn(II) and photophysical properties in comparison with related compounds RSC Adv., 2016 |
4032790 | CIF | C11 H11 N3 O2 | P b c a | 11.0134; 9.5835; 19.539 90; 90; 90 | 2062.28 | Huang, Adrian; Wo, Kellie; Lee, So Yeun Christine; Kneitschel, Nika; Chang, Jennifer; Zhu, Kathleen; Mello, Tatsiana; Bancroft, Laura; Norman, Natalie J.; Zheng, Shao-Liang Regioselective Synthesis, NMR, and Crystallographic Analysis of N1-Substituted Pyrazoles. The Journal of organic chemistry, 2017, 82, 8864-8872 |
7240322 | CIF | C11 H11 N3 O2 | P b c a | 8.6847; 9.1876; 27.083 90; 90; 90 | 2161 | Zhang, Zhenfeng An X-shaped cyano-carbonyl interaction on the polar surface of (cyanoacetyl)hydrazones CrystEngComm, 2020 |
2234043 | CIF HKL Paper | C11 H11 N3 O4 | P b c a | 12.762; 7.9495; 22.218 90; 90; 90 | 2254 | Mosslemin, Mohammad Hossein 2-[3,5-Dioxo-4-(pyridin-3-yl)piperazin-1-yl]acetic acid Acta Crystallographica Section E, 2012, 68, o583 |
2230624 | CIF HKL Paper | C11 H12 Br2 N2 | P b c a | 8.4548; 13.9166; 20.831 90; 90; 90 | 2451 | Dong, Jian-Yu; You, Tian-Pa 3-(2-Bromobenzyl)-1-methyl-1<i>H</i>-imidazol-3-ium bromide Acta Crystallographica Section E, 2011, 67, o1568 |
4500552 | CIF | C11 H12 Br2 N2 Se | P b c a | 11.207; 8.1064; 30.386 90; 90; 90 | 2760.5 | Roy, Gouriprasanna; Bhabak, Krishna P.; Mugesh, Govindasamy Interactions of Antithyroid Drugs and Their Analogues with Halogens and their Biological Implications Crystal Growth & Design, 2011, 11, 2279 |
4128014 | CIF | C11 H12 Cl N O | P b c a | 6.7928; 12.0154; 25.9101 90; 90; 90 | 2114.7 | Hong, Seung Youn; Chang, Sukbok Stereodefined Access to Lactams via Olefin Difunctionalization: Iridium Nitrenoids as a Motif of LUMO-Controlled Dipoles. Journal of the American Chemical Society, 2019, 141, 10399-10408 |
2220734 | CIF HKL Paper | C11 H12 Cl N O3 | P b c a | 14.19; 5.637; 28.139 90; 90; 90 | 2250.8 | Gowda, B. Thimme; Foro, Sabine; Saraswathi, B. S.; Terao, Hiromitsu; Fuess, Hartmut Methyl <i>N</i>-(4-chlorophenyl)succinamate Acta Crystallographica Section E, 2009, 65, o388 |
2222350 | CIF HKL Paper | C11 H12 Cl N3 O3 | P b c a | 15.488; 10.009; 16.249 90; 90; 90 | 2518.9 | Tan, Hai-Jun; He, Hai-Bing; Xia, Ming; Zhang, Xiang-Ning; Zhu, Hong-Jun Ethyl 2-(3-chloro-2-pyridyl)-5-oxopyrazolidine-3-carboxylate Acta Crystallographica Section E, 2009, 65, o1495 |
7002622 | CIF | C11 H12 Cl2 Cu N6 O | P b c a | 14.902; 13.026; 16.7628 90; 90; 90 | 3253.9 | Silva, Telma F. S.; Mishra, Gopal S.; Guedes da Silva, M. Fátima; Wanke, Riccardo; Martins, Luísa M. D. R. S.; Pombeiro, Armando J. L. CuII complexes bearing the 2,2,2-tris(1-pyrazolyl)ethanol or 2,2,2-tris(1-pyrazolyl)ethyl methanesulfonate scorpionates. X-Ray structural characterization and application in the mild catalytic peroxidative oxidation of cyclohexane Dalton Transactions, 2009, 9207-9215 |
7244476 | CIF | C11 H12 Cu F N O4 | P b c a | 7.7611; 14.453; 20.556 90; 90; 90 | 2305.8 | Li, Zhongkui; Su, Hao; Zhu, Yanhong; Yan, Li; Li, Hui Structural transformation of copper coordination complexes accompanied with chiral transformation CrystEngComm, 2022 |
2021312 | CIF HKL Paper | C11 H12 F N O2 | P b c a | 7.3584; 7.2979; 37.576 90; 90; 90 | 2017.9 | Piontek, Aleksandra; Bisz, Elwira; Dziuk, Błażej; Szostak, Roman; Szostak, Michal Structures and energetic properties of 4-halobenzamides Acta Crystallographica Section C, 2018, 74 |
7122851 | CIF | C11 H12 F N O3 | P b c a | 8.5328; 10.2996; 23.8575 90; 90; 90 | 2096.7 | Cosimi, Elena; Trapp, Nils; Ebert, Marc-Olivier; Wennemers, Helma Combined Experimental and Theoretical Study of Long-Range H F Interactions in α Fluoro Amides Chemical Communications, 2019 |
4034777 | CIF | C11 H12 F3 N O2 S | P b c a | 10.8054; 7.8126; 28.528 90; 90; 90 | 2408.3 | Wang, Xue-Juan; Su, Yan; Li, Rui; Gu, Peiming Tf<sub>2</sub>O-Promoted Intramolecular Schmidt Reaction of the ω-Azido Carboxylic Acids. The Journal of organic chemistry, 2018, 83, 5816-5824 |
4036407 | CIF | C11 H12 I N O2 | P b c a | 15.334; 6.3606; 23.307 90; 90; 90 | 2273.2 | Liu, Gong-Qing; Yang, Chun-Hua; Li, Yue-Ming Modular Preparation of 5-Halomethyl-2-oxazolines via PhI(OAc)2-Promoted Intramolecular Halooxygenation of N-Allylcarboxamides. The Journal of organic chemistry, 2015, 80, 11339-11350 |
4102500 | CIF | C11 H12 N2 | P b c a | 11.5057; 8.482; 19.2656 90; 90; 90 | 1880.16 | Sergey I. Druzhinin; Peter Mayer; Dietmar Stalke; Rixa von Bülow; Mathias Noltemeyer; Klaas A. Zachariasse Intramolecular Charge Transfer with 1-tert-Butyl-6-cyano-1,2,3,4-tetrahydroquinoline (NTC6) and Other Aminobenzonitriles. A Comparison of Experimental Vapor Phase Spectra and Crystal Structures with Calculations Journal of the American Chemical Society, 2010, 132, 7730-7744 |
1563819 | CIF HKL Paper | C11 H12 N2 O S | P b c a | 8.0175; 14.4611; 18.5612 90; 90; 90 | 2152.02 | Abou, Akoun; Bamba, Fanté; Marrot, Jérôme; Yaya, Soro; Coustard, Jean-Marie 8-Methyl-3-methylsulfanyl-8a,8b-dihydro-5<i>H</i>-1-oxa-2,4-diazaacenaphthylene IUCrData, 2021, 6, x210674 |
2229419 | CIF HKL Paper | C11 H12 N2 O S | P b c a | 10.9479; 11.347; 17.7392 90; 90; 90 | 2203.67 | Shahani, Tara; Fun, Hoong-Kun; Ragavan, R. Venkat; Vijayakumar, V.; Sarveswari, S. 1,3-Dimethyl-4-phenylsulfanyl-1<i>H</i>-pyrazol-5-ol Acta Crystallographica Section E, 2011, 67, o633 |
7246881 | CIF | C11 H12 N2 O2 | P b c a | 7.3489; 14.605; 19.983 90; 90; 90 | 2144.8 | Lazić, Anita; Radovanović, Lidija; Rogan, Jelena; Valentić, Nataša; Janjić, Goran; Đorđević, Ivana; Trišović, Nemanja Exploring the supramolecular profile of 5-phenylhydantoins CrystEngComm, 2023, 25, 3637-3654 |
2020858 | CIF HKL | C11 H12 N2 O4 | P b c a | 6.9132; 8.9917; 36.898 90; 90; 90 | 2293.6 | Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Ravikumar, Krishnan Four cocrystals of thymine with phenolic coformers: influence of the coformer on hydrogen bonding Acta Crystallographica Section C Structural Chemistry, 2015, 71, 602 |
8107521 | CIF | C11 H12 N2 O4 S | P b c a | 11.08447; 10.71473; 19.5463 90; 90; 90 | 2321.46 | Song, Jinqing; Cui, Beibei; Mi, Xia; Zhang, Jingyu Crystal structure of 3-(thiazol-2-ylcarbamoyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid, C11H12N2O4S Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 653-654 |
4504362 | CIF | C11 H12 N4 O | P b c a | 11.6368; 7.2494; 24.7339 90; 90; 90 | 2086.5 | B. Aakeröy, Christer; Schultheiss, Nate; Desper, John; Moore, Curtis Balancing Hydrogen-Bond Donors and Acceptors in a Family of Bifunctional Aromatic N-Heterocycles Crystal Growth & Design, 2007, 7, 2324 |
2001799 | CIF Paper | C11 H12 N4 O2 | P b c a | 6.962; 13.754; 22.974 90; 90; 90 | 2200 | De Bondt, H. L.; Blaton, N. M.; Peeters, O. M.; De Ranter, C. J. Structure of 5-benzylamino-1-methyl-4-nitroimidazole Acta Crystallographica Section C, 1993, 49, 763-765 |
1547429 | CIF | C11 H12 N4 O2 S | P b c a | 9.0785; 11.5265; 22.8581 90; 90; 90 | 2391.95 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547430 | CIF | C11 H12 N4 O2 S | P b c a | 9.0963; 11.5574; 22.8612 90; 90; 90 | 2403.39 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547431 | CIF | C11 H12 N4 O2 S | P b c a | 9.0885; 11.5482; 22.7898 90; 90; 90 | 2391.9 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547432 | CIF | C11 H12 N4 O2 S | P b c a | 9.0907; 11.5779; 22.8104 90; 90; 90 | 2400.82 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547433 | CIF | C11 H12 N4 O2 S | P b c a | 9.1074; 11.6193; 22.8456 90; 90; 90 | 2417.56 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547434 | CIF | C11 H12 N4 O2 S | P b c a | 9.1228; 11.6522; 22.8488 90; 90; 90 | 2428.8 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547435 | CIF | C11 H12 N4 O2 S | P b c a | 9.1349; 11.6868; 22.866 90; 90; 90 | 2441.12 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547436 | CIF | C11 H12 N4 O2 S | P b c a | 9.0823; 11.5422; 22.8439 90; 90; 90 | 2394.72 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547437 | CIF | C11 H12 N4 O2 S | P b c a | 9.0881; 11.5538; 22.8478 90; 90; 90 | 2399.07 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547438 | CIF | C11 H12 N4 O2 S | P b c a | 9.0992; 11.5635; 22.8525 90; 90; 90 | 2404.51 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547439 | CIF | C11 H12 N4 O2 S | P b c a | 9.0972; 11.5751; 22.8531 90; 90; 90 | 2406.45 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547440 | CIF | C11 H12 N4 O2 S | P b c a | 9.1048; 11.5802; 22.8576 90; 90; 90 | 2410 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547441 | CIF | C11 H12 N4 O2 S | P b c a | 9.1064; 11.5845; 22.8569 90; 90; 90 | 2411.25 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547442 | CIF | C11 H12 N4 O2 S | P b c a | 9.107; 11.5902; 22.8593 90; 90; 90 | 2412.84 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547443 | CIF | C11 H12 N4 O2 S | P b c a | 9.1066; 11.5983; 22.8627 90; 90; 90 | 2414.78 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547444 | CIF | C11 H12 N4 O2 S | P b c a | 9.1158; 11.6222; 22.8715 90; 90; 90 | 2423.14 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547445 | CIF | C11 H12 N4 O2 S | P b c a | 9.12; 11.6339; 22.8697 90; 90; 90 | 2426.5 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547446 | CIF | C11 H12 N4 O2 S | P b c a | 9.1237; 11.6442; 22.8738 90; 90; 90 | 2430.07 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547447 | CIF | C11 H12 N4 O2 S | P b c a | 9.128; 11.6579; 22.8759 90; 90; 90 | 2434.3 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547448 | CIF | C11 H12 N4 O2 S | P b c a | 9.1311; 11.6667; 22.88 90; 90; 90 | 2437.4 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547449 | CIF | C11 H12 N4 O2 S | P b c a | 9.1357; 11.6782; 22.8834 90; 90; 90 | 2441.4 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547450 | CIF | C11 H12 N4 O2 S | P b c a | 9.1405; 11.6923; 22.8838 90; 90; 90 | 2445.67 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547451 | CIF | C11 H12 N4 O2 S | P b c a | 9.1415; 11.7002; 22.8837 90; 90; 90 | 2447.58 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
1547452 | CIF | C11 H12 N4 O2 S | P b c a | 9.1445; 11.713; 22.8862 90; 90; 90 | 2451.33 | Anuradha R. Pallipurath; Jonathan M. Skelton; Mark R. Warren; Naghmeh Kamali; Patrick McArdle; Andrea Erxleben Sulfamerazine: Understanding the Influence of Slip Planes in the Polymorphic Phase Transformation through X-Ray Crystallographic Studies and ab Initio Lattice Dynamics Molecular Pharmaceutics, 2015, 12, 3735-3748 |
2227452 | CIF HKL Paper | C11 H12 N4 O3 S | P b c a | 10.7589; 9.5652; 24.5586 90; 90; 90 | 2527.35 | Bruni, Bruno; Coran, Silvia A.; Bartolucci, Gianluca; Di Vaira, Massimo 4-Amino-<i>N</i>-(3-methoxypyrazin-2-yl)benzenesulfonamide Acta Crystallographica Section E, 2010, 66, o2663 |
4508168 | CIF | C11 H12 N4 O3 S | P b c a | 10.912; 9.586; 24.842 90; 90; 90 | 2598.5 | Perlovich, German L.; Ryzhakov, Alex M.; Tkachev, Valery V.; Hansen, Lars Kr.; Raevsky, Oleg A. Sulfonamide Molecular Crystals: Structure, Sublimation Thermodynamic Characteristics, Molecular Packing, Hydrogen Bonds Networks Crystal Growth & Design, 2013, 13, 4002 |
2016113 | CIF HKL Paper | C11 H12 N4 O6 | P b c a | 10.61; 12.1878; 20.522 90; 90; 90 | 2653.8 | Wardell, James L.; Skakle, Janet M. S.; Low, John N.; Glidewell, Christopher Cyclic and acyclic products from the reactions between methyl 3-oxobutanoate and arylhydrazines Acta Crystallographica Section C, 2007, 63, o462-o467 |
2220631 | CIF HKL Paper | C11 H12 O2 | P b c a | 10.24; 6.237; 27.503 90; 90; 90 | 1756.5 | Xu, Jian; Xu, Hao; Quan, Ji-cai; Sha, Fei; Yao, Cheng 1,2,3,4-Tetrahydro-1,4-methanonaphthalene-2,3-diol Acta Crystallographica Section E, 2009, 65, o79 |
2228581 | CIF HKL Paper | C11 H12 O2 S | P b c a | 15.9875; 7.6354; 16.9963 90; 90; 90 | 2074.75 | Yu, Lijuan; Yin, Yinghui; Zhou, Xiaole; Li, Renjie; Peng, Tianyou 1,3-Dimethyl-5,6,7,8-tetrahydro-4<i>H</i>-cyclohepta[<i>c</i>]thiophene-4,8-dione Acta Crystallographica Section E, 2010, 66, o3231 |
2011121 | CIF Paper | C11 H12 O4 | P b c a | 11.3705; 9.7132; 19.0382 90; 90; 90 | 2102.65 | Gerkin, Roger E. Hydrogen bonds and C—H···O interactions in 2-(2-methylbenzyl)malonic acid at 150K Acta Crystallographica Section C, 2000, 56, 853-854 |
8102480 | CIF | C11 H12 O4 | P b c a | 10.469; 7.153; 26.363 90; 90; 90 | 1974.2 | Xiaochuan Li; Woo Taik Lim; Sung-Hoon Kim; Young-A Son Refinement of crystal structure of b-phenylglutaric acid, C11H12O4 Zeitschrift für Kristallographie - New Crystal Structures, 2009, 224, 491 |
2208842 | CIF HKL Paper | C11 H12 O6 | P b c a | 12.3492; 9.0553; 19.813 90; 90; 90 | 2215.6 | Hökelek, Tuncer; Çelik, Murat; Gültekin, M. Serdar; Balcı, Metin Dimethyl 3,6-dioxatetracyclo[6.1.0.0^2,4^.0^5,7^]nonane-2,9-dicarboxylate Acta Crystallographica Section E, 2006, 62, o1991-o1993 |
7210631 | CIF | C11 H12 O6 P2 | P b c a | 16.2835; 7.8798; 19.1588 90; 90; 90 | 2458.28 | Białek, Michał J.; Janczak, Jan; Zoń, Jerzy Naphthalene-based linkers for metal phosphonates: synthesis, structure, and interesting conformational flexibility influence on final lanthanum hybrids CrystEngComm, 2013, 15, 390 |
1558281 | CIF HKL Paper | C11 H13 Br N2 | P b c a | 10.907; 18.8993; 21.6608 90; 90; 90 | 4465 | Peppel, Tim; Wulf, Christoph; Spannenberg, Anke 1-Benzyl-3-methylimidazolium bromide IUCrData, 2020, 5 |
2221719 | CIF HKL Paper | C11 H13 Br O | P b c a | 15.379; 8.282; 17.374 90; 90; 90 | 2212.9 | Chen, Lei; Xu, Qing-Bing; Song, Guang-Liang; Zhu, Hong-Jun 2-Bromo-1-mesitylethanone Acta Crystallographica Section E, 2009, 65, o1083 |
2232580 | CIF HKL Paper | C11 H13 Br O2 | P b c a | 9.9727; 12.174; 18.558 90; 90; 90 | 2253.1 | Balasubramani, V.; Vinuchakkaravarthy, T.; Gopi, Sreeraj; Narasimhan, S.; Velmurugan, D. 3-Bromo-5-<i>tert</i>-butyl-2-hydroxybenzaldehyde Acta Crystallographica Section E, 2011, 67, o3375 |
2230780 | CIF HKL Paper | C11 H13 Cl N2 O | P b c a | 9.4498; 10.856; 21.93 90; 90; 90 | 2249.7 | Li, Yu-Feng <i>N</i>-(4-Chlorophenyl)pyrrolidine-1-carboxamide Acta Crystallographica Section E, 2011, 67, o1792 |
2231606 | CIF HKL Paper | C11 H13 Cl N2 O2 | P b c a | 9.3359; 11.105; 22.426 90; 90; 90 | 2325 | Li, Yu-Feng <i>N</i>-(4-Chlorophenyl)morpholine-4-carboxamide Acta Crystallographica Section E, 2011, 67, o2492 |
7707824 | CIF | C11 H13 Cl N4 S Sn | P b c a | 13.4062; 13.7584; 15.3342 90; 90; 90 | 2828.36 | Wu, Junmiao; Yang, Tongfu; Wang, Xiaojun; Li, Wenjuan; Pang, Min; Sun, Hongbin; Liang, Hong; Yang, Feng Development of a multi-target anticancer Sn(ii) pyridine-2-carboxaldehyde thiosemicarbazone complex. Dalton transactions (Cambridge, England : 2003), 2021, 50, 10909-10921 |
2004660 | CIF Paper | C11 H13 Cl O Ti | P b c a | 14.63; 12.616; 11.709 90; 90; 90 | 2161.2 | Gibson, D. H.; Ding, Y.; Mashuta, M. S.; Richardson, J. F. Chlorobis(η^5^-cyclopentadienyl)methoxytitanium Acta Crystallographica Section C, 1996, 52, 559-560 |
2213270 | CIF HKL Paper | C11 H13 Cl2 N O | P b c a | 10.655; 9.999; 23.275 90; 90; 90 | 2479.7 | Gowda, B. Thimme; Kožíšek, Jozef; Tokarčík, Miroslav; Fuess, Hartmut <i>N</i>-(3,5-Dichlorophenyl)-2,2,2-trimethylacetamide Acta Crystallographica Section E, 2007, 63, o2071-o2072 |
8107091 | CIF | C11 H13 Cr N2 O9 | P b c a | 6.774; 12.309; 32.776 90; 90; 90 | 2732.9 | Xie, Ling; Feng, Sisi; Lu, Liping; Zhu, Miaoli The crystal structure of diaqua-(N-(2-hydroxy-5-nitrobenzyl)iminodiacetato-κ4-N,O,O′,O′′)chromium(III) based on synchrotron data, C11H13CrN2O9 Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 1047-1049 |
2224106 | CIF HKL Paper | C11 H13 Cu N O7 | P b c a | 13.0461; 9.7919; 19.374 90; 90; 90 | 2475 | Zhang, Xiu-Qing; Huang, Fu-Ping; Bian, He-Dong; Yu, Qing; Liang, Hong Aqua[<i>N</i>-(2,5-dihydroxybenzyl)iminodiacetato]copper(II) Acta Crystallographica Section E, 2009, 65, m1393 |
4082749 | CIF | C11 H13 K O3 Ru | P b c a | 8.7374; 11.492; 24.169 90; 90; 90 | 2426.8 | Kalz, Kai F.; Kindermann, Nicole; Xiang, Sheng-Qi; Kronz, Andreas; Lange, Adam; Meyer, Franc Revisiting the Synthesis and Elucidating the Structure of Potassium Cyclopentadienyldicarbonylruthenate, K[CpRu(CO)2] Organometallics, 2014, 33, 1475 |
4035846 | CIF | C11 H13 N | P b c a | 10.874; 8.3249; 19.94 90; 90; 90 | 1805.1 | Skalenko, Yevhen A.; Druzhenko, Tetiana V.; Denisenko, Aleksandr V.; Samoilenko, Maryna V.; Dacenko, Oleksandr P.; Trofymchuk, Serhii A.; Grygorenko, Oleksandr O.; Tolmachev, Andrey A.; Mykhailiuk, Pavel K. [2+2]-Photocycloaddition of N-Benzylmaleimide to Alkenes As an Approach to Functional 3-Azabicyclo[3.2.0]heptanes. The Journal of organic chemistry, 2018, 83, 6275-6289 |
2011195 | CIF HKL Paper | C11 H13 N O | P b c a | 10.04; 7.733; 25.62 90; 90; 90 | 1989.1 | Nesterov, Vladimir N.; Timofeeva, Tatiana V.; Antipin, Mikhail Yu.; Clark, Ronald D. A combinatorial chemistry approach to new materials for nonlinear optics. II. 4,4-Dimethylaminocinnamaldehyde and a molecular complex of 4-methoxycinnamaldehyde with 2,4-dinitroaniline Acta Crystallographica Section C, 2000, 56, 976-978 |
4027678 | CIF | C11 H13 N O | P b c a | 7.4984; 9.8472; 25.9083 90; 90; 90 | 1913.02 | Agnieszka Witosińska; Bogdan Musielak; Paweł Serda; Maria Owińska; Barbara Rys Conformation of Eight-Membered Benzoannulated Lactams by Combined NMR and DFT Studies Journal of Organic Chemistry, 2012, 77, 9784-9794 |
1554260 | CIF | C11 H13 N O2 | P b c a | 5.565; 17.417; 19.97 90; 90; 90 | 1935.6 | Ivanov, Konstantin L.; Vatsouro, Ivan M.; Bezzubov, Stanislav I.; Melnikov, Mikhail Ya.; Budynina, Ekaterina M. Domino construction of a bullataketal core via double bond cleavage in activated dihydrofurans Organic Chemistry Frontiers, 2018, 5, 1655 |
2102173 | CIF HKL Paper | C11 H13 N O2 | P b c a | 26.766; 9.3754; 8.1729 90; 90; 90 | 2050.9 | Chisholm, Greig; Kennedy, Alan R.; Wilson, Sharon; Teat, Simon J. Comparison of the structural motifs of acetoacetanilides and related azo pigments Acta Crystallographica Section B, 2000, 56, 1046-1053 |
2200223 | CIF Paper | C11 H13 N O2 S2 | P b c a | 9.3725; 10.7012; 23.0919 90; 90; 90 | 2316.05 | Coustard, Jean-Marie; Le Toquin, Ronan; Leo, Roland; Paulus, Werner; Cousson, Alain (<i>E</i>)-3-Methoxy-3-methylsulfanylisothiochroman-4-one oxime Acta Crystallographica Section E, 2001, 57, o256-o257 |
2235181 | CIF HKL Paper | C11 H13 N O2 S2 | P b c a | 13.5388; 7.266; 24.1083 90; 90; 90 | 2371.6 | Mirošová, Pavla; Nečas, Marek; Vícha, Robert 2-Methyl-2-(3-nitrophenyl)-1,3-dithiane Acta Crystallographica Section E, 2012, 68, o1827 |
2101414 | CIF Paper | C11 H13 N O3 | P b c a | 9.469; 8.53; 27.149 90; 90; 90 | 2192.8 | Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G. Intermolecular N‒H^{···^}O hydrogen bonds assisted by resonance. Heteroconjugated systems as hydrogen-bond-strengthening functional groups Acta Crystallographica Section B, 1995, 51, 1004-1015 |
2200148 | CIF HKL Paper | C11 H13 N O3 | P b c a | 8.6209; 13.9266; 16.4518 90; 90; 90 | 1975.2 | Tam, William; Tranmer, Geoffrey K.; Lough, Alan J. 6,9-Methano-4-methyl-3a,4,5a,6,9,10-hexahydro-5-oxa-1<i>H</i>,3<i>H</i>-furano[3,4-<i>c</i>]isoindol-3-one Acta Crystallographica Section E, 2001, 57, o269-o270 |
4035934 | CIF | C11 H13 N O3 | P b c a | 13.4466; 9.1948; 17.3481 90; 90; 90 | 2144.9 | Ondari, Mark E.; Klosin, Jerzy; Froese, Robert D. J.; Kruper, William R.; MacDonald, Jason; Arriola, Dan J.; Bell, Bruce M.; Briggs, John R.; Kruper, William J. Mechanistic and Synthetic Implications of the Diol-Ritter Reaction: Unexpected Yet Reversible Pathways in the Regioselective Synthesis of Vicinal-Aminoalcohols. The Journal of organic chemistry, 2019, 84, 4715-4722 |
8102261 | CIF | C11 H13 N O4 | P b c a | 9.1171; 14.639; 16.626 90; 90; 90 | 2219 | Brian O. Patrick; Brian A. Mendelsohn; Marco A. Ciufolini Crystal structure of methyl 2-(1-acetamido-4-oxocyclohexa-2,5-dienyl)-acetate, C11H13NO4 Zeitschrift für Kristallographie - New Crystal Structures, 2008, 223, 205 |
2227809 | CIF HKL Paper | C11 H13 N3 O | P b c a | 10.4; 12.165; 15.37 90; 90; 90 | 1944.6 | Shi, Daxin; Yang, Liupan; Tang, Jianhong; Wang, Xiuzhen; Li, Jiarong Spiro[cyclopentane-1,2'(1'<i>H</i>)-pyrido[2,3-<i>d</i>]pyrimidin]-4'(3'<i>H</i>)-one Acta Crystallographica Section E, 2010, 66, o2301 |
2234603 | CIF HKL Paper | C11 H13 N3 O | P b c a | 15.762; 8.1144; 16.015 90; 90; 90 | 2048.3 | Lemmerer, Andreas; Bernstein, Joel; Kahlenberg, Volker <i>N</i>'-Cyclopentylidenepyridine-4-carbohydrazide Acta Crystallographica Section E, 2012, 68, o1299 |
7207692 | CIF | C11 H13 N3 O | P b c a | 10.4; 12.165; 15.37 90; 90; 90 | 1944.6 | Yang, Liupan; Shi, Daxin; Chen, Shu; Chai, Hongxin; Huang, Danfei; Zhang, Qi; Li, Jiarong Microwave-assisted synthesis of 2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-ones catalyzed by DBU in aqueous medium Green Chemistry, 2012, 14, 945 |
2201464 | CIF HKL Paper | C11 H13 N3 O2 | P b c a | 21.372; 14.705; 7.211 90; 90; 90 | 2266.2 | Shang Shan; Duan-Jun Xu; Jing-Yun Wu; Michael Y. Chiang Cyclopentanone 4-nitrophenylhydrazone Acta Crystallographica Section E, 2002, 58, o1218-o1219 |
2019619 | CIF HKL Paper | C11 H13 N3 O2 S2 | P b c a | 8.53937; 15.0206; 21.396 90; 90; 90 | 2744.39 | Li, Xiaozhou; Bond, Andrew D.; Johansson, Kristoffer E.; Van de Streek, Jacco Distinguishing tautomerism in the crystal structure of (<i>Z</i>)-<i>N</i>-(5-ethyl-2,3-dihydro-1,3,4-thiadiazol-2-ylidene)-4-methylbenzenesulfonamide using DFT-D calculations and ^13^C solid-state NMR Acta Crystallographica Section C, 2014, 70 |
2104858 | CIF Paper | C11 H13 N3 O2 S2 | P b c a | 8.5364; 15.0148; 21.3846 90; 90; 90 | 2740.91 | Hangan, Adriana; Borodi, Gheorghe; Filip, Xenia; Tripon, Carmen; Morari, Cristian; Oprean, Luminita; Filip, Claudiu Structure of <i>N</i>-(5-ethyl-[1,3,4]-thiadiazole-2-yl)toluenesulfonamide by combined X-ray powder diffraction, ^13^C solid-state NMR and molecular modelling Acta Crystallographica Section B, 2010, 66, 615-621 |
2213625 | CIF HKL Paper | C11 H13 N3 O3 | P b c a | 9.4711; 13.1959; 17.773 90; 90; 90 | 2221.3 | Liu, Wei; Guo, Yan-Ling; Han, Cong; Cheng, Shao-Ling 1-(4-Nitrophenyl)pyrrolidine-2-carboxamide Acta Crystallographica Section E, 2007, 63, o2778-o2779 |
2208499 | CIF HKL Paper | C11 H13 N3 O4 S | P b c a | 10.733; 9.842; 24.65 90; 90; 90 | 2603.9 | Silva, Luiz Everson da; Joussef, Antonio Carlos; Andrighetti-Fröhner, Carla Regina; Simões, Cláudia Maria Olivra; Bortoluzzi, Adailton José 5-(5-Ethyl-1,3,4-thiadiazol-2-ylaminomethylene)-2,2-dimethyl-1,3-dioxane- 4,6-dione Acta Crystallographica Section E, 2006, 62, o1520-o1521 |
2234984 | CIF HKL Paper | C11 H13 N3 S | P b c a | 10.9165; 7.815; 28.039 90; 90; 90 | 2392.08 | Mendoza-Meroño, Rafael; García-Granda, Santiago (1<i>E</i>,2<i>E</i>)-2-Methyl-3-phenylacrylaldehyde thiosemicarbazone Acta Crystallographica Section E, 2012, 68, o1840 |
7122326 | CIF | C11 H13 N5 | P b c a | 10.2177; 11.0976; 19.154 90; 90; 90 | 2171.9 | Li, Lian-Hua; Niu, Zhi-Jie; Li, Ying-Xiu; Liang, Yong-Min Transition-metal-free multinitrogenation of amides by C-C bond cleavage: a new approach to tetrazoles. Chemical communications (Cambridge, England), 2018, 54, 11148-11151 |
2224553 | CIF HKL Paper | C11 H13.5 Cl N2 O0.25 | P b c a | 11.452; 11.41; 34.867 90; 90; 90 | 4556 | Ji, Xiujie; Cheng, Bowen; Song, Jun; Liu, Chao 1-Benzyl-3-methylimidazolium chloride 0.25-hydrate Acta Crystallographica Section E, 2010, 66, o218 |
4338867 | CIF | C11 H14 Ag N3 O4 S | P b c a | 13.271; 14.427; 14.477 90; 90; 90 | 2771.8 | Liu, Hai-Yan; Wu, Hua; Ma, Jian-Fang; Song, Shu-Yan; Yang, Jin; Liu, Ying-Ying; Su, Zhong-Min Structural study of silver(I) sulfonate complexes with pyrazine derivatives. Inorganic chemistry, 2007, 46, 7299-7311 |
2230423 | CIF HKL Paper | C11 H14 Br N O | P b c a | 10.0728; 11.2577; 20.367 90; 90; 90 | 2309.55 | Moreno-Fuquen, Rodolfo; Quintero, David E.; Zuluaga, Fabio; Kennedy, Alan R.; De Almeida Santos, Regina H. 2-Bromo-2-methyl-<i>N</i>-<i>p</i>-tolylpropanamide Acta Crystallographica Section E, 2011, 67, o1543 |
1567779 | CIF | C11 H14 Cl Fe O2 P | P b c a | 12.2903; 13.3012; 15.6001 90; 90; 90 | 2550.24 | Xin, Tiansi; Geeson, Michael B.; Zhu, Hui; Qu, Zheng-Wang; Grimme, Stefan; Cummins, Christopher C. Synthesis of phosphiranes <i>via</i> organoiron-catalyzed phosphinidene transfer to electron-deficient olefins. Chemical science, 2022, 13, 12696-12702 |
1504320 | CIF | C11 H14 Cl N O | P b c a | 9.7381; 10.0151; 22.9501 90; 90; 90 | 2238.28 | Hursthouse, Michael B.; Huth, L. Susanne; Threlfall, Terence L. Why Do Organic Compounds Crystallise Well or Badly or Ever so Slowly? Why Is Crystallisation Nevertheless Such a Good Purification Technique?† Organic Process Research & Development, 2009, 13, 1231 |
2213279 | CIF HKL Paper | C11 H14 Cl N O | P b c a | 9.6933; 10.115; 23.542 90; 90; 90 | 2308.2 | B. Thimme Gowda; Sabine Foro; Hartmut Fuess <i>N</i>-(4-Chlorophenyl)-2,2,2-trimethylacetamide Acta Crystallographica Section E, 2007, 63, o2329-o2330 |
2014363 | CIF Paper | C11 H14 Cl N5 Ni O | P b c a | 6.75; 19.893; 20.585 90; 90; 90 | 2764.1 | Sun, Yu-Xi Two different structures controlled by small secondary ligands: {4-chloro-2-[2-(dimethylamino)ethyliminomethyl]phenolato}thiocyanatonickel(II) and <i>catena</i>-poly[[{4-chloro-2-[2-(dimethylamino)ethyliminomethyl]phenolato}nickel(II)]-μ-azido] Acta Crystallographica Section C, 2006, 62, m109-m111 |
2201917 | CIF HKL Paper | C11 H14 Cl3 N O | P b c a | 11.4236; 10.2623; 21.899 90; 90; 90 | 2567.3 | Kaynak, F. Betül; Özbey, Süheyla; Şenöz, Hülya; Tunoḡlu, Nazan 2-Trichloroacetyl-1-(1-pyrrolidinyl)cyclopentene Acta Crystallographica Section E, 2003, 59, o833-o835 |
7707197 | CIF | C11 H14 Co N2 O8 | P b c a | 17.0748; 7.2456; 21.3863 90; 90; 90 | 2645.9 | Liang, Shuai; Ge, Fa-Yuan; Ren, Shuang-Shuang; Lei, Ming-Yuan; Gao, Xiang-Jing; Zheng, He-Gen Molecular engineering in a family of pillared-layered metal-organic frameworks for tuning gas adsorption behavior. Dalton transactions (Cambridge, England : 2003), 2021, 50, 7409-7416 |
4317880 | CIF | C11 H14 Cu Mo2 N2 O13 P2 | P b c a | 7.828; 19.877; 25.46 90; 90; 90 | 3961.5 | Robert C. Finn; Randy S. Rarig; Jon Zubieta Organic-Inorganic Hybrid Materials: Hydrothermal Syntheses and Structural Characterization of Bimetallic Organophosphonate Oxides of the Type Mo/Cu/O/RPO32-/Organoimine Inorganic Chemistry, 2002, 41, 2109-2123 |
7015344 | CIF | C11 H14 Cu N2 O7 S | P b c a | 15.222; 7.432; 26.225 90; 90; 90 | 2966.8 | Kopylovich, Maximilian N.; Nunes, Andreia C. C.; Mahmudov, Kamran T.; Haukka, Matti; Mac Leod, Tatiana C. O.; Martins, Luísa M D R S; Kuznetsov, Maxim L.; Pombeiro, Armando J. L. Complexes of copper(II) with 3-(ortho-substituted phenylhydrazo)pentane-2,4-diones: syntheses, properties and catalytic activity for cyclohexane oxidation. Dalton transactions (Cambridge, England : 2003), 2011, 40, 2822-2836 |
4513063 | CIF | C11 H14 Cu2 N4 | P b c a | 17.9734; 17.21788; 7.95298 90; 90; 90 | 2461.16 | Timokhin, Ivan; Pettinari, Claudio; Marchetti, Fabio; Pettinari, Riccardo; Condello, Francesca; Galli, Simona; Alegria, Elisabete C. B. A.; Martins, Luísa M. D. R. S.; Pombeiro, Armando J. L. Novel Coordination Polymers with (Pyrazolato)-Based Tectons: Catalytic Activity in the Peroxidative Oxidation of Alcohols and Cyclohexane Crystal Growth & Design, 2015, 15, 2303 |
1567781 | CIF | C11 H14 F Fe O2 P | P b c a | 21.4541; 9.6814; 23.524 90; 90; 90 | 4886.07 | Xin, Tiansi; Geeson, Michael B.; Zhu, Hui; Qu, Zheng-Wang; Grimme, Stefan; Cummins, Christopher C. Synthesis of phosphiranes <i>via</i> organoiron-catalyzed phosphinidene transfer to electron-deficient olefins. Chemical science, 2022, 13, 12696-12702 |
4116987 | CIF | C11 H14 N O4 S2 V | P b c a | 7.6495; 12.384; 27.867 90; 90; 90 | 2639.9 | Charles R. Cornman; Thad C. Stauffer; Paul D. Boyle Oxidation of a Vanadium(V)-Dithiolate Complex to a Vanadium(V)-η2,η2-Disulfenate Complex Journal of the American Chemical Society, 1997, 119, 5986-5987 |
2222083 | CIF HKL Paper | C11 H14 N2 O | P b c a | 19.538; 10.104; 20.735 90; 90; 90 | 4093.3 | Zhang, Ling; Shi, Daxin; Fan, Yanqiu; Qian, Dongfeng; Li, Jiarong 2,2,7-Trimethyl-2,3-dihydroquinazolin-4(1<i>H</i>)-one Acta Crystallographica Section E, 2009, 65, o1345 |
4034993 | CIF | C11 H14 N2 O2 | P b c a | 10.6419; 9.2073; 22.7567 90; 90; 90 | 2229.77 | Saha, Amrita; Bhattacharyya, Aditya; Talukdar, Ranadeep; Ghorai, Manas K. Stereospecific Syntheses of Enaminonitriles and β-Enaminoesters via Domino Ring-Opening Cyclization (DROC) of Activated Cyclopropanes with Pronucleophilic Malononitriles. The Journal of organic chemistry, 2018, 83, 2131-2144 |
7050302 | CIF | C11 H14 N2 O2 | P b c a | 11.901; 9.9022; 18.667 90; 90; 90 | 2199.8 | Boldog, Ishtvan; Rusanov, Eduard B.; Sieler, Joachim; Domasevitch, Konstantin V. Cooperative association of pyrazoles and phenols: A versatile binary systemElectronic supplementary information (ESI) available: Details for crystal structure determination and refinement and geometry of hydrogen bonding in structures. See http://www.rsc.org/suppdata/nj/b3/b317104c/ New Journal of Chemistry, 2004, 28, 756 |
2219192 | CIF HKL Paper | C11 H14 N2 O2 S | P b c a | 31.6377; 8.6787; 8.5308 90; 90; 90 | 2342.34 | Duque, J.; Estévez-Hernández, O.; Mascarenhas, Yvonne; Ellena, J.; Corrêa, Rodrigo S. <i>N</i>-(2-Furylcarbonyl)piperidine-1-carbothioamide Acta Crystallographica Section E, 2008, 64, o1457 |
2222638 | CIF HKL Paper | C11 H14 N2 O3 | P b c a | 8.794; 10.92; 24.418 90; 90; 90 | 2344.9 | Lv, Lu-Ping; Yu, Tie-Ming; Yu, Wen-Bo; Li, Wei-Wei; Hu, Xian-Chao <i>N</i>'-(3,4-Dimethoxybenzylidene)acetohydrazide Acta Crystallographica Section E, 2009, 65, o1989 |
2223184 | CIF HKL Paper | C11 H14 N2 O3 | P b c a | 9.423; 13.25; 20.041 90; 90; 90 | 2502.2 | Chen, Yu; Guo, Li-hua; Song, Wei; Zhang, Jing; Tian, Dan-bi <i>N</i>-Isopropyl-3-methyl-2-nitrobenzamide Acta Crystallographica Section E, 2009, 65, o2278 |
8107032 | CIF | C11 H14 N2 O3 S | P b c a | 10.1973; 9.9487; 23.1332 90; 90; 90 | 2346.86 | Ghorab, Mostafa M.; Alsaid, Mansour S.; Ghabbour, Hazem A.; Al-Mishari, Abdullah A. Crystal structure of (Z)-4-(4-oxopent-2-en-2-ylamino)benzenesulfonamide, C11H14N2O3S Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 867-869 |
1546762 | CIF | C11 H14 N2 O5 S2 | P b c a | 9.411; 14.986; 19.855 90; 90; 90 | 2800.2 | Mizojiri, Ryo; Takami, Kazuaki; Ito, Tatsuya; Maeda, Hiroyuki; Yamano, Mitsuhisa; Kawamoto, Tetsuji Efficient and Stereoselective Syntheses of Isomerically Pure 4-Aminotetrahydro-2H-thiopyran 1-Oxide Derivatives Organic Process Research & Development, 2017, 21, 1034 |
3500091 | CIF HKL | C11 H14 N2 O6 | P b c a | 16.9583; 6.7846; 20.6053 90; 90; 90 | 2370.75 | Thierry Maris benzoic acid 3,5-dicarboxylate ethylenediammonium Personal communication to COD, 2020 |
4508169 | CIF | C11 H14 N3 O3 S | P b c a | 14.455; 11.514; 14.857 90; 90; 90 | 2472.7 | Perlovich, German L.; Ryzhakov, Alex M.; Tkachev, Valery V.; Hansen, Lars Kr.; Raevsky, Oleg A. Sulfonamide Molecular Crystals: Structure, Sublimation Thermodynamic Characteristics, Molecular Packing, Hydrogen Bonds Networks Crystal Growth & Design, 2013, 13, 4002 |
4081651 | CIF | C11 H14 O2 S Si | P b c a | 10.9876; 17.2317; 27.31 90; 90; 90 | 5170.7 | Baldridge, Kim K.; Bunker, Kevin D.; Vélez, Carmen L.; Holland, Ryan L.; Rheingold, Arnold L.; Moore, Curtis E.; O’Connor, Joseph M. Structural Characterization of (C5H5)Co(PPh3)(η2-alkyne) and (C5H5)Co(η2-alkyne) Complexes of Highly Polarized Alkynes Organometallics, 2013, 32, 5473 |
4031865 | CIF | C11 H14 O2 S2 | P b c a | 11.059; 11.569; 17.329 90; 90; 90 | 2217.1 | Picado, Alfredo; Li, ShengJian; Dieter, R. Karl A Serendipitous Synthesis of Bis-Heterocyclic Spiro 3(2H)-Furanones. The Journal of organic chemistry, 2016, 81, 1391-1400 |
2229907 | CIF HKL Paper | C11 H14 O3 | P b c a | 16.8864; 6.6653; 18.238 90; 90; 90 | 2052.7 | Betz, Richard; Gerber, Thomas; Schalekamp, Henk 2-Hydroxy-6-isopropyl-3-methylbenzoic acid Acta Crystallographica Section E, 2011, 67, o1063 |
2200995 | CIF HKL Paper | C11 H14 O5 | P b c a | 8.0792; 10.6879; 24.5704 90; 90; 90 | 2121.65 | Greatrex, Ben W.; Kimber, Marc C.; Taylor, Dennis K.; Fallon, Gary D. (±)-2,5-Dioxoperhydrocycloocta[<i>b</i>]furan-3-carboxylic acid Acta Crystallographica Section E, 2002, 58, o248-o249 |
4133193 | CIF | C11 H14 O6 | P b c a | 14.7312; 10.3767; 15.206 90; 90; 90 | 2324.4 | Hu, Anhua; Chen, Yilin; Guo, Jing-Jing; Yu, Na; An, Qing; Zuo, Zhiwei Cerium-Catalyzed Formal Cycloaddition of Cycloalkanols with Alkenes through Dual Photoexcitation. Journal of the American Chemical Society, 2018, 140, 13580-13585 |
1519268 | CIF | C11 H15 B O2 | P b c a | 7.515; 9.3921; 30.7365 90; 90; 90 | 2169.43 | Gelbrich, Thomas; Sampson, David; Hursthouse, Michael B. (E)-5-Phenyl-pent-1-enyl-boronic acid Crystal Structure Report Archive, 2000, 528 |
2311094 | CIF HKL | C11 H15 B O2 | P b c a | 7.52; 9.3837; 30.712 90; 90; 90 | 2167.21 | Fournier, Bertrand; Guillot, Beno\?ît; Lecomte, Claude; Escudero-Adán, Eduardo C.; Jelsch, Christian A method to estimate statistical errors of properties derived from charge-density modelling Acta Crystallographica Section A, 2018, 74, 170-183 |
2022460 | CIF HKL Paper | C11 H15 Cl N2 | P b c a | 9.1893; 9.3259; 27.5149 90; 90; 90 | 2358 | Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. The crystalline forms of nine hydrochloride salts of substituted tryptamines Acta Crystallographica Section C, 2021, 77 |
7001465 | CIF | C11 H15 Cl N2 O Pt | P b c a | 10.974; 11.5679; 19.0234 90; 90; 90 | 2414.9 | Mukhopadhyay, Bhaswati Ghosh; Mukhopadhyay, Suman; Guedes da Silva, M. Fátima C.; Charmier, M. Adília Januário; Pombeiro, Armando J. L. Synthesis of mono- and bis-tetrazolato complexes of Ni(II), Pt(II) and Cu(II) via 1,3-dipolar cycloadditions of 2-cyanopyridines with metal ligated azides in N,N,O-aminoiminophenolato complexes Dalton Transactions, 2009, 4778-4785 |
1519733 | CIF | C11 H15 F6 N2 P | P b c a | 9.2017; 16.0731; 18.2782 90; 90; 90 | 2703.34 | Butts, Craig; Coles, Simon J.; Hursthouse, Michael B. C11H15F6N2P Crystal Structure Report Archive, 2004, 967 |
7015306 | CIF | C11 H15 Fe2 I O5 S3 | P b c a | 15.888; 17.307; 28.582 90; 90; 90 | 7859 | Xiao, Zhiyin; Wei, Zhenhong; Long, Li; Wang, Yongli; Evans, David J.; Liu, Xiaoming Diiron carbonyl complexes possessing a {Fe(II)Fe(II)} core: synthesis, characterisation, and electrochemical investigation. Dalton transactions (Cambridge, England : 2003), 2011, 40, 4291-4299 |
7131411 | CIF | C11 H15 I O3 S | P b c a | 11.9016; 9.6956; 21.935 90; 90; 90 | 2531.1 | Thai, Phong; Frey, Brandon L.; Figgins, Matthew T.; Thompson, Richard R.; Carmieli, Raanan; Powers, David C. Selective multi-electron aggregation at a hypervalent iodine center by sequential disproportionation. Chemical communications (Cambridge, England), 2023, 59, 4308-4311 |
2221718 | CIF HKL Paper | C11 H15 N O2 | P b c a | 9.301; 7.649; 31.394 90; 90; 90 | 2233.5 | Zhang, Min; Lu, Ran-Zhe; Han, Lu-Na; Wei, Wen-Bin; Wang, Hai-Bo <i>N</i>-(4-Isopropoxyphenyl)acetamide Acta Crystallographica Section E, 2009, 65, o1017 |
2203232 | CIF HKL Paper | C11 H15 N O3 S | P b c a | 13.113; 9.999; 18.474 90; 90; 90 | 2422.3 | Vande Velde, Christophe M. L.; Geise, Herman J.; Blockhuys, Frank <i>O</i>-(3,5-Dimethoxyphenyl) <i>N,N</i>-dimethylthiocarbamate Acta Crystallographica Section E, 2004, 60, o199-o200 |
7050450 | CIF | C11 H15 N O6 | P b c a | 6.8309; 16.047; 22.8001 90; 90; 90 | 2499.2 | Shan, Ning; Bond, Andrew D.; Jones, William Supramolecular architectures of cyclohexane-1, 3cis, 5cis-tricarboxylic acid in acid∶base complexes New Journal of Chemistry, 2003, 27, 365 |
2219239 | CIF HKL Paper | C11 H15 N O7 S | P b c a | 9.9291; 10.3636; 25.8862 90; 90; 90 | 2663.72 | Lo, Kong Mun; Ng, Seik Weng Bis(carboxymethyl)ammonium 4-toluenesulfonate Acta Crystallographica Section E, 2008, 64, o1798 |
2244086 | CIF HKL Paper | C11 H15 N2 O4 P | P b c a | 13.229; 10.5551; 17.8346 90; 90; 90 | 2490.3 | Naeem, Marilyn; Sherwood, Alexander M.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. The crystal structure of baeocystin Acta Crystallographica Section E, 2022, 78 |
2223011 | CIF HKL Paper | C11 H15 N3 O | P b c a | 8.619; 20.063; 26.231 90; 90; 90 | 4536 | Li, Wei-Wei; Yu, Tie-Ming; Yu, Wen-Bo; Lv, Lu-Ping; Hu, Xian-Chao <i>N</i>'-[4-(Dimethylamino)benzylidene]acetohydrazide Acta Crystallographica Section E, 2009, 65, o2197 |
2226485 | CIF HKL Paper | C11 H15 N3 O S | P b c a | 13.066; 10.128; 19.224 90; 90; 90 | 2544 | Li, Yu-Feng; Jian, Fang-Fang 4-Ethyl-1-(4-methoxybenzylidene)thiosemicarbazide Acta Crystallographica Section E, 2010, 66, o1714 |
2005692 | CIF Paper | C11 H15 N3 O2 | P b c a | 8.856; 24.985; 10.507 90; 90; 90 | 2324.9 | Collins, D. J.; Hughes, T. C.; Johnson, W. M.; Mackay, M. F. 2-Methyl-3-phenyl-2,5-dihydro-1,2,4-triazin-6(1<i>H</i>)-one Methanol Solvate and 4-Methyl-3-phenyl-4,5-dihydro-1,2,4-triazin-6(1<i>H</i>)-one Acta Crystallographica Section C, 1996, 52, 2865-2868 |
2218418 | CIF HKL Paper | C11 H15 N3 O2 | P b c a | 13.051; 9.838; 18.637 90; 90; 90 | 2392.9 | Hu, Xian-Chao; Lv, Lu-Ping; Li, Wei-Wei; Yu, Wen-Bo (<i>E</i>)-Methyl 2-[4-(dimethylamino)benzylidene]hydrazinecarboxylate at 123 K Acta Crystallographica Section E, 2008, 64, o1081 |
4024451 | CIF | C11 H15 N4 O3 | P b c a | 10.644; 14.876; 15.388 90; 90; 90 | 2436.7 | Oleg N. Chupakhin; Irina A. Utepova; Mikhail V. Varaksin; Evgeny V. Tretyakov; Galina V. Romanenko; Dmitry V. Stass; Victor I. Ovcharenko SNH Approach in the Synthesis of Nitronyl Nitroxides Journal of Organic Chemistry, 2009, 74, 2870-2872 |
7001464 | CIF | C11 H15 N5 Ni O | P b c a | 11.619; 12.483; 17.385 90; 90; 90 | 2522 | Mukhopadhyay, Bhaswati Ghosh; Mukhopadhyay, Suman; Guedes da Silva, M. Fátima C.; Charmier, M. Adília Januário; Pombeiro, Armando J. L. Synthesis of mono- and bis-tetrazolato complexes of Ni(II), Pt(II) and Cu(II) via 1,3-dipolar cycloadditions of 2-cyanopyridines with metal ligated azides in N,N,O-aminoiminophenolato complexes Dalton Transactions, 2009, 4778-4785 |
7001466 | CIF | C11 H15 N5 O Pt | P b c a | 11.6391; 12.794; 17.4002 90; 90; 90 | 2591.1 | Mukhopadhyay, Bhaswati Ghosh; Mukhopadhyay, Suman; Guedes da Silva, M. Fátima C.; Charmier, M. Adília Januário; Pombeiro, Armando J. L. Synthesis of mono- and bis-tetrazolato complexes of Ni(II), Pt(II) and Cu(II) via 1,3-dipolar cycloadditions of 2-cyanopyridines with metal ligated azides in N,N,O-aminoiminophenolato complexes Dalton Transactions, 2009, 4778-4785 |
2208555 | CIF HKL Paper | C11 H16 Br2 N2 O Zn | P b c a | 11.757; 14.363; 17.535 90; 90; 90 | 2961.1 | Xiao-Yang Qiu Dibromo{2-[3-(methylamino)propyliminomethyl]phenolato}zinc(II) Acta Crystallographica Section E, 2006, 62, m717-m718 |
2009718 | CIF Paper | C11 H16 Cl N | P b c a | 11.151; 29.244; 6.666 90; 90; 90 | 2173.8 | Barnes, John C.; Paton, John D.; Rae, Duncan; Cairns, James; Redpath, James 2,3-Dihydro-2-methyl-2-indenylmethylammonium chloride Acta Crystallographica Section C, 1994, 50, 728-729 |
7012326 | CIF | C11 H16 Cl2 O2 Te | P b c a | 7.0124; 15.1295; 26.187 90; 90; 90 | 2778.3 | Asahara, Masahiro; Taomoto, Shoichiro; Tanaka, Masahito; Erabi, Tatsuo; Wada, Masanori Dependence of the rotational barrier of the Ar-group in RArTeX2 on the R-group [Ar = 2,6-(MeO)2C6H3; R = Me, Et, i-Pr; X = Cl, Br, I] Dalton Transactions, 2003, 973 |
4316776 | CIF | C11 H16 K N2 O6 P | P b c a | 7.4875; 14.295; 28.8098 90; 90; 90 | 3083.6 | Sylvie Pailloux; Cornel Edicome Shirima; Karen Ann Smith; Eileen N. Duesler; Robert T. Paine; Neil J. Williams; Robert D. Hancock Synthesis and Reactivity of (Benzoxazol-2-ylmethyl)phosphonic Acid Inorganic Chemistry, 2010, 49, 9369-9379 |
7224065 | CIF | C11 H16 N O5 P | P b c a | 11.863; 14.09; 14.457 90; 90; 90 | 2416.5 | Materna, Magdalena; Stawinski, Jacek; Kiliszek, Agnieszka; Rypniewski, Wojciech; Sobkowski, Michal Oxyonium phosphobetaines ‒ unusually stable nucleophilic catalyst-phosphate complexes formed from H-phosphonates and N-oxides RSC Adv., 2016 |
1502729 | CIF | C11 H16 N2 O | P b c a | 11.0135; 10.1491; 19.8528 90; 90; 90 | 2219.09 | Ośmiałowski, Borys; Kolehmainen, Erkki; Dobosz, Robert; Gawinecki, Ryszard; Kauppinen, Reijo; Valkonen, Arto; Koivukorpi, Juha; Rissanen, Kari Self-organization of 2-acylaminopyridines in the solid state and in solution. The journal of physical chemistry. A, 2010, 114, 10421-10426 |
2239400 | CIF HKL | C11 H16 N2 O | P b c a | 10.7954; 10.1809; 20.839 90; 90; 90 | 2290.35 | El-Hiti, Gamal A.; Smith, Keith; Balakit, Asim A.; Hegazy, Amany S.; Kariuki, Benson M. 2,2-Dimethyl-<i>N</i>-(4-methylpyridin-2-yl)propanamide Acta Crystallographica Section E, 2014, 70, o351-o352 |
8107098 | CIF | C11 H16 N2 O | P b c a | 10.7388; 9.8449; 21.1259 90; 90; 90 | 2233.5 | El-Hiti, Gamal A.; Smith, Keith; Alshammari, Mohammed B.; Alotaibi, Mohammad Hayal; Kariuki, Benson M. Crystal structure of 1,1-dimethyl-3-(2-phenylethyl)urea, C11H16N2O Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 1065-1066 |
2312089 | CIF HKL Paper | C11 H16 N2 O2 S | P b c a | 11.1747; 10.485; 20.1368 90; 90; 90 | 2359.36 | Kolade, Sherif O.; Izunobi, Josephat U.; Gordon, Allen T.; Hosten, Eric C.; Olasupo, Idris A.; Ogunlaja, Adeniyi S.; Asekun, Olayinka T.; Familoni, Oluwole B. N-Cycloamino substituent effects on the packing architecture of ortho-sulfanilamide molecular crystals and their in silico carbonic anhydrase II and IX inhibitory activities. Acta crystallographica. Section C, Structural chemistry, 2022, 78, 730-742 |
2233687 | CIF HKL Paper | C11 H16 N2 O3 S | P b c a | 8.7791; 14.1747; 20.1577 90; 90; 90 | 2508.4 | Ahmad, Saba; Farrukh, Muhammad Akhyar; Qureshi, Fahim Ashraf; Khan, Islam Ullah; Akkurt, Mehmet <i>N</i>-[4-(Propylsulfamoyl)phenyl]acetamide Acta Crystallographica Section E, 2012, 68, o290-o291 |
7204581 | CIF | C11 H16 N3 O2 | P b c a | 13.0654; 14.4171; 12.874 90; 90; 90 | 2425 | Jotaro Nakazaki; InGwon Chung; Michio M. Matsushita; Tadashi Sugawara; Ryoji Watanabe; Akira Izuoka; Yuzo Kawada Design and preparation of pyrrole-based spin-polarized donors J. Mater. Chem., 2003, 13, 1011-1022 |
7212068 | CIF | C11 H16 N4 | P b c a | 8.2313; 16.1062; 17.0904 90; 90; 90 | 2265.76 | Basu, Tannistha; Mondal, Raju Construction of first anion-assisted helix inside a helix network CrystEngComm, 2010, 12, 366 |
7104277 | CIF | C11 H16 N4 O2 | P b c a | 10.638; 7.562; 30.221 90; 90; 90 | 2431.1 | Huang, Zhangjian; Zhang, Yihua; Fang, Lei; Zhang, Zhiguo; Lai, Yisheng; Ding, Ye; Cao, Fengqi; Zhang, Ji; Peng, Sixun Nanometre-sized titanium dioxide-catalyzed reactions of nitric oxide with aliphatic cyclic and aromatic amines. Chemical communications (Cambridge, England), 2009, 34, 1763-1765 |
2014752 | CIF HKL Paper | C11 H16 O5 | P b c a | 7.8896; 12.7281; 21.8425 90; 90; 90 | 2193.4 | Rodríguez, M.L.; Febles, M.; Pérez, C.; Pérez-Hernández , N.; Martín , J.D.; Foces-Foces, C. Hydrogen-bonding patterns of two dihydroxylactone derivatives Acta Crystallographica Section C, 2005, 61, o138-o142 |
2022604 | CIF HKL Paper | C11 H17 Br N2 O2 | P b c a | 8.859; 12.038; 23.805 90; 90; 90 | 2538.7 | van Terwingen, Steven; Ebel, Ben; Wang, Ruimin; Englert, Ulli Weaving a 2D net of hydrogen and halogen bonds: cocrystal of a pyrazolium bromide with tetrafluorodiiodobenzene Acta Crystallographica Section C, 2022, 78 |
7707059 | CIF | C11 H17 Cd F N4 S3 | P b c a | 14.9579; 10.8069; 20.2117 90; 90; 90 | 3267.2 | Wang, Yu-Zhen; Zhang, Zhi-Xu; Su, Chang-Yuan; Zhang, Tie; Fu, Da-Wei; Zhang, Yi A-site cation with high vibrational motion in ABX<sub>3</sub> perovskite effectively induces dielectric phase transition. Dalton transactions (Cambridge, England : 2003), 2021, 50, 3841-3847 |
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