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|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
2,003,024 | 12.083 | 0.004 | 18.854 | 0.006 | 10.76 | 0.003 | 90 | null | 107.29 | 0.03 | 90 | null | 2,340.5 | 1.3 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/a 1 | -P 2yab | 14 | 2-phenyl-4-hydroxyphthalazin-1-one | 2,3-dihydro-2-phenyl-1,4-phthalazinedione | - C14 H10 N2 O2 - | - C14 H10 N2 O2 - | - C112 H80 N16 O16 - | 8 | 2 | MU1320 | Becker, Dan; Botoshansky, Mark; Gasper, Noga; Herbstein, Frank H.; Karni, Miriam | 2-Phenyl-4-hydroxyphthalazin-1-one: A Benzoannelated Derivative of Maleic Hydrazide | Acta Crystallographica Section B | 1,998 | 54 | 5 | 671 | 676 | 10.1107/S0108768197015760 | 0.71069 | MoKα | 0.0802 | 0.05 | null | 0.1324 | 0.1131 | null | null | null | 1.009 | 1.072 | 1.072 | null | null | null | has coordinates | Becker, Dan; Botoshansky, Mark; Gasper, Noga; Herbstein, Frank H.; Karni, Miriam
2-Phenyl-4-hydroxyphthalazin-1-one: A Benzoannelated Derivative of Maleic Hydrazide
Acta Crystallographica Section B
54(5)
(1998)
671-676 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,025 | 7.14 | 0.03 | 8.05 | 0.04 | 7.84 | 0.04 | 90 | null | 118.1 | 0.4 | 90 | null | 398 | 4 | null | null | null | null | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | - Fe H2 O5 Se - | - Fe O5 Se - | - Fe4 O20 Se4 - | 4 | 0.5 | NA0082 | Aleksovska, S.; Petrusevski, V. M.; Soptrajanov, B. | Calculation of Structural Parameters in Isostructural Series: the Kieserite Group | Acta Crystallographica Section B | 1,998 | 54 | 5 | 564 | 567 | 10.1107/S0108768198000974 | null | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Aleksovska, S.; Petrusevski, V. M.; Soptrajanov, B.
Calculation of Structural Parameters in Isostructural Series: the Kieserite Group
Acta Crystallographica Section B
54(5)
(1998)
564-567 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,026 | 16.3224 | 0.0015 | 11.243 | 0.002 | 9.919 | 0.001 | 90 | null | 115.972 | 0.011 | 90 | null | 1,636.4 | 0.4 | 150 | null | 150 | null | null | null | null | null | 3 | C 1 c 1 | C -2yc | 9 | Potassium disilicate | - K2 O5 Si2 - | - K2 O5 Si2 - | - K24 O60 Si24 - | 12 | 3 | NA0083 | de Jong, B. H. W. S.; Supèr, H. T. J.; Spek, A. L.; Veldman, N.; Nachtegaal, G.; Fischer, J. C. | Mixed Alkali Systems: Structure and ^29^Si MASNMR of Li~2~Si~2~O~5~ and K~2~Si~2~O~5~ | Acta Crystallographica Section B | 1,998 | 54 | 5 | 568 | 577 | 10.1107/S0108768198001062 | 0.71073 | MoKα | 0.038 | 0.038 | null | 0.079 | null | 0.079 | null | null | null | null | null | null | null | null | has coordinates | de Jong, B. H. W. S.; Supèr, H. T. J.; Spek, A. L.; Veldman, N.; Nachtegaal, G.; Fischer, J. C.
Mixed Alkali Systems: Structure and ^29^Si MASNMR of Li~2~Si~2~O~5~ and K~2~Si~2~O~5~
Acta Crystallographica Section B
54(5)
(1998)
568-577 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,027 | 5.807 | 0.002 | 14.582 | 0.007 | 4.773 | 0.003 | 90 | null | 90 | null | 90 | null | 404.2 | 0.3 | 293 | null | 293 | null | null | null | null | null | 3 | C c c 2 | C 2 -2c | 37 | Lithium Disilicate | - Li2 O5 Si2 - | - Li2 O5 Si2 - | - Li8 O20 Si8 - | 4 | 0.5 | NA0083 | de Jong, B. H. W. S.; Supèr, H. T. J.; Spek, A. L.; Veldman, N.; Nachtegaal, G.; Fischer, J. C. | Mixed Alkali Systems: Structure and ^29^Si MASNMR of Li~2~Si~2~O~5~ and K~2~Si~2~O~5~ | Acta Crystallographica Section B | 1,998 | 54 | 5 | 568 | 577 | 10.1107/S0108768198001062 | 0.71073 | MoKα | 0.0464 | 0.045 | null | null | null | 0.1138 | null | null | null | null | null | 1.133 | null | null | has coordinates | de Jong, B. H. W. S.; Supèr, H. T. J.; Spek, A. L.; Veldman, N.; Nachtegaal, G.; Fischer, J. C.
Mixed Alkali Systems: Structure and ^29^Si MASNMR of Li~2~Si~2~O~5~ and K~2~Si~2~O~5~
Acta Crystallographica Section B
54(5)
(1998)
568-577 | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,028 | 16.481 | 0.002 | 16.481 | 0.002 | 7.131 | 0.004 | 90 | null | 90 | null | 90 | null | 1,936.9 | 1.1 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | I -4 | I -4 | 82 | Tetrakis(p-ter-butylbenzyl)Zirconium | - C44 H60 Zr - | - C44 H60 Zr - | - C88 H120 Zr2 - | 2 | 0.25 | NA0084 | Tedesco, C.; Immirzi, A.; Proto, A. | Structures of Homoleptic Benzyl Derviatives of Zirconium | Acta Crystallographica Section B | 1,998 | 54 | 4 | 431 | 437 | 10.1107/S0108768197017771 | 0.71069 | MoKα | 0.0561 | 0.033 | null | 0.0919 | 0.0822 | null | null | null | 1.017 | 1.053 | 1.053 | null | null | null | has coordinates | Tedesco, C.; Immirzi, A.; Proto, A.
Structures of Homoleptic Benzyl Derviatives of Zirconium
Acta Crystallographica Section B
54(4)
(1998)
431-437 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,029 | 16.387 | 0.001 | 20.022 | 0.001 | 13.758 | 0.006 | 90 | null | 90 | null | 90 | null | 4,514 | 2 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P b c a | -P 2ac 2ab | 61 | Tetrakis(benzyl)Zirconium | - C28 H28 Zr - | - C28 H28 Zr - | - C224 H224 Zr8 - | 8 | 1 | NA0084 | Tedesco, C.; Immirzi, A.; Proto, A. | Structures of Homoleptic Benzyl Derviatives of Zirconium | Acta Crystallographica Section B | 1,998 | 54 | 4 | 431 | 437 | 10.1107/S0108768197017771 | 0.71069 | MoKα | 0.1634 | 0.0362 | null | 0.2267 | 0.0969 | null | null | null | 1.001 | 1.084 | 1.084 | null | null | null | has coordinates | Tedesco, C.; Immirzi, A.; Proto, A.
Structures of Homoleptic Benzyl Derviatives of Zirconium
Acta Crystallographica Section B
54(4)
(1998)
431-437 | 201,955 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,030 | 4.0246 | 0.0005 | 15.5147 | 0.0005 | 9.1453 | 0.0009 | 90 | null | 101.23 | 0.01 | 90 | null | 560.1 | 0.09 | 295 | 3 | 295 | 3 | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | 5,10-dimethyl-4,9-diazapyrene | - C16 H12 N2 - | - C16 H12 N2 - | - C32 H24 N4 - | 2 | 0.5 | NA0085 | Kojić-Prodić, Biserka; Kiralj, Rudolf; Žinić, Mladen; Piantanida, Ivo | Crystal and molecular structures of diazapyrenes and a study of π···π interactions | Acta Crystallographica Section B | 1,999 | 55 | 1 | 55 | 69 | 10.1107/S0108768198006557 | 1.54184 | CuKα | 0.2272 | 0.0425 | null | 0.4272 | 0.1281 | null | null | null | 0.629 | 0.66 | 0.66 | null | null | null | has coordinates | Kojić-Prodić, Biserka; Kiralj, Rudolf; Žinić, Mladen; Piantanida, Ivo
Crystal and molecular structures of diazapyrenes and a study of π···π interactions
Acta Crystallographica Section B
55(1)
(1999)
55-69 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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4,322,428 | 8.506 | 0.002 | 8.202 | 0.002 | 13.789 | 0.003 | 90 | null | 96.14 | 0.03 | 90 | null | 956.5 | 0.4 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | - C10 H13 N O - | - C10 H13 N O - | - C40 H52 N4 O4 - | 4 | 1 | Peter W. Roesky; Markus R. Bürgstein | Bridged Aminotroponiminate Complexes of the Lanthanides | Inorganic Chemistry | 1,999 | 38 | 5629 | 5632 | 10.1021/ic990533c | 0.71073 | MoKa | 0.1097 | 0.0779 | null | 0.2901 | 0.2192 | null | null | null | 1.133 | 1.097 | 1.097 | null | null | null | has coordinates | Peter W. Roesky; Markus R. Bürgstein
Bridged Aminotroponiminate Complexes of the Lanthanides
Inorganic Chemistry
38
(1999)
5629-5632 | 301,838 | 2025-08-20 | 22:17:37 | #------------------------------------------------------------------------------
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2,003,031 | 12.4968 | 0.0003 | 11.4751 | 0.0004 | 3.9615 | 0.0003 | 90 | null | 96.8 | 0.01 | 90 | null | 564.09 | 0.05 | 295 | 2 | 295 | 3 | null | null | null | null | 3 | C 1 2/m 1 | -C 2y | 12 | 2,7-dimethyl-4,9-diazapyrene | - C16 H12 N2 - | - C13 H11 N2 - | - C26 H22 N4 - | 2 | 0.25 | NA0085 | Kojić-Prodić, Biserka; Kiralj, Rudolf; Žinić, Mladen; Piantanida, Ivo | Crystal and molecular structures of diazapyrenes and a study of π···π interactions | Acta Crystallographica Section B | 1,999 | 55 | 1 | 55 | 69 | 10.1107/S0108768198006557 | 1.54184 | CuKα | 0.061 | 0.0405 | null | 0.138 | 0.1237 | null | null | null | 0.896 | 1.055 | 1.055 | null | null | null | has coordinates,has disorder | Kojić-Prodić, Biserka; Kiralj, Rudolf; Žinić, Mladen; Piantanida, Ivo
Crystal and molecular structures of diazapyrenes and a study of π···π interactions
Acta Crystallographica Section B
55(1)
(1999)
55-69 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,032 | 8.23 | 0.005 | 35.82 | 0.01 | 8.042 | 0.002 | 90 | null | 103.11 | 0.03 | 90 | null | 2,309 | 1.7 | 293 | null | 293 | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | (Z)-3-[3-(3,5-dichloro-2,4,6-trimethylphenyl)isoxazol-4-yl]but-2-enal (ethoxycarbonyl)hydrazone - ethyl acetate solvate | - C20.36 H23.72 Cl2 N3 O3.68 - | - C20 H26 Cl2 N3 O3 - | - C80 H104 Cl8 N12 O12 - | 4 | 1 | NA0086 | Pani, M.; Carnasciali, M. M.; Mugnoli, A.; Beltrame, P.; Cadoni, E.; Gelli, G. | Energetic Study of the Disordered Solvent in the Crystal Structure of an Isoxazole Derivative | Acta Crystallographica Section B | 1,998 | 54 | 6 | 872 | 876 | 10.1107/S0108768198003577 | 0.7107 | MoKα | null | 0.072 | null | null | null | 0.228 | null | null | null | null | null | 0.96 | null | null | has coordinates,has Fobs | Pani, M.; Carnasciali, M. M.; Mugnoli, A.; Beltrame, P.; Cadoni, E.; Gelli, G.
Energetic Study of the Disordered Solvent in the Crystal Structure of an Isoxazole Derivative
Acta Crystallographica Section B
54(6)
(1998)
872-876 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,033 | 5.4514 | 0.0008 | 11.945 | 0.001 | 40.482 | 0.003 | 84.662 | 0.007 | 86.97 | 0.01 | 79.77 | 0.01 | 2,581.1 | 0.5 | 243 | null | 243 | null | null | null | null | null | 3 | P -1 | -P 1 | 2 | tripalmitin | 1,2,3-trihexadecanoyl-glycerol | - C51 H98 O6 - | - C51 H98 O6 - | - C102 H196 O12 - | 2 | 1 | NA0087 | A.J. van Langevelde | Structure of mono-acid even-numbered β-triacylglycerols | Acta Crystallographica Section B | 1,999 | 55 | 1 | 114 | 122 | 10.1107/S0108768198009392 | 1.5418 | CuKα | 0.153 | 0.078 | null | 0.1 | 0.071 | null | null | null | 0.695 | 0.803 | 0.803 | null | null | null | has coordinates | A.J. van Langevelde
Structure of mono-acid even-numbered β-triacylglycerols
Acta Crystallographica Section B
55(1)
(1999)
114-122 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,034 | 9.9147 | 0.0003 | 9.9147 | 0.0003 | 8.6508 | 0.0006 | 90 | null | 90 | null | 90 | null | 850.38 | 0.07 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | I 4/m | -I 4 | 87 | - Mo6 O12 Pr - | - Mo6 O12 Pr - | - Mo24 O48 Pr4 - | 4 | 0.25 | Barrier, N.; Tortelier, J.; Gougeon, P. | A new reduced molybdenum oxide with hollandite-type structure, PrMo~6~O~12~ | Acta Crystallographica, Section E | 2,001 | 57 | i3 | i5 | 10.1107/S1600536800019048 | 0.71073 | MoKα | 0.038 | 0.032 | null | null | null | 0.081 | null | null | null | null | null | 1.176 | null | null | has coordinates | Barrier, N.; Tortelier, J.; Gougeon, P.
A new reduced molybdenum oxide with hollandite-type structure, PrMo~6~O~12~
Acta Crystallographica, Section E
57
(2001)
i3-i5 | 282,068 | 2023-03-26 | 10:12:03 | #------------------------------------------------------------------------------
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2,003,035 | 7.456 | 0.001 | 8.813 | 0.002 | 4.6806 | 0.0005 | 91.74 | 0.01 | 92.85 | 0.01 | 101.11 | 0.01 | 301.17 | 0.09 | 80 | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | Ammonium Hydrogen Succinate | - C4 H9 N O4 - | - C4 H9 N O4 - | - C8 H18 N2 O8 - | 2 | 1 | OA0011 | Kashino, Setsuo; Taka, Jun-ichiro; Yoshida, Tadanori; Kubozono, Yoshihiro; Ishida, Hiroyuki; Maeda, Hironobu | Structure of Ammonium Hydrogen Succinate at 80 and 20 K | Acta Crystallographica Section B | 1,998 | 54 | 6 | 889 | 894 | 10.1107/S0108768198005448 | 0.71073 | MoKα | null | 0.035 | null | null | null | 0.033 | null | null | null | null | null | 1.77 | null | null | has coordinates | Kashino, Setsuo; Taka, Jun-ichiro; Yoshida, Tadanori; Kubozono, Yoshihiro; Ishida, Hiroyuki; Maeda, Hironobu
Structure of Ammonium Hydrogen Succinate at 80 and 20 K
Acta Crystallographica Section B
54(6)
(1998)
889-894 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,322,427 | 7.8987 | 0.0008 | 14.976 | 0.002 | 10.7734 | 0.0013 | 90 | 0.02 | 96.242 | 0.011 | 90 | 0.013 | 1,266.8 | 0.3 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | C 1 c 1 | C -2yc | 9 | - C14 H12 O4 S - | - C14 H12 O4 S - | - C56 H48 O16 S4 - | 4 | 1 | Peter W. Roesky; Markus R. Bürgstein | Bridged Aminotroponiminate Complexes of the Lanthanides | Inorganic Chemistry | 1,999 | 38 | 5629 | 5632 | 10.1021/ic990533c | 0.71073 | MoKa | 0.041 | 0.0392 | null | 0.116 | 0.1109 | null | null | null | 1.079 | 1.051 | 1.051 | null | null | null | has coordinates | Peter W. Roesky; Markus R. Bürgstein
Bridged Aminotroponiminate Complexes of the Lanthanides
Inorganic Chemistry
38
(1999)
5629-5632 | 301,838 | 2025-08-20 | 22:17:37 | #------------------------------------------------------------------------------
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2,003,036 | 7.46 | 0.001 | 8.805 | 0.002 | 4.6768 | 0.0005 | 91.84 | 0.01 | 92.73 | 0.01 | 101.2 | 0.01 | 300.74 | 0.09 | 20 | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | Ammonium Hydrogen Succinate | - C4 H9 N O4 - | - C4 H9 N O4 - | - C8 H18 N2 O8 - | 2 | 1 | OA0011 | Kashino, Setsuo; Taka, Jun-ichiro; Yoshida, Tadanori; Kubozono, Yoshihiro; Ishida, Hiroyuki; Maeda, Hironobu | Structure of Ammonium Hydrogen Succinate at 80 and 20 K | Acta Crystallographica Section B | 1,998 | 54 | 6 | 889 | 894 | 10.1107/S0108768198005448 | 0.71073 | MoKα | null | 0.034 | null | null | null | 0.034 | null | null | null | null | null | 1.79 | null | null | has coordinates | Kashino, Setsuo; Taka, Jun-ichiro; Yoshida, Tadanori; Kubozono, Yoshihiro; Ishida, Hiroyuki; Maeda, Hironobu
Structure of Ammonium Hydrogen Succinate at 80 and 20 K
Acta Crystallographica Section B
54(6)
(1998)
889-894 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,037 | 13.293 | 0.002 | 16.657 | 0.002 | 8.944 | 0.002 | 90 | null | 93.09 | 0.01 | 90 | null | 1,977.5 | 0.6 | 297 | null | null | null | null | null | null | null | 3 | P 1 21/n 1 | -P 2yn | 14 | 2,4,6-triisopropylbenzophenone | - C22 H28 O - | - C22 H28 O - | - C88 H112 O4 - | 4 | 1 | OA0012 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. | Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones | Acta Crystallographica Section B | 1,998 | 54 | 6 | 895 | 906 | 10.1107/S0108768198005515 | 0.71073 | MoKα | null | 0.072 | null | null | 0.069 | null | null | null | null | 1.21 | 1.21 | null | null | null | has coordinates,has Fobs | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S.
Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones
Acta Crystallographica Section B
54(6)
(1998)
895-906 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003037.cif $
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2,003,038 | 10.765 | 0.003 | 17.292 | 0.004 | 11.228 | 0.004 | 90 | null | 91.61 | 0.03 | 90 | null | 2,089.2 | 1.1 | 293 | null | null | null | null | null | null | null | 3 | P 1 21/n 1 | -P 2yn | 14 | 3'-methoxy-2,4,6-triisopropylbenzophenone | - C23 H30 O2 - | - C23 H30 O2 - | - C92 H120 O8 - | 4 | 1 | OA0012 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. | Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones | Acta Crystallographica Section B | 1,998 | 54 | 6 | 895 | 906 | 10.1107/S0108768198005515 | 0.71073 | MoKα | null | 0.066 | null | null | 0.063 | null | null | null | null | 1.18 | 1.18 | null | null | null | has coordinates,has Fobs | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S.
Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones
Acta Crystallographica Section B
54(6)
(1998)
895-906 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003038.cif $
#-------------------------------------------------------------------... | ||||||||||
2,003,039 | 10.915 | 0.002 | 17.606 | 0.002 | 11.629 | 0.001 | 90 | null | 108.49 | 0.01 | 90 | null | 2,119.4 | 0.5 | 293 | null | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | 3'-chloroformyl-2,4,6-triisopropylbenzophenone | - C23 H27 Cl O2 - | - C23 H27 Cl O2 - | - C92 H108 Cl4 O8 - | 4 | 1 | OA0012 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. | Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones | Acta Crystallographica Section B | 1,998 | 54 | 6 | 895 | 906 | 10.1107/S0108768198005515 | 0.71073 | MoKα | null | 0.074 | null | null | 0.073 | null | null | null | null | 1.32 | 1.32 | null | null | null | has coordinates,has Fobs | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S.
Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones
Acta Crystallographica Section B
54(6)
(1998)
895-906 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003039.cif $
#-------------------------------------------------------------------... | ||||||||||
2,003,040 | 11.274 | 0.001 | 13.348 | 0.002 | 14.786 | 0.001 | 90 | null | 95.67 | 0.01 | 90 | null | 2,214.2 | 0.4 | 293 | null | null | null | null | null | null | null | 3 | P 1 21/n 1 | -P 2yn | 14 | 3'-methoxycarbonyl-2,4,6-triisopropylbenzophenone | - C24 H30 O3 - | - C24 H30 O3 - | - C96 H120 O12 - | 4 | 1 | OA0012 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. | Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones | Acta Crystallographica Section B | 1,998 | 54 | 6 | 895 | 906 | 10.1107/S0108768198005515 | 0.71073 | MoKα | null | 0.077 | null | null | 0.071 | null | null | null | null | 1.27 | 1.27 | null | null | null | has coordinates,has Fobs | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S.
Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones
Acta Crystallographica Section B
54(6)
(1998)
895-906 | 201,955 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-10-13 03:08:28 +0300 (Fri, 13 Oct 2017) $
#$Revision: 201955 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003040.cif $
#-------------------------------------------------------------------... | ||||||||||
2,003,041 | 10.789 | 0.002 | 14.804 | 0.002 | 13.528 | 0.002 | 90 | null | 104.62 | 0.01 | 90 | null | 2,090.7 | 0.6 | 293 | null | null | null | null | null | null | null | 3 | P 1 21/n 1 | -P 2yn | 14 | 4'-methyl-2,4,6-triisopropylbenzophenone | - C23 H30 O - | - C23 H30 O - | - C92 H120 O4 - | 4 | 1 | OA0012 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. | Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones | Acta Crystallographica Section B | 1,998 | 54 | 6 | 895 | 906 | 10.1107/S0108768198005515 | 0.71073 | MoKα | null | 0.074 | null | null | 0.07 | null | null | null | null | 1.23 | 1.23 | null | null | null | has coordinates,has Fobs | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S.
Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones
Acta Crystallographica Section B
54(6)
(1998)
895-906 | 201,955 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-10-13 03:08:28 +0300 (Fri, 13 Oct 2017) $
#$Revision: 201955 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003041.cif $
#-------------------------------------------------------------------... | ||||||||||
2,003,042 | 10.033 | 0.002 | 22.856 | 0.002 | 11.227 | 0.001 | 90 | null | 113.73 | 0.01 | 90 | null | 2,356.8 | 0.6 | 293 | null | null | null | null | null | null | null | 3 | P 1 21/n 1 | -P 2yn | 14 | 4'-tert-butyl-2,4,6-triisopropylbenzophenone | - C26 H36 O - | - C26 H36 O - | - C104 H144 O4 - | 4 | 1 | OA0012 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. | Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones | Acta Crystallographica Section B | 1,998 | 54 | 6 | 895 | 906 | 10.1107/S0108768198005515 | 0.71073 | MoKα | null | 0.081 | null | null | 0.075 | null | null | null | null | 1.33 | 1.33 | null | null | null | has coordinates,has Fobs | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S.
Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones
Acta Crystallographica Section B
54(6)
(1998)
895-906 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003042.cif $
#-------------------------------------------------------------------... | ||||||||||
2,003,043 | 9.312 | 0.002 | 12.005 | 0.002 | 18.804 | 0.002 | 90 | null | 90 | 0.01 | 90 | null | 2,102.1 | 0.6 | 297 | null | null | null | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | 4'-methoxy-2,4,6-triisopropylbenzophenone | - C23 H30 O2 - | - C23 H30 O2 - | - C92 H120 O8 - | 4 | 1 | OA0012 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. | Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones | Acta Crystallographica Section B | 1,998 | 54 | 6 | 895 | 906 | 10.1107/S0108768198005515 | 0.71073 | MoKα | null | 0.072 | null | null | 0.066 | null | null | null | null | 1.21 | 1.21 | null | null | null | has coordinates,has Fobs | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S.
Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones
Acta Crystallographica Section B
54(6)
(1998)
895-906 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003043.cif $
#-------------------------------------------------------------------... | ||||||||||
2,003,044 | 11.71 | 0.001 | 15.01 | 0.002 | 6.224 | 0.001 | 95.55 | 0.01 | 97.05 | 0.01 | 77.79 | 0.01 | 1,058.3 | 0.2 | 293 | null | null | null | null | null | null | null | 3 | P -1 | -P 1 | 2 | 4'-carboxyl-2,4,6-triisopropylbenzophenone | - C23 H28 O3 - | - C23 H28 O3 - | - C46 H56 O6 - | 2 | 1 | OA0012 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. | Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones | Acta Crystallographica Section B | 1,998 | 54 | 6 | 895 | 906 | 10.1107/S0108768198005515 | 0.71073 | MoKα | null | 0.068 | null | null | 0.064 | null | null | null | null | 1.08 | 1.08 | null | null | null | has coordinates | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S.
Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones
Acta Crystallographica Section B
54(6)
(1998)
895-906 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003044.cif $
#-------------------------------------------------------------------... | ||||||||||
2,003,045 | 17.466 | 0.002 | 20.537 | 0.002 | 11.749 | 0.002 | 90 | null | 90 | null | 90 | null | 4,214.4 | 1 | 293 | null | null | null | null | null | null | null | 4 | P c a b | -P 2bc 2ac | 61 | 4'-chloroformyl-2,4,6-triisopropylbenzophenone | - C23 H27 Cl O2 - | - C23 H27 Cl0.735 O2.562 - | - C184 H216 Cl5.88 O20.496 - | 8 | 1 | OA0012 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. | Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones | Acta Crystallographica Section B | 1,998 | 54 | 6 | 895 | 906 | 10.1107/S0108768198005515 | 0.71073 | MoKα | null | 0.076 | null | null | 0.069 | null | null | null | null | 1.4 | 1.4 | null | null | null | has coordinates,has Fobs | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S.
Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones
Acta Crystallographica Section B
54(6)
(1998)
895-906 | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003045.cif $
#-------------------------------------------------------------------... | ||||||||||
2,003,046 | 8.679 | 0.001 | 20.893 | 0.003 | 6.16 | 0.001 | 93.96 | 0.02 | 103.14 | 0.02 | 78.22 | 0.01 | 1,064.5 | 0.3 | 293 | null | null | null | null | null | null | null | 3 | P -1 | -P 1 | 2 | 4'-methoxycarbonyl-2,4,6-triisopropylbenzophenone | - C24 H30 O3 - | - C24 H30 O3 - | - C48 H60 O6 - | 2 | 1 | OA0012 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. | Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones | Acta Crystallographica Section B | 1,998 | 54 | 6 | 895 | 906 | 10.1107/S0108768198005515 | 0.71073 | MoKα | null | 0.052 | null | null | 0.056 | null | null | null | null | 1.05 | 1.05 | null | null | null | has coordinates | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S.
Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones
Acta Crystallographica Section B
54(6)
(1998)
895-906 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003046.cif $
#-------------------------------------------------------------------... | ||||||||||
2,003,047 | 10.83 | 0.002 | 12.717 | 0.002 | 9.379 | 0.001 | 104.53 | 0.01 | 99.15 | 0.01 | 105.14 | 0.01 | 1,171.6 | 0.3 | 293 | null | null | null | null | null | null | null | 3 | P -1 | -P 1 | 2 | 4'-ethoxycarbonyl-2,4,6-triisopropylbenzophenone | - C25 H32 O3 - | - C25 H32 O3 - | - C50 H64 O6 - | 2 | 1 | OA0012 | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S. | Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones | Acta Crystallographica Section B | 1,998 | 54 | 6 | 895 | 906 | 10.1107/S0108768198005515 | 0.71073 | MoKα | null | 0.068 | null | null | 0.072 | null | null | null | null | 1.16 | 1.16 | null | null | null | has coordinates | Fukushima, S.; Ito, Y.; Hosomi, H.; Ohba, S.
Structures and Photoreactivities of 2,4,6-Triisopropylbenzophenones
Acta Crystallographica Section B
54(6)
(1998)
895-906 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003047.cif $
#-------------------------------------------------------------------... | ||||||||||
2,003,048 | 10.798 | 0.003 | 30.042 | 0.003 | 9.407 | 0.003 | 90 | null | 90 | null | 90 | null | 3,051.6 | 1.3 | 293 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | 19 | 2,4,6-Triisopropyl-4'-(S)-phenylalaninocarbonylbenzophenone Methyl Ester | - C33 H39 N O4 - | - C33 H39 N O4 - | - C132 H156 N4 O16 - | 4 | 1 | OA0013 | Hosomi, H.; Ito, Y.; Ohba, S. | Crystal-to-Crystal Diastereoselective Transformation of 2,4,6-Triisopropyl-4'-(<i>S</i>)-phenylalaninocarbonylbenzophenone Methyl Ester | Acta Crystallographica Section B | 1,998 | 54 | 6 | 907 | 911 | 10.1107/S0108768198005503 | 0.71073 | MoKα | null | 0.08 | null | null | 0.07 | null | null | null | null | 1.34 | 1.34 | null | null | null | has coordinates,has Fobs | Hosomi, H.; Ito, Y.; Ohba, S.
Crystal-to-Crystal Diastereoselective Transformation of 2,4,6-Triisopropyl-4'-(<i>S</i>)-phenylalaninocarbonylbenzophenone Methyl Ester
Acta Crystallographica Section B
54(6)
(1998)
907-911 | 201,955 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-10-13 03:08:28 +0300 (Fri, 13 Oct 2017) $
#$Revision: 201955 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003048.cif $
#-------------------------------------------------------------------... | ||||||||||
2,003,049 | 11.525 | 0.009 | 28.238 | 0.011 | 9.317 | 0.008 | 90 | null | 90 | null | 90 | null | 3,032 | 4 | 298 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | 19 | 2,4-diisopropyl-1-{4'-(S)-phenylalaninocarbonylphenyl}-2,2-dimethyl- 1,2-dihydrobenzocyclobuten-1-ol Methyl Ester | - C33 H39 N O4 - | - C33 H39 N O4 - | - C132 H156 N4 O16 - | 4 | 1 | OA0013 | Hosomi, H.; Ito, Y.; Ohba, S. | Crystal-to-Crystal Diastereoselective Transformation of 2,4,6-Triisopropyl-4'-(<i>S</i>)-phenylalaninocarbonylbenzophenone Methyl Ester | Acta Crystallographica Section B | 1,998 | 54 | 6 | 907 | 911 | 10.1107/S0108768198005503 | 0.71073 | MoKα | null | 0.077 | null | null | 0.066 | null | null | null | null | 1.31 | 1.31 | null | null | null | has coordinates,has Fobs | Hosomi, H.; Ito, Y.; Ohba, S.
Crystal-to-Crystal Diastereoselective Transformation of 2,4,6-Triisopropyl-4'-(<i>S</i>)-phenylalaninocarbonylbenzophenone Methyl Ester
Acta Crystallographica Section B
54(6)
(1998)
907-911 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003049.cif $
#-------------------------------------------------------------------... | ||||||||||
2,003,050 | 11.691 | 0.002 | 17.51 | 0.003 | 10.683 | 0.002 | 90 | null | 90 | null | 90 | null | 2,186.9 | 0.7 | 293 | null | null | null | null | null | null | null | 3 | P 21 n b | P -2bc 2a | 33 | 2,4-diisopropyl-1-(3'-methoxycarbonylphenyl)-2,2-dimethyl- 1,2-dihydrobenzocyclobuten-1-ol | - C24 H30 O3 - | - C24 H30 O3 - | - C96 H120 O12 - | 4 | 1 | OA0013 | Hosomi, H.; Ito, Y.; Ohba, S. | Crystal-to-Crystal Diastereoselective Transformation of 2,4,6-Triisopropyl-4'-(<i>S</i>)-phenylalaninocarbonylbenzophenone Methyl Ester | Acta Crystallographica Section B | 1,998 | 54 | 6 | 907 | 911 | 10.1107/S0108768198005503 | 0.71073 | MoKα | null | 0.049 | null | null | 0.047 | null | null | null | null | 1.16 | 1.16 | null | null | null | has coordinates,has Fobs | Hosomi, H.; Ito, Y.; Ohba, S.
Crystal-to-Crystal Diastereoselective Transformation of 2,4,6-Triisopropyl-4'-(<i>S</i>)-phenylalaninocarbonylbenzophenone Methyl Ester
Acta Crystallographica Section B
54(6)
(1998)
907-911 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003050.cif $
#-------------------------------------------------------------------... | ||||||||||
2,003,051 | 3.877 | 0.004 | 15.6 | 0.01 | 9.375 | 0.006 | 90 | null | 98.45 | 0.07 | 90 | null | 560.9 | 0.8 | 150 | null | 150 | null | null | null | null | null | 4 | P 1 21/c 1 | null | nicotinamide | - C6 H6 N2 O - | - C3 H3 N O0.5 - | - C12 H12 N4 O2 - | 4 | 1 | OA0014 | Yoshihisa Miwa; Takashi Mizuno; Kazunori Tsuchida; Tooru Taga; Yutaka Iwata | Experimental charge density and electrostatic potential in nicotinamide | Acta Crystallographica Section B | 1,999 | 55 | 1 | 78 | 84 | 10.1107/S0108768198007848 | 0.71073 | MoKα | null | 0.054 | null | null | 0.056 | null | null | null | null | 0.29 | 0.29 | null | null | null | has coordinates,has Fobs | Yoshihisa Miwa; Takashi Mizuno; Kazunori Tsuchida; Tooru Taga; Yutaka Iwata
Experimental charge density and electrostatic potential in nicotinamide
Acta Crystallographica Section B
55(1)
(1999)
78-84 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003051.cif $
#-------------------------------------------------------------------... | |||||||||||
2,003,052 | 3.975 | 0.005 | 15.632 | 0.008 | 9.422 | 0.004 | 90 | null | 99.03 | 0.07 | 90 | null | 578.2 | null | 295 | null | 295 | null | null | null | null | null | 4 | P 1 21/c 1 | null | nicotinamide | - C6 H6 N2 O - | - C3 H3 N O0.5 - | - C12 H12 N4 O2 - | 4 | 1 | Yoshihisa Miwa; Takashi Mizuno; Kazunori Tsuchida; Tooru Taga; Yutaka Iwata | Experimental Charge Density and Electrostatic Potential in Nicotinamide | Acta Crystallographica, Section B | 1,999 | 55 | 78 | 84 | 0.71073 | MoKα | null | 0.057 | null | null | 0.066 | null | null | null | null | 0.4 | 0.4 | null | null | null | has coordinates | Yoshihisa Miwa; Takashi Mizuno; Kazunori Tsuchida; Tooru Taga; Yutaka Iwata
Experimental Charge Density and Electrostatic Potential in Nicotinamide
Acta Crystallographica, Section B
55
(1999)
78-84 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003052.cif $
#-------------------------------------------------------------------... | ||||||||||||||
4,322,426 | 15.509 | 0.006 | 10.936 | 0.004 | 17.491 | 0.005 | 90 | null | 96.53 | 0.03 | 90 | null | 2,947.3 | 1.8 | 153.2 | null | 153.2 | null | null | null | null | null | 7 | P 1 21/a 1 | -P 2yab | 14 | - C29 H23 Cl2 Cu F10 N4 O0.5 - | - C29.5 Cl2 Cu F10 N4 O - | - C118 Cl8 Cu4 F40 N16 O4 - | 4 | 1 | Christina Ng; Michal Sabat; Cassandra L. Fraser | Metal Complexes with Cis α Topology from Stereoselective Quadridentate Ligands with Amine, Pyridine, and Quinoline Donor Groups | Inorganic Chemistry | 1,999 | 38 | 5545 | 5556 | 10.1021/ic990475v | 0.7107 | MoKalpha | null | 0.0566 | null | null | 0.0778 | null | null | null | null | 2.274 | 2.274 | null | null | null | has coordinates | Christina Ng; Michal Sabat; Cassandra L. Fraser
Metal Complexes with Cis α Topology from Stereoselective Quadridentate Ligands with Amine, Pyridine, and Quinoline Donor Groups
Inorganic Chemistry
38
(1999)
5545-5556 | 176,467 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-16 22:30:59 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176467 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/4/32/24/4322426.cif $
#-------------------------------------------------------------------... | |||||||||||||
2,003,053 | 3.975 | 0.005 | 15.632 | 0.008 | 9.422 | 0.004 | 90 | null | 99.03 | 0.07 | 90 | null | 578.2 | null | 295 | null | 295 | null | null | null | null | null | 4 | P 1 21/c 1 | null | nicotinamide | - C6 H6 N2 O - | - C3 H3 N O0.5 - | - C12 H12 N4 O2 - | 4 | 1 | Yoshihisa Miwa; Takashi Mizuno; Kazunori Tsuchida; Tooru Taga; Yutaka Iwata | Experimental Charge Density and Electrostatic Potential in Nicotinamide | Acta Crystallographica, Section B | 1,999 | 55 | 78 | 84 | neutron | 1.005 | neutron | null | 0.06 | null | null | 0.068 | null | null | null | null | null | null | null | null | null | has coordinates | Yoshihisa Miwa; Takashi Mizuno; Kazunori Tsuchida; Tooru Taga; Yutaka Iwata
Experimental Charge Density and Electrostatic Potential in Nicotinamide
Acta Crystallographica, Section B
55
(1999)
78-84 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003053.cif $
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2,003,054 | 10.125 | 0.003 | 11.133 | 0.002 | 15.014 | 0.002 | 73.78 | 0.01 | 71.68 | 0.01 | 68.87 | 0.02 | 1,472 | 0.6 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C18 H40 Co K N12 O4 - | - C18 H40 Co K N12 O4 - | - C36 H80 Co2 K2 N24 O8 - | 2 | 1 | OA0016 | Steve C.F. Au-Yeung | Crystal structures of [18]aneN~6~H~2~K[Co(CN)~6~].4H~2~O, [16]aneN~4~H~2~K[Co(CN)~6~] and [12]aneN~4~H~3~[Co(CN)~6~].2H~2~O. Insight into the electrostatic and hydrogen-bonding interaction in self-assembling supercomplexes | Acta Crystallographica Section B | 1,999 | 55 | 3 | 389 | 395 | 10.1107/S0108768198014281 | 0.71073 | MoKα | 0.0964 | 0.0592 | null | 0.0745 | 0.0667 | null | null | null | null | 1.38 | 1.38 | null | null | null | has coordinates | Steve C.F. Au-Yeung
Crystal structures of [18]aneN~6~H~2~K[Co(CN)~6~].4H~2~O, [16]aneN~4~H~2~K[Co(CN)~6~] and [12]aneN~4~H~3~[Co(CN)~6~].2H~2~O. Insight into the electrostatic and hydrogen-bonding interaction in self-assembling supercomplexes
Acta Crystallographica Section B
55(3)
(1999)
389-395 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,055 | 10.675 | 0.002 | 10.516 | 0.002 | 21.051 | 0.004 | 90 | null | 91.89 | 0.03 | 90 | null | 2,361.9 | 0.8 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - C18 H30 Co K N10 - | - C18 H30 Co K N10 - | - C72 H120 Co4 K4 N40 - | 4 | 1 | OA0016 | Steve C.F. Au-Yeung | Crystal structures of [18]aneN~6~H~2~K[Co(CN)~6~].4H~2~O, [16]aneN~4~H~2~K[Co(CN)~6~] and [12]aneN~4~H~3~[Co(CN)~6~].2H~2~O. Insight into the electrostatic and hydrogen-bonding interaction in self-assembling supercomplexes | Acta Crystallographica Section B | 1,999 | 55 | 3 | 389 | 395 | 10.1107/S0108768198014281 | 0.71073 | MoKα | 0.107 | 0.0489 | null | 0.0625 | 0.0582 | null | null | null | null | 1.62 | 1.62 | null | null | null | has coordinates | Steve C.F. Au-Yeung
Crystal structures of [18]aneN~6~H~2~K[Co(CN)~6~].4H~2~O, [16]aneN~4~H~2~K[Co(CN)~6~] and [12]aneN~4~H~3~[Co(CN)~6~].2H~2~O. Insight into the electrostatic and hydrogen-bonding interaction in self-assembling supercomplexes
Acta Crystallographica Section B
55(3)
(1999)
389-395 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,056 | 7.635 | 0.002 | 8.202 | 0.005 | 9.442 | 0.003 | 109.08 | 0.01 | 103.46 | 0.01 | 107.03 | 0.01 | 497.7 | 0.4 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 | P 1 | 1 | - C14 H27 Co N10 O2 - | - C14 H22 Co N10 O2 - | - C14 H22 Co N10 O2 - | 1 | 1 | OA0016 | Steve C.F. Au-Yeung | Crystal structures of [18]aneN~6~H~2~K[Co(CN)~6~].4H~2~O, [16]aneN~4~H~2~K[Co(CN)~6~] and [12]aneN~4~H~3~[Co(CN)~6~].2H~2~O. Insight into the electrostatic and hydrogen-bonding interaction in self-assembling supercomplexes | Acta Crystallographica Section B | 1,999 | 55 | 3 | 389 | 395 | 10.1107/S0108768198014281 | 0.71073 | MoKα | 0.0802 | 0.0614 | null | 0.082 | 0.0741 | null | null | null | null | 1.37 | 1.37 | null | null | null | has coordinates | Steve C.F. Au-Yeung
Crystal structures of [18]aneN~6~H~2~K[Co(CN)~6~].4H~2~O, [16]aneN~4~H~2~K[Co(CN)~6~] and [12]aneN~4~H~3~[Co(CN)~6~].2H~2~O. Insight into the electrostatic and hydrogen-bonding interaction in self-assembling supercomplexes
Acta Crystallographica Section B
55(3)
(1999)
389-395 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,057 | 8.507 | 0.003 | 10.613 | 0.004 | 12.457 | 0.003 | 80.05 | 0.03 | 71.38 | 0.02 | 76.69 | 0.03 | 1,031.2 | 0.6 | 295 | null | 295 | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C24 H21 O6 P - | - C26 H24 O6 P - | - C52 H48 O12 P2 - | 2 | 1 | OA0018 | Cho, Ching-Sheng; Dr Liau, Wen-Bin; Dr Chen, Leo-Wang | Single-crystal structure analysis of a novel aryl phosphinate diglycidyl ether | Acta Crystallographica Section B | 1,999 | 55 | 4 | 525 | 529 | 10.1107/S010876819900018X | 0.71073 | MolybdenumKα | 0.063 | 0.063 | null | 0.057 | 0.057 | null | null | null | null | 1.48 | 1.48 | null | null | null | has coordinates | Cho, Ching-Sheng; Dr Liau, Wen-Bin; Dr Chen, Leo-Wang
Single-crystal structure analysis of a novel aryl phosphinate diglycidyl ether
Acta Crystallographica Section B
55(4)
(1999)
525-529 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,058 | 20.0097 | 0.0013 | 15.249 | 0.002 | 10.4168 | 0.0018 | 90 | null | 90 | null | 90 | null | 3,178.5 | 0.7 | 296 | 2 | 296 | null | null | null | null | null | 5 | P b c a | -P 2ac 2ab | 61 | F-TEMPO | 4-(4-fluorophenyl)methyleneamino-2,2,6,6-tetramethylpiperidin-1-oxyl | - C16 H22 F N2 O - | - C16 H22 F N2 O - | - C128 H176 F8 N16 O8 - | 8 | 1 | OA0019 | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi | TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 2 | 231 | 245 | 10.1107/S0108768198012786 | 0.71073 | MoKα | 0.103 | 0.0425 | null | null | null | 0.1397 | null | null | null | null | null | 0.989 | null | null | has coordinates,has Fobs | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds
Acta Crystallographica, Section B: Structural Science
55(2)
(1999)
231-245 | 208,977 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,059 | 10.98 | 0.004 | 38.914 | 0.004 | 8.358 | 0.004 | 90 | null | 103.88 | 0.03 | 90 | null | 3,467 | 2 | 295 | null | 295 | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | I-TEMPO(b) | 4-(4-iodophenyl)methyleneamino-2,2,6,6-tetramethylpiperidin-1-oxyl | - C16 H22 I N2 O - | - C16 H22 I N2 O - | - C128 H176 I8 N16 O8 - | 8 | 2 | OA0019 | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi | TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 2 | 231 | 245 | 10.1107/S0108768198012786 | 0.71073 | MoKα | 0.0766 | 0.037 | null | null | null | 0.107 | null | null | null | null | null | 1.029 | null | null | has coordinates,has Fobs | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds
Acta Crystallographica, Section B: Structural Science
55(2)
(1999)
231-245 | 208,977 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-07-11 17:24:05 +0300 (Wed, 11 Jul 2018) $
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2,003,060 | 7.977 | 0.006 | 20.158 | 0.007 | 11.383 | 0.009 | 90 | null | 125.95 | 0.06 | 90 | null | 1,482 | 2 | 295 | null | 295 | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | 4-Py-TEMPO | 4-(4-pyridyl)methyleneamino-2,2,6,6-tetramethylpiperidin-1-oxyl | - C15 H22 N3 O - | - C15 H22 N3 O - | - C60 H88 N12 O4 - | 4 | 1 | OA0019 | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi | TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 2 | 231 | 245 | 10.1107/S0108768198012786 | 0.71073 | MoKα | 0.0621 | 0.0407 | null | null | null | 0.1204 | null | null | null | null | null | 1.001 | null | null | has coordinates,has Fobs | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds
Acta Crystallographica, Section B: Structural Science
55(2)
(1999)
231-245 | 208,977 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-07-11 17:24:05 +0300 (Wed, 11 Jul 2018) $
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2,003,061 | 14.035 | 0.003 | 22.964 | 0.003 | 10.71 | 0.002 | 90 | null | 90 | null | 90 | null | 3,451.8 | 1.1 | 295 | null | 295 | null | null | null | null | null | 5 | P b c a | -P 2ac 2ab | 61 | 3,5-diCl-TEMPO | 4-(3,5-dichlorophenyl)methyleneamino-2,2,6,6-tetramethylpiperidin-1-oxyl | - C16 H21 Cl2 N2 O - | - C16 H21 Cl2 N2 O - | - C128 H168 Cl16 N16 O8 - | 8 | 1 | OA0019 | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi | TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 2 | 231 | 245 | 10.1107/S0108768198012786 | 0.71073 | MoKα | 0.1287 | 0.0491 | null | null | null | 0.1233 | null | null | null | null | null | 0.996 | null | null | has coordinates,has Fobs | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds
Acta Crystallographica, Section B: Structural Science
55(2)
(1999)
231-245 | 208,977 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-07-11 17:24:05 +0300 (Wed, 11 Jul 2018) $
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2,003,062 | 5.8845 | 0.0019 | 24.417 | 0.002 | 11.397 | 0.002 | 90 | null | 104.09 | 0.02 | 90 | null | 1,588.3 | 0.6 | 293 | null | 293 | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | Cl-TEMPO | 4-(4-chlorophenyl)methyleneamino-2,2,6,6-tetramethylpiperidin-1-oxyl | - C16 H22 Cl N2 O - | - C16 H22 Cl N2 O - | - C64 H88 Cl4 N8 O4 - | 4 | 1 | OA0019 | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi | TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 2 | 231 | 245 | 10.1107/S0108768198012786 | 0.71073 | MoKα | 0.0798 | 0.0399 | null | null | null | 0.1186 | null | null | null | null | null | 0.993 | null | null | has coordinates,has Fobs | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds
Acta Crystallographica, Section B: Structural Science
55(2)
(1999)
231-245 | 208,977 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-07-11 17:24:05 +0300 (Wed, 11 Jul 2018) $
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4,322,425 | 7.4655 | 0.0015 | 8.952 | 0.0018 | 11.116 | 0.002 | 90 | null | 92.816 | 0.005 | 90 | null | 742 | 0.2 | 115 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C6 H8 Cu5 N6 O4 - | - C6 Cu5 N6 O4 - | - C12 Cu10 N12 O8 - | 2 | 0.5 | Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta | Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused "Slinky", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family | Inorganic Chemistry | 1,999 | 38 | 5484 | 5494 | 10.1021/ic990385q | 0.71073 | MoKα | 0.0706 | 0.0442 | null | null | 0.0968 | 0.1067 | null | null | null | null | null | 0.983 | null | null | has coordinates | Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta
Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused "Slinky", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family
Inorganic Chemistry
38
(1999)
5484-5494 | 179,327 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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#$Revision: 179327 $
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2,003,063 | 7.541 | 0.001 | 20.848 | 0.003 | 10.591 | 0.001 | 90 | null | 91.56 | 0.01 | 90 | null | 1,664.4 | 0.4 | 295 | null | 295 | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | Br-TEMPO | 4-(4-bromophenyl)methyleneamino-2,2,6,6-tetramethylpiperidin-1-oxyl | - C16 H22 Br N2 O - | - C16 H22 Br N2 O - | - C64 H88 Br4 N8 O4 - | 4 | 1 | OA0019 | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi | TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 2 | 231 | 245 | 10.1107/S0108768198012786 | 0.71073 | MoKα | 0.1421 | 0.0462 | null | null | null | 0.0982 | null | null | null | null | null | 0.97 | null | null | has coordinates,has Fobs | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds
Acta Crystallographica, Section B: Structural Science
55(2)
(1999)
231-245 | 208,977 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,064 | 5.889 | 0.004 | 25.851 | 0.003 | 11.322 | 0.003 | 90 | null | 105.27 | 0.03 | 90 | null | 1,662.8 | 1.3 | 293 | null | 293 | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | I-TEMPO(a) | 4-(4-iodophenyl)methyleneamino-2,2,6,6-tetramethylpiperidin-1-oxyl | - C16 H22 I N2 O - | - C16 H22 I N2 O - | - C64 H88 I4 N8 O4 - | 4 | 1 | OA0019 | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi | TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 2 | 231 | 245 | 10.1107/S0108768198012786 | 0.71073 | MoKα | 0.071 | 0.0329 | null | null | null | 0.0945 | null | null | null | null | null | 0.992 | null | null | has coordinates,has Fobs | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds
Acta Crystallographica, Section B: Structural Science
55(2)
(1999)
231-245 | 208,977 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-07-11 17:24:05 +0300 (Wed, 11 Jul 2018) $
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2,003,065 | 5.955 | 0.001 | 28.488 | 0.005 | 11.796 | 0.002 | 90 | null | 106.72 | 0.02 | 90 | null | 1,916.5 | 0.6 | 296 | null | 296 | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | biPh-TEMPO | 4-(biphenyl-4-yl)methyleneamino-2,2,6,6-tetramethylpiperidin-1-oxyl | - C22 H27 N2 O - | - C22 H27 N2 O - | - C88 H108 N8 O4 - | 4 | 1 | OA0019 | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi | TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 2 | 231 | 245 | 10.1107/S0108768198012786 | 0.71073 | MoKα | 0.1175 | 0.0624 | null | null | null | 0.1817 | null | null | null | null | null | 0.981 | null | null | has coordinates,has Fobs | Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds
Acta Crystallographica, Section B: Structural Science
55(2)
(1999)
231-245 | 208,977 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,066 | 12.0062 | 0.0005 | 12.0062 | 0.0005 | 12.0062 | 0.0005 | 90 | null | 90 | null | 90 | null | 1,730.68 | 0.12 | 296 | null | null | null | null | null | null | null | 3 | I a -3 d | -I 4bd 2c 3 | 230 | - Al5 O12 Y3 - | - Al5 O12 Y3 - | - Al40 O96 Y24 - | 8 | 0.083333 | OH0057 | Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T. | Cation distribution and crystal chemistry of Y~3~Al~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) garnet solid solutions | Acta Crystallographica Section B | 1,999 | 55 | 3 | 266 | 272 | 10.1107/S0108768198012567 | 0.71069 | MoKα | null | 0.029 | null | null | 0.026 | null | null | null | null | null | null | null | null | null | has coordinates | Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.
Cation distribution and crystal chemistry of Y~3~Al~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) garnet solid solutions
Acta Crystallographica Section B
55(3)
(1999)
266-272 | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,067 | 12.0432 | 0.0007 | 12.0432 | 0.0007 | 12.0432 | 0.0007 | 90 | null | 90 | null | 90 | null | 1,746.73 | 0.18 | 296 | null | null | null | null | null | null | null | 4 | I a -3 d | -I 4bd 2c 3 | 230 | - Al4 Ga O12 Y3 - | - Al4.002 Ga0.998 O12 Y3 - | - Al32.016 Ga7.984 O96 Y24 - | 8 | 0.083333 | OH0057 | Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T. | Cation distribution and crystal chemistry of Y~3~Al~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) garnet solid solutions | Acta Crystallographica Section B | 1,999 | 55 | 3 | 266 | 272 | 10.1107/S0108768198012567 | 0.71069 | MoKα | null | 0.022 | null | null | 0.016 | null | null | null | null | null | null | null | null | null | has coordinates | Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.
Cation distribution and crystal chemistry of Y~3~Al~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) garnet solid solutions
Acta Crystallographica Section B
55(3)
(1999)
266-272 | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,068 | 12.0926 | 0.0009 | 12.0926 | 0.0009 | 12.0926 | 0.0009 | 90 | null | 90 | null | 90 | null | 1,768.3 | 0.2 | 296 | null | null | null | null | null | null | null | 4 | I a -3 d | -I 4bd 2c 3 | 230 | - Al3 Ga2 O12 Y3 - | - Al2.999 Ga2.001 O12 Y3 - | - Al23.992 Ga16.008 O96 Y24 - | 8 | 0.083333 | OH0057 | Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T. | Cation distribution and crystal chemistry of Y~3~Al~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) garnet solid solutions | Acta Crystallographica Section B | 1,999 | 55 | 3 | 266 | 272 | 10.1107/S0108768198012567 | 0.71069 | MoKα | null | 0.018 | null | null | 0.017 | null | null | null | null | null | null | null | null | null | has coordinates | Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.
Cation distribution and crystal chemistry of Y~3~Al~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) garnet solid solutions
Acta Crystallographica Section B
55(3)
(1999)
266-272 | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,069 | 12.1552 | 0.0006 | 12.1552 | 0.0006 | 12.1552 | 0.0006 | 90 | null | 90 | null | 90 | null | 1,795.92 | 0.15 | 296 | null | null | null | null | null | null | null | 4 | I a -3 d | -I 4bd 2c 3 | 230 | - Al2 Ga3 O12 Y3 - | - Al2.001 Ga2.999 O12 Y3 - | - Al16.008 Ga23.992 O96 Y24 - | 8 | 0.083333 | OH0057 | Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T. | Cation distribution and crystal chemistry of Y~3~Al~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) garnet solid solutions | Acta Crystallographica Section B | 1,999 | 55 | 3 | 266 | 272 | 10.1107/S0108768198012567 | 0.71069 | MoKα | null | 0.018 | null | null | 0.013 | null | null | null | null | null | null | null | null | null | has coordinates | Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.
Cation distribution and crystal chemistry of Y~3~Al~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) garnet solid solutions
Acta Crystallographica Section B
55(3)
(1999)
266-272 | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,070 | 12.2123 | 0.0008 | 12.2123 | 0.0008 | 12.2123 | 0.0008 | 90 | null | 90 | null | 90 | null | 1,821.3 | 0.2 | 296 | null | null | null | null | null | null | null | 4 | I a -3 d | -I 4bd 2c 3 | 230 | - Al Ga4 O12 Y3 - | - Al0.999 Ga4.001 O12 Y3 - | - Al7.992 Ga32.008 O96 Y24 - | 8 | 0.083333 | OH0057 | Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T. | Cation distribution and crystal chemistry of Y~3~Al~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) garnet solid solutions | Acta Crystallographica Section B | 1,999 | 55 | 3 | 266 | 272 | 10.1107/S0108768198012567 | 0.71069 | MoKα | null | 0.014 | null | null | 0.009 | null | null | null | null | null | null | null | null | null | has coordinates | Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.
Cation distribution and crystal chemistry of Y~3~Al~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) garnet solid solutions
Acta Crystallographica Section B
55(3)
(1999)
266-272 | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,071 | 5.8884 | 0.0019 | 11.771 | 0.004 | 8.226 | 0.003 | 90 | null | 90 | null | 90 | null | 570.2 | 0.3 | 300 | null | null | null | null | null | null | null | 3 | P b a m | -P 2 2ab | null | - O3 Pb Zr - | - O3 Pb Zr - | - O24 Pb8 Zr8 - | 8 | 1 | OH0059 | Yamasaki, K.; Soejima, Y. | Superstructure Determination of PbZrO~3~ | Acta Crystallographica Section B | 1,998 | 54 | 5 | 524 | 530 | 10.1107/S0108768197018466 | 0.35 | synchrotron | null | 0.047 | null | null | 0.045 | null | null | null | null | 0.06 | 0.06 | null | null | null | has coordinates | Yamasaki, K.; Soejima, Y.
Superstructure Determination of PbZrO~3~
Acta Crystallographica Section B
54(5)
(1998)
524-530 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,072 | 13 | 0.004 | 29.1 | 0.004 | 11.6 | 0.004 | 90 | null | 90 | null | 90 | null | 4,388 | 2 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | 19 | geraniin | - C41 H42 O34 - | - C41 H42 O34 - | - C164 H168 O136 - | 4 | 1 | OH0063 | Luger, Peter; Weber, Manuela; Kashino,Setsuo; Amakura, Yoshiaki; Yoshida, Takashi; Okuda, Takuo; Beurskens, Gezina; Dauter, Zbigniew | Structure of the Tannin Geraniin Based on Conventional X-ray Data at 295 K and on Synchrotron Data at 293 and 120 K | Acta Crystallographica Section B | 1,998 | 54 | 5 | 687 | 694 | 10.1107/S0108768198000081 | 0.86 | synchrotron | 0.0614 | 0.0557 | null | 0.1599 | 0.1535 | null | null | null | 1.046 | 1.074 | 1.074 | null | null | null | has coordinates | Luger, Peter; Weber, Manuela; Kashino,Setsuo; Amakura, Yoshiaki; Yoshida, Takashi; Okuda, Takuo; Beurskens, Gezina; Dauter, Zbigniew
Structure of the Tannin Geraniin Based on Conventional X-ray Data at 295 K and on Synchrotron Data at 293 and 120 K
Acta Crystallographica Section B
54(5)
(1998)
687-694 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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4,322,424 | 11.59 | 0.003 | 20.555 | 0.004 | 16.158 | 0.003 | 90 | null | 103.865 | 0.005 | 90 | null | 3,737.2 | 1.4 | 115 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | - C17 H10 Cu4 N8 - | - C17 H10 Cu4 N8 - | - C136 H80 Cu32 N64 - | 8 | 2 | Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta | Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused "Slinky", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family | Inorganic Chemistry | 1,999 | 38 | 5484 | 5494 | 10.1021/ic990385q | 0.71073 | MoKα | 0.0403 | 0.0327 | null | null | 0.0792 | 0.0824 | null | null | null | null | null | 1.015 | null | null | has coordinates | Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta
Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused "Slinky", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family
Inorganic Chemistry
38
(1999)
5484-5494 | 179,327 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,073 | 12.96 | 0.002 | 29.11 | 0.002 | 11.51 | 0.002 | 90 | null | 90 | null | 90 | null | 4,342.3 | 1.1 | 120 | 2 | 120 | 2 | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | 19 | geraniin | - C41 H42 O34 - | - C41 H42 O34 - | - C164 H168 O136 - | 4 | 1 | OH0063 | Luger, Peter; Weber, Manuela; Kashino,Setsuo; Amakura, Yoshiaki; Yoshida, Takashi; Okuda, Takuo; Beurskens, Gezina; Dauter, Zbigniew | Structure of the Tannin Geraniin Based on Conventional X-ray Data at 295 K and on Synchrotron Data at 293 and 120 K | Acta Crystallographica Section B | 1,998 | 54 | 5 | 687 | 694 | 10.1107/S0108768198000081 | 0.928 | synchrotron | 0.0439 | 0.0379 | null | 0.143 | 0.0978 | null | null | null | 1.071 | 1.032 | 1.032 | null | null | null | has coordinates | Luger, Peter; Weber, Manuela; Kashino,Setsuo; Amakura, Yoshiaki; Yoshida, Takashi; Okuda, Takuo; Beurskens, Gezina; Dauter, Zbigniew
Structure of the Tannin Geraniin Based on Conventional X-ray Data at 295 K and on Synchrotron Data at 293 and 120 K
Acta Crystallographica Section B
54(5)
(1998)
687-694 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,074 | 13.055 | 0.002 | 29.139 | 0.004 | 11.576 | 0.001 | 90 | null | 90 | null | 90 | null | 4,403.6 | 1 | 295 | null | null | null | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | 19 | - C41 H42 O34 - | - C41 H29 O34 - | - C164 H116 O136 - | 4 | 1 | OH0063 | Luger, Peter; Weber, Manuela; Kashino,Setsuo; Amakura, Yoshiaki; Yoshida, Takashi; Okuda, Takuo; Beurskens, Gezina; Dauter, Zbigniew | Structure of the Tannin Geraniin Based on Conventional X-ray Data at 295 K and on Synchrotron Data at 293 and 120 K | Acta Crystallographica Section B | 1,998 | 54 | 5 | 687 | 694 | 10.1107/S0108768198000081 | 1.5418 | CuKα | null | 0.046 | null | null | 0.064 | null | null | null | null | 1.25 | 1.25 | null | null | null | has coordinates | Luger, Peter; Weber, Manuela; Kashino,Setsuo; Amakura, Yoshiaki; Yoshida, Takashi; Okuda, Takuo; Beurskens, Gezina; Dauter, Zbigniew
Structure of the Tannin Geraniin Based on Conventional X-ray Data at 295 K and on Synchrotron Data at 293 and 120 K
Acta Crystallographica Section B
54(5)
(1998)
687-694 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,075 | 12.94 | 0.003 | 18.06 | 0.002 | 22.544 | 0.011 | 90 | null | 96.29 | 0.02 | 90 | null | 5,237 | 3 | 132 | 2 | 132 | 2 | null | null | null | null | 6 | C 1 2/c 1 | -C 2yc | 15 | Tetrakis(2,2'-bipyridine)bis(mu-oxo)dimanganese(3+) hexanitratocerate(3-) pentahydrate | - C40 H42 Ce Mn2 N14 O25 - | - C40 H42 Ce Mn2 N14 O25 - | - C160 H168 Ce4 Mn8 N56 O100 - | 4 | 0.5 | OS0004 | D. Ramalakshmi; M. V. Rajasekharan | Crystallographic disorder in mixed-valent dioxo-bridged Mn^III,IV^ complexes. [Mn~2~O~2~(bpy)~4~][Ce(NO~3~)~6~].5H~2~O | Acta Crystallographica Section B | 1,999 | 55 | 2 | 186 | 191 | 10.1107/S0108768198011586 | 0.71073 | MoKα | 0.0539 | 0.0358 | null | 0.0947 | 0.0783 | null | null | null | 1.105 | 1.136 | 1.136 | null | null | null | has coordinates | D. Ramalakshmi; M. V. Rajasekharan
Crystallographic disorder in mixed-valent dioxo-bridged Mn^III,IV^ complexes. [Mn~2~O~2~(bpy)~4~][Ce(NO~3~)~6~].5H~2~O
Acta Crystallographica Section B
55(2)
(1999)
186-191 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,076 | 34.005 | 0.003 | 7.6024 | 0.0004 | 6.6358 | 0.0005 | 90.086 | 0.006 | 109.127 | 0.006 | 90.043 | 0.006 | 1,620.8 | 0.2 | 293 | null | 293 | null | null | null | null | null | 3 | C 1 | C 1 | 1 | bismuth tantalum oxide | - Bi7 O18 Ta3 - | - Bi7 O18 Ta3 - | - Bi28 O72 Ta12 - | 4 | null | OS0006 | Ling, C. D.; Schmid, S.; Withers, R. L.; Thompson, J. G.; Ishizawa, N.; Kishimoto, S | Solution and refinement of the crystal structure of Bi~7~Ta~3~O~18~ | Acta Crystallographica Section B | 1,999 | 55 | 2 | 157 | 164 | 10.1107/S0108768198011148 | 0.958 | synchrotron | 0.05 | 0.0386 | null | null | 0.0337 | null | null | null | null | 1.249 | 1.249 | null | null | null | has coordinates | Ling, C. D.; Schmid, S.; Withers, R. L.; Thompson, J. G.; Ishizawa, N.; Kishimoto, S
Solution and refinement of the crystal structure of Bi~7~Ta~3~O~18~
Acta Crystallographica Section B
55(2)
(1999)
157-164 | 209,123 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,322,423 | 8.542 | 0.002 | 9.802 | 0.002 | 20.439 | 0.004 | 82.468 | 0.005 | 83.126 | 0.005 | 79.832 | 0.005 | 1,661.7 | 0.6 | 115 | 2 | 293 | 2 | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C16 H10 Cu3 N7 - | - C16 H10 Cu3 N7 - | - C64 H40 Cu12 N28 - | 4 | 2 | Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta | Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused "Slinky", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family | Inorganic Chemistry | 1,999 | 38 | 5484 | 5494 | 10.1021/ic990385q | 0.71073 | MoKα | 0.0522 | 0.0421 | null | null | 0.1052 | 0.1094 | null | null | null | null | null | 1.01 | null | null | has coordinates | Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta
Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused "Slinky", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family
Inorganic Chemistry
38
(1999)
5484-5494 | 179,327 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,077 | 34.0084 | 0.0009 | 7.6069 | 0.0002 | 6.63644 | 0.00017 | 90 | null | 109.238 | 0.0011 | 90 | null | 1,620.97 | 0.07 | 293 | null | 293 | null | null | null | null | null | 3 | C 1 2/m 1 | -C 2y | 12 | bismuth tantalum oxide | - Bi7 O18 Ta3 - | - Bi7 O18 Ta3 - | - Bi28 O72 Ta12 - | 4 | 0.5 | OS0006 | Ling, C. D.; Schmid, S.; Withers, R. L.; Thompson, J. G.; Ishizawa, N.; Kishimoto, S | Solution and refinement of the crystal structure of Bi~7~Ta~3~O~18~ | Acta Crystallographica Section B | 1,999 | 55 | 2 | 157 | 164 | 10.1107/S0108768198011148 | neutron | null | neutron | null | null | null | null | null | null | null | null | 5.41 | null | null | null | null | null | has coordinates | Ling, C. D.; Schmid, S.; Withers, R. L.; Thompson, J. G.; Ishizawa, N.; Kishimoto, S
Solution and refinement of the crystal structure of Bi~7~Ta~3~O~18~
Acta Crystallographica Section B
55(2)
(1999)
157-164 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,078 | 12.934 | 0.003 | 14.748 | 0.003 | 15.858 | 0.003 | 90 | null | 90 | null | 90 | null | 3,024.9 | 1.1 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P b c a | -P 2ac 2ab | 61 | 4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium iodide | - C19 H9 I O3 - | - C19 H9 I O3 - | - C152 H72 I8 O24 - | 8 | 1 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.0496 | 0.0438 | null | null | null | 0.1104 | null | null | null | null | null | 1.196 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 208,975 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,079 | 12.817 | 0.003 | 15.196 | 0.003 | 15.396 | 0.003 | 90 | null | 90 | null | 90 | null | 2,998.6 | 1.1 | 120 | 2 | 293 | 2 | null | null | null | null | 5 | P b c a | -P 2ac 2ab | 61 | 4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium tetrafluoroborate | - C19 H9 B F4 O3 - | - C19 H9 B F4 O3 - | - C152 H72 B8 F32 O24 - | 8 | 1 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.059 | 0.0437 | null | null | null | 0.1239 | null | null | null | null | null | 1.031 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,080 | 13.55 | 0.003 | 15.807 | 0.003 | 32.201 | 0.006 | 90 | null | 90 | null | 90 | null | 6,897 | 2 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P b c a | -P 2ac 2ab | 61 | 4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluoroarsenate | - C19 H9 As F6 O3 - | - C19 H9 As F6 O3 - | - C304 H144 As16 F96 O48 - | 16 | 2 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.0967 | 0.0572 | null | null | null | 0.1779 | null | null | null | null | null | 1.068 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 208,975 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,081 | 12.946 | 0.002 | 12.946 | 0.002 | 16.806 | 0.003 | 90 | null | 90 | null | 120 | null | 2,439.3 | 0.7 | 120 | 2 | 293 | 2 | null | null | null | null | 5 | R -3 c :H | -R 3 2"c | 167 | 4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate | - C19 H9 F6 O3 P - | - C19 H9 F6 O3 P - | - C114 H54 F36 O18 P6 - | 6 | 0.166667 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.0336 | 0.0261 | null | null | null | 0.0819 | null | null | null | null | null | 1.047 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,082 | 6.496 | 0.0013 | 7.653 | 0.0015 | 33.039 | 0.007 | 90 | null | 91.95 | 0.03 | 90 | null | 1,641.5 | 0.6 | 120 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | 4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium nitratehydrogennitrate | - C19 H10 N2 O9 - | - C19 H10 N2 O9 - | - C76 H40 N8 O36 - | 4 | 1 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.0852 | 0.0425 | null | null | null | 0.1134 | null | null | null | null | null | 1.002 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 208,975 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,083 | 15.771 | 0.003 | 15.473 | 0.003 | 15.332 | 0.003 | 90 | null | 115.7 | 0.03 | 90 | null | 3,371.3 | 1.4 | 120 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | 4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium trifluoromethanesulphonate | - C20 H9 F3 O6 S - | - C20 H9 F3 O6 S - | - C160 H72 F24 O48 S8 - | 8 | 2 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.0394 | 0.0315 | null | null | null | 0.0889 | null | null | null | null | null | 1.022 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,084 | 18.205 | 0.004 | 13.54 | 0.003 | 18.679 | 0.004 | 90 | null | 97.93 | 0.03 | 90 | null | 4,560.3 | 1.8 | 120 | 2 | 293 | 2 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | Bis(4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium) tetradecachlorohexamolybdate | - C38 H18 Cl14 Mo6 O6 - | - C38 H18 Cl14 Mo6 O6 - | - C152 H72 Cl56 Mo24 O24 - | 4 | 0.5 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.0288 | 0.0221 | null | null | null | 0.0563 | null | null | null | null | null | 1.094 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 219,800 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2019-10-28 09:23:29 +0200 (Mon, 28 Oct 2019) $
#$Revision: 219800 $
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2,003,085 | 8.63 | 0.0017 | 8.968 | 0.0018 | 9.876 | 0.002 | 97.91 | 0.03 | 102.37 | 0.03 | 108.61 | 0.03 | 689.8 | 0.3 | 120 | 2 | 293 | 2 | null | null | null | null | 4 | P -1 | -P 1 | 2 | Bis(4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium) dithionate | - C38 H18 O12 S2 - | - C38 H18 O12 S2 - | - C38 H18 O12 S2 - | 1 | 0.5 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.0375 | 0.0323 | null | null | null | 0.0923 | null | null | null | null | null | 1.024 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 219,800 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2019-10-28 09:23:29 +0200 (Mon, 28 Oct 2019) $
#$Revision: 219800 $
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2,003,086 | 12.085 | 0.002 | 11.347 | 0.002 | 22.93 | 0.005 | 90 | null | 102.87 | 0.03 | 90 | null | 3,065.4 | 1.1 | 120 | 2 | 293 | 2 | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | 2,6,10-tri-tert-butyl-4,8,12-trioxa-4,8,12,12c-tetrahydro- dibenzo[cd,mn]pyrenium hexafluorophosphate acetonitrile | - C33 H36 F6 N O3 P - | - C33 H36.009 F6 N O3 P - | - C132 H144.036 F24 N4 O12 P4 - | 4 | 1 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.0484 | 0.0364 | null | null | null | 0.0997 | null | null | null | null | null | 1.043 | null | null | has coordinates,has disorder | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 208,975 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-07-11 16:43:08 +0300 (Wed, 11 Jul 2018) $
#$Revision: 208975 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003086.cif $
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2,003,087 | 17.157 | 0.003 | 11.13 | 0.002 | 18.456 | 0.004 | 90 | null | 96.4 | 0.03 | 90 | null | 3,502.3 | 1.2 | 120 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | Bis(2,6,10-tri-tert-butyl-4,8,12-trioxa-4,8,12,12c-tetrahydro- dibenzo[cd,mn]pyrenium) tetradecachlorohexamolybdate | - C62 H66 Cl14 Mo6 O6 - | - C62 H66 Cl14 Mo6 O6 - | - C124 H132 Cl28 Mo12 O12 - | 2 | 0.5 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.0294 | 0.0234 | null | null | null | 0.0582 | null | null | null | null | null | 1.097 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 219,800 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2019-10-28 09:23:29 +0200 (Mon, 28 Oct 2019) $
#$Revision: 219800 $
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4,322,422 | 9.7582 | 0.0001 | 17.1622 | 0.0002 | 9.901 | null | 90 | null | 106.869 | 0.001 | 90 | null | 1,586.79 | 0.03 | 115 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | - C28 H20 Cu6 N14 - | - C28 H20 Cu6 N14 - | - C56 H40 Cu12 N28 - | 2 | 0.5 | Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta | Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused "Slinky", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family | Inorganic Chemistry | 1,999 | 38 | 5484 | 5494 | 10.1021/ic990385q | 0.71073 | MoKα | 0.0331 | 0.0265 | null | null | 0.0574 | 0.0594 | null | null | null | null | null | 1.058 | null | null | has coordinates | Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta
Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused "Slinky", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family
Inorganic Chemistry
38
(1999)
5484-5494 | 179,327 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,088 | 12.964 | 0.002 | 12.964 | 0.002 | 16.813 | 0.003 | 90 | null | 90 | null | 120 | null | 2,447.1 | 0.7 | 160 | 2 | 293 | 2 | null | null | null | null | 5 | R -3 c :H | -R 3 2"c | 167 | 4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate | - C19 H9 F6 O3 P - | - C19 H9 F6 O3 P - | - C114 H54 F36 O18 P6 - | 6 | 0.166667 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.0462 | 0.031 | null | null | null | 0.0902 | null | null | null | null | null | 1.036 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,003,089 | 12.997 | 0.002 | 12.997 | 0.002 | 16.843 | 0.003 | 90 | null | 90 | null | 120 | null | 2,464 | 0.7 | 198 | 2 | 293 | 2 | null | null | null | null | 5 | R -3 c :H | -R 3 2"c | 167 | 4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate | - C19 H9 F6 O3 P - | - C19 H9 F6 O3 P - | - C114 H54 F36 O18 P6 - | 6 | 0.166667 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.0585 | 0.0333 | null | null | null | 0.0988 | null | null | null | null | null | 1.06 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 208,975 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-07-11 16:43:08 +0300 (Wed, 11 Jul 2018) $
#$Revision: 208975 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/30/2003089.cif $
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2,003,090 | 13.015 | 0.002 | 13.015 | 0.002 | 16.859 | 0.003 | 90 | null | 90 | null | 120 | null | 2,473.2 | 0.7 | 220 | 2 | 293 | 2 | null | null | null | null | 5 | R -3 c :H | -R 3 2"c | 167 | 4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate | - C19 H9 F6 O3 P - | - C19 H9 F6 O3 P - | - C114 H54 F36 O18 P6 - | 6 | 0.166667 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.0593 | 0.0325 | null | null | null | 0.0993 | null | null | null | null | null | 1.022 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,003,091 | 13.04 | 0.002 | 13.04 | 0.002 | 16.884 | 0.003 | 90 | null | 90 | null | 120 | null | 2,486.3 | 0.7 | 243 | 2 | 293 | 2 | null | null | null | null | 5 | R -3 c :H | -R 3 2"c | 167 | 4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate | - C19 H9 F6 O3 P - | - C19 H9 F6 O3 P - | - C114 H54 F36 O18 P6 - | 6 | 0.166667 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.0638 | 0.0296 | null | null | null | 0.0953 | null | null | null | null | null | 0.948 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,092 | 13.067 | 0.002 | 13.067 | 0.002 | 16.91 | 0.003 | 90 | null | 90 | null | 120 | null | 2,500.5 | 0.7 | 268 | 2 | 293 | 2 | null | null | null | null | 5 | R -3 c :H | -R 3 2"c | 167 | 4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate | - C19 H9 F6 O3 P - | - C19 H9 F6 O3 P - | - C114 H54 F36 O18 P6 - | 6 | 0.166667 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.0758 | 0.0371 | null | null | null | 0.1124 | null | null | null | null | null | 1.067 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,093 | 13.094 | 0.002 | 13.094 | 0.002 | 16.937 | 0.003 | 90 | null | 90 | null | 120 | null | 2,514.8 | 0.7 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | R -3 c :H | -R 3 2"c | 167 | 4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate | - C19 H9 F6 O3 P - | - C19 H9 F6 O3 P - | - C114 H54 F36 O18 P6 - | 6 | 0.166667 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.0851 | 0.0344 | null | null | null | 0.1106 | null | null | null | null | null | 1.001 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,094 | 13.111 | 0.002 | 13.111 | 0.002 | 16.953 | 0.003 | 90 | null | 90 | null | 120 | null | 2,523.8 | 0.7 | 313 | 2 | 293 | 2 | null | null | null | null | 5 | R -3 c :H | -R 3 2"c | 167 | 4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate | - C19 H9 F6 O3 P - | - C19 H9 F6 O3 P - | - C114 H54 F36 O18 P6 - | 6 | 0.166667 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.0863 | 0.0363 | null | null | null | 0.1095 | null | null | null | null | null | 1.054 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,095 | 13.131 | 0.002 | 13.131 | 0.002 | 16.97 | 0.003 | 90 | null | 90 | null | 120 | null | 2,534 | 0.7 | 338 | 2 | 293 | 2 | null | null | null | null | 5 | R -3 c :H | -R 3 2"c | 167 | 4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate | - C19 H9 F6 O3 P - | - C19 H9 F6 O3 P - | - C114 H54 F36 O18 P6 - | 6 | 0.166667 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.1019 | 0.0365 | null | null | null | 0.1137 | null | null | null | null | null | 1.049 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 208,975 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,096 | 13.181 | 0.002 | 13.181 | 0.002 | 17.025 | 0.003 | 90 | null | 90 | null | 120 | null | 2,561.6 | 0.7 | 373 | 2 | 293 | 2 | null | null | null | null | 5 | R -3 c :H | -R 3 2"c | 167 | 4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate | - C19 H9 F6 O3 P - | - C19 H9 F6 O3 P - | - C114 H54 F36 O18 P6 - | 6 | 0.166667 | OS0007 | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal | The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions | Acta Crystallographica, Section B: Structural Science | 1,999 | 55 | 3 | 410 | 423 | 10.1107/S0108768198016140 | 0.71073 | MoKα | 0.1208 | 0.042 | null | null | null | 0.1276 | null | null | null | null | null | 1.093 | null | null | has coordinates | Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal
The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various mo... | 208,975 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,097 | 9.567 | 0.001 | 9.567 | 0.001 | 20.754 | 0.002 | 90 | null | 90 | null | 120 | null | 1,645.1 | 0.3 | 293 | null | null | null | null | null | null | null | 4 | P 63/m | -P 6c | 176 | - Ca15 I O37 P9 - | - Ca15 I1.048 O36.98 P9 - | - Ca30 I2.096 O73.96 P18 - | 2 | 0.166667 | OS0009 | Alberius Henning, Peter; Lidin, Sven; Petříček, Vačlav | Iodo-oxyapatite, the first example from a new class of modulated apatites | Acta Crystallographica Section B | 1,999 | 55 | 2 | 165 | 169 | 10.1107/S0108768198012312 | 0.7107 | MoKα | 0.0937 | 0.0452 | null | 0.0545 | 0.0459 | null | null | null | 1.01 | 1.29 | 1.29 | null | null | null | has coordinates | Alberius Henning, Peter; Lidin, Sven; Petříček, Vačlav
Iodo-oxyapatite, the first example from a new class of modulated apatites
Acta Crystallographica Section B
55(2)
(1999)
165-169 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,098 | 9.8944 | 0.0002 | 4.7425 | 0.0001 | 12.9045 | 0.0002 | 90 | null | 93.374 | 0.001 | 90 | null | 604.48 | 0.02 | 150 | 2 | 150 | 2 | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | L-Isoleucine:D-Alanine | - C9 H20 N2 O4 - | - C9 H20 N2 O4 - | - C18 H40 N4 O8 - | 2 | 1 | OS0011 | Dalhus, Bjørn; Görbitz, Carl Henrik | Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series | Acta Crystallographica Section B | 1,999 | 55 | 3 | 424 | 431 | 10.1107/S0108768198013494 | 0.71073 | MoKα | 0.0885 | 0.0612 | null | 0.1697 | 0.1548 | null | null | null | 1.004 | 1.084 | 1.084 | null | null | null | has coordinates | Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series
Acta Crystallographica Section B
55(3)
(1999)
424-431 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,003,099 | 26.9873 | 0.0006 | 4.7471 | 0.0001 | 9.9652 | 0.0002 | 90 | null | 94.546 | 0.001 | 90 | null | 1,272.64 | 0.05 | 170 | 2 | 170 | 2 | null | null | null | null | 4 | C 1 2 1 | C 2y | 5 | L-Isoleucine:D-aminobutyric acid | - C10 H22 N2 O4 - | - C10 H22 N2 O4 - | - C40 H88 N8 O16 - | 4 | 1 | OS0011 | Dalhus, Bjørn; Görbitz, Carl Henrik | Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series | Acta Crystallographica Section B | 1,999 | 55 | 3 | 424 | 431 | 10.1107/S0108768198013494 | 0.71073 | MoKα | 0.0428 | 0.0385 | null | 0.1043 | 0.0995 | null | null | null | 1.085 | 1.073 | 1.073 | null | null | null | has coordinates | Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series
Acta Crystallographica Section B
55(3)
(1999)
424-431 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,100 | 29.0557 | 0.0007 | 4.7551 | 0.0001 | 9.9398 | 0.0002 | 90 | null | 101.358 | 0.001 | 90 | null | 1,346.42 | 0.05 | 150 | 2 | 150 | 2 | null | null | null | null | 4 | C 1 2 1 | C 2y | 5 | L-Isoleucine:D-Norvaline | - C11 H24 N2 O4 - | - C11 H24 N2 O4 - | - C44 H96 N8 O16 - | 4 | 1 | OS0011 | Dalhus, Bjørn; Görbitz, Carl Henrik | Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series | Acta Crystallographica Section B | 1,999 | 55 | 3 | 424 | 431 | 10.1107/S0108768198013494 | 0.71073 | MoKα | 0.0364 | 0.0349 | null | 0.0971 | 0.0946 | null | null | null | 1.093 | 1.079 | 1.079 | null | null | null | has coordinates | Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series
Acta Crystallographica Section B
55(3)
(1999)
424-431 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,101 | 10.012 | 0.002 | 4.7227 | 0.0009 | 30.335 | 0.006 | 90 | null | 98.38 | 0.03 | 90 | null | 1,419 | 0.5 | 150 | 2 | 150 | 2 | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | L-Isoleucine:D-Norleucine | - C12 H26 N2 O4 - | - C12 H26 N2 O4 - | - C48 H104 N8 O16 - | 4 | 2 | OS0011 | Dalhus, Bjørn; Görbitz, Carl Henrik | Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series | Acta Crystallographica Section B | 1,999 | 55 | 3 | 424 | 431 | 10.1107/S0108768198013494 | 0.71073 | MoKα | 0.0621 | 0.0482 | null | 0.1183 | 0.1109 | null | null | null | 1.119 | 1.143 | 1.143 | null | null | null | has coordinates | Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series
Acta Crystallographica Section B
55(3)
(1999)
424-431 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,102 | 31.7681 | 0.0003 | 4.717 | 0.0001 | 10.0043 | 0.0001 | 90 | null | 105.914 | 0.001 | 90 | null | 1,441.69 | 0.04 | 150 | 2 | 150 | 2 | null | null | null | null | 5 | C 1 2 1 | C 2y | 5 | L-Isoleucine:D-Methionine | - C11 H24 N2 O4 S - | - C11 H24 N2 O4 S - | - C44 H96 N8 O16 S4 - | 4 | 1 | OS0011 | Dalhus, Bjørn; Görbitz, Carl Henrik | Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series | Acta Crystallographica Section B | 1,999 | 55 | 3 | 424 | 431 | 10.1107/S0108768198013494 | 0.71073 | MoKα | 0.0606 | 0.0419 | null | 0.1028 | 0.0931 | null | null | null | 1.075 | 1.088 | 1.088 | null | null | null | has coordinates | Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series
Acta Crystallographica Section B
55(3)
(1999)
424-431 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,103 | 5.2528 | 0.0001 | 23.9809 | 0.0006 | 5.42 | 0.0001 | 90 | null | 110.42 | 0.001 | 90 | null | 639.84 | 0.02 | 150 | 2 | 150 | 2 | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | L-Isoleucine:D-Valine | - C11 H24 N2 O4 - | - C11 H24 N2 O4 - | - C22 H48 N4 O8 - | 2 | 1 | OS0011 | Dalhus, Bjørn; Görbitz, Carl Henrik | Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series | Acta Crystallographica Section B | 1,999 | 55 | 3 | 424 | 431 | 10.1107/S0108768198013494 | 0.71073 | MoKα | 0.0532 | 0.0458 | null | 0.1114 | 0.1066 | null | null | null | 1.14 | 1.145 | 1.145 | null | null | null | has coordinates | Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series
Acta Crystallographica Section B
55(3)
(1999)
424-431 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,104 | 5.1933 | 0.0003 | 5.4064 | 0.0003 | 13.6968 | 0.0007 | 91.516 | 0.002 | 98.603 | 0.002 | 110.376 | 0.002 | 355.16 | 0.03 | 150 | 2 | 150 | 2 | null | null | null | null | 4 | P 1 | P 1 | 1 | L-Isoleucine:D-Leucine | - C12 H26 N2 O4 - | - C12 H26 N2 O4 - | - C12 H26 N2 O4 - | 1 | 1 | OS0011 | Dalhus, Bjørn; Görbitz, Carl Henrik | Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series | Acta Crystallographica Section B | 1,999 | 55 | 3 | 424 | 431 | 10.1107/S0108768198013494 | 0.71073 | MoKα | 0.0665 | 0.0526 | null | 0.134 | 0.1181 | null | null | null | 1.119 | 1.059 | 1.059 | null | null | null | has coordinates | Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series
Acta Crystallographica Section B
55(3)
(1999)
424-431 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,105 | 8.71083 | 0.00004 | 8.71083 | null | 17.32202 | 0.0001 | 90 | null | 90 | null | 90 | null | 1,314.37 | 0.01 | 293 | null | 293 | null | null | null | null | null | 3 | I 4/m | -I 4 | 87 | bismuth tungsten oxide | - Bi14 O24 W - | - Bi14 O24 W - | - Bi28 O48 W2 - | 2 | 0.125 | OS0017 | Ling, C. D.; Withers, R. L.; Thompson, J. G.; Schmid, S. | Structures of Bi~14~WO~24~ and Bi~14~MoO~24~ from neutron powder diffraction data | Acta Crystallographica Section B | 1,999 | 55 | 3 | 306 | 312 | 10.1107/S0108768198014086 | neutron | null | neutron | null | null | null | null | null | null | null | null | 2.71 | null | null | null | null | null | has coordinates | Ling, C. D.; Withers, R. L.; Thompson, J. G.; Schmid, S.
Structures of Bi~14~WO~24~ and Bi~14~MoO~24~ from neutron powder diffraction data
Acta Crystallographica Section B
55(3)
(1999)
306-312 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
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2,003,106 | 8.70839 | 0.00004 | 8.70839 | null | 17.31634 | 0.00014 | 90 | null | 90 | null | 90 | null | 1,313.2 | 0.012 | 293 | null | 293 | null | null | null | null | null | 3 | I 4/m | -I 4 | 87 | bismuth tungsten oxide | - Bi14 Mo O24 - | - Bi14 Mo O24 - | - Bi28 Mo2 O48 - | 2 | 0.125 | OS0017 | Ling, C. D.; Withers, R. L.; Thompson, J. G.; Schmid, S. | Structures of Bi~14~WO~24~ and Bi~14~MoO~24~ from neutron powder diffraction data | Acta Crystallographica Section B | 1,999 | 55 | 3 | 306 | 312 | 10.1107/S0108768198014086 | neutron | null | neutron | null | null | null | null | null | null | null | null | 2.59 | null | null | null | null | null | has coordinates | Ling, C. D.; Withers, R. L.; Thompson, J. G.; Schmid, S.
Structures of Bi~14~WO~24~ and Bi~14~MoO~24~ from neutron powder diffraction data
Acta Crystallographica Section B
55(3)
(1999)
306-312 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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4,322,421 | 9.1183 | 0.0005 | 9.9838 | 0.0006 | 12.7545 | 0.0008 | 94.206 | 0.001 | 90.492 | 0.001 | 112.534 | 0.001 | 1,068.72 | 0.11 | 115 | 2 | 293 | 2 | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C34 H24 Cu10 N22 - | - C34 H24 Cu10 N22 - | - C34 H24 Cu10 N22 - | 1 | 0.5 | Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta | Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused "Slinky", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family | Inorganic Chemistry | 1,999 | 38 | 5484 | 5494 | 10.1021/ic990385q | 0.71073 | MoKα | 0.0544 | 0.0414 | null | null | 0.1028 | 0.1113 | null | null | null | null | null | 1.046 | null | null | has coordinates | Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta
Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused "Slinky", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family
Inorganic Chemistry
38
(1999)
5484-5494 | 179,327 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,107 | 8.695 | 0.0008 | 12.1085 | 0.0015 | 12.4538 | 0.0011 | 80.905 | 0.007 | 86.368 | 0.009 | 84.22 | 0.009 | 1,286.4 | 0.2 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | P -1 | -P 1 | 2 | Hydrated,bis[(diethylenetrimine)copper]-μ-(1,3-imidazolate-N,N') triperchlorate | - C11 H29 Cl3 Cu2 N8 O13 - | - C11 H27 Cl3 Cu2 N8 O13 - | - C22 H54 Cl6 Cu4 N16 O26 - | 2 | 1 | Bu, Weiming; Ye, Ling; Zhu, Hailiang; Yang, Guangdi; Fan, Yuguo; Tang, Wenxia | μ-1,3-Imidazolyl-κN:κN'-bis[(diethylenetriaminato-κ^3^N)copper] triperchlorate hydrate | Acta Crystallographica, Section C: Crystal Structure Communications | 1,999 | 55 | 5 | IUC9900045 | 10.1107/s0108270199099527 | 0.71073 | MoKα | 0.0548 | 0.0426 | null | 0.0654 | 0.0521 | null | null | null | 1.015 | 1.156 | 1.156 | null | null | null | has coordinates | Bu, Weiming; Ye, Ling; Zhu, Hailiang; Yang, Guangdi; Fan, Yuguo; Tang, Wenxia
μ-1,3-Imidazolyl-κN:κN'-bis[(diethylenetriaminato-κ^3^N)copper] triperchlorate hydrate
Acta Crystallographica, Section C: Crystal Structure Communications
55(5)
(1999)
IUC9900045 | 182,018 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,108 | 9.8136 | 0.0009 | 7.6018 | 0.0006 | 13.4201 | 0.0009 | 90 | null | 90 | null | 90 | null | 1,001.15 | 0.14 | 295 | null | null | null | null | null | null | null | 3 | P n m a | -P 2ac 2n | 62 | - Cl4 Cs2 Hg - | - Cl4 Cs2 Hg - | - Cl16 Cs8 Hg4 - | 4 | 0.5 | SE0229 | Bagautdinov, B.; Luedecke, J.; Schneider, M.; van Smaalen, S. | Disorder in the Crystal Structure of Cs~2~HgCl~4~ Studied by the Maximum Entropy Method | Acta Crystallographica Section B | 1,998 | 54 | 5 | 626 | 634 | 10.1107/S010876819800233X | 0.71073 | MoKα | null | 0.032 | null | null | 0.031 | null | null | null | null | 1.93 | 1.93 | null | null | null | has coordinates | Bagautdinov, B.; Luedecke, J.; Schneider, M.; van Smaalen, S.
Disorder in the Crystal Structure of Cs~2~HgCl~4~ Studied by the Maximum Entropy Method
Acta Crystallographica Section B
54(5)
(1998)
626-634 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,109 | 14.7711 | 0.0005 | 14.7711 | 0.0005 | 3.82206 | 0.00006 | 90 | null | 90 | null | 120 | null | 722.19 | 0.04 | 293 | null | null | null | null | null | null | null | 3 | R 3 m :H | R 3 -2" | 160 | - C10 H15 Li - | - C7.998 Li - | - C23.994 Li3 - | 3 | 0.166667 | SE0236 | Robert E. Dinnebier | Disorder determined by high-resolution powder diffraction: structure of pentamethylcyclopentadienyllithium | Acta Crystallographica Section B | 1,999 | 55 | 1 | 35 | 44 | 10.1107/S0108768198007009 | 0.84979 | synchrotron | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Robert E. Dinnebier
Disorder determined by high-resolution powder diffraction: structure of pentamethylcyclopentadienyllithium
Acta Crystallographica Section B
55(1)
(1999)
35-44 | 208,817 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,110 | 5.8907 | 0.0007 | 26.071 | 0.002 | 11.8868 | 0.0011 | 90 | null | 106.118 | 0.009 | 90 | null | 1,753.8 | 0.3 | 258 | 1 | 258 | 1 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | 1:1 adduct of hexamethylenetetramine and azelaic acid | - C15 H28 N4 O4 - | - C15 H28 N4 O4 - | - C60 H112 N16 O16 - | 4 | 1 | SE0259 | Marc Hostettler; Henrik Birkedal; Manual Gardon; Gervais Chapuis; Dieter Schwarzenbach; Michel Bonin | Phase-transition-induced twinning in the 1:1 adduct of hexamethylenetetramine and azelaic acid | Acta Crystallographica Section B | 1,999 | 55 | 3 | 448 | 458 | 10.1107/S0108768198017200 | 0.71073 | MoKα | 0.0469 | 0.0469 | null | null | null | 0.1364 | null | null | null | null | null | 1.15 | null | null | has coordinates | Marc Hostettler; Henrik Birkedal; Manual Gardon; Gervais Chapuis; Dieter Schwarzenbach; Michel Bonin
Phase-transition-induced twinning in the 1:1 adduct of hexamethylenetetramine and azelaic acid
Acta Crystallographica Section B
55(3)
(1999)
448-458 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,111 | 4.6511 | 0.0008 | 8.802 | 0.001 | 8.402 | 0.001 | 90 | null | 90 | null | 90 | null | 343.97 | 0.08 | 293 | null | null | null | null | null | null | null | 4 | P b n m | -P 2c 2ab | 62 | - Al2 F2 O4 Si - | - Al2 F2 O4 Si - | - Al8 F8 O16 Si4 - | 4 | 0.5 | SH0101 | Ivanov, Yu.V.; Belokoneva, E.L.; Protas, J.; Hansen, N.K.; Tsirelson, V.G. | Multipole Analysis of the Electron Density in Topaz Using X-ray Diffraction Data | Acta Crystallographica Section B | 1,998 | 54 | 6 | 774 | 781 | 10.1107/S0108768198004108 | 0.71069 | MoKα | null | 0.0091 | null | null | 0.011 | null | null | null | null | 1.13 | 1.13 | null | null | null | has coordinates | Ivanov, Yu.V.; Belokoneva, E.L.; Protas, J.; Hansen, N.K.; Tsirelson, V.G.
Multipole Analysis of the Electron Density in Topaz Using X-ray Diffraction Data
Acta Crystallographica Section B
54(6)
(1998)
774-781 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,322,420 | 11.108 | 0.002 | 8.886 | 0.002 | 15.397 | 0.003 | 90 | null | 90 | null | 90 | null | 1,519.8 | 0.5 | 115 | 2 | 293 | 2 | null | null | null | null | 4 | P c c a | -P 2a 2ac | 54 | - C7 H2 Cu6 N8 - | - C3.5 H Cu3 N4 - | - C28 H8 Cu24 N32 - | 8 | 1 | Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta | Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused "Slinky", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family | Inorganic Chemistry | 1,999 | 38 | 5484 | 5494 | 10.1021/ic990385q | 0.71073 | MoKα | 0.0304 | 0.024 | null | null | 0.0608 | 0.0627 | null | null | null | null | null | 1.026 | null | null | has coordinates | Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta
Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused "Slinky", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family
Inorganic Chemistry
38
(1999)
5484-5494 | 179,327 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,003,112 | 5.589 | 0.0005 | 5.589 | 0.0005 | 4.6947 | 0.0004 | 90 | null | 90 | null | 90 | null | 146.65 | 0.02 | 148 | null | null | null | null | null | null | null | 4 | P -4 21 m | P -4 2ab | null | - C H4 N2 O - | - C H4 N2 O - | - C2 H8 N4 O2 - | 2 | 0.25 | SH0102 | Zavodnik, Valery; Stash, Adam; Tsirelson, Vladimir; de Vries, Roelof; Feil, Dirk | Electron density study of urea using TDS-corrected X-ray diffraction data: quantitative comparison of experimental and theoretical results | Acta Crystallographica Section B | 1,999 | 55 | 1 | 45 | 54 | 10.1107/S0108768198005746 | 0.7069 | MoKα | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Zavodnik, Valery; Stash, Adam; Tsirelson, Vladimir; de Vries, Roelof; Feil, Dirk
Electron density study of urea using TDS-corrected X-ray diffraction data: quantitative comparison of experimental and theoretical results
Acta Crystallographica Section B
55(1)
(1999)
45-54 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,113 | 9.9645 | 0.0004 | 7.1801 | 0.0003 | 7.8897 | 0.0003 | 90 | null | 96.243 | 0.003 | 90 | null | 561.13 | 0.04 | null | null | 293 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - C H8 N O4 P - | - C H8 N O4 P - | - C4 H32 N4 O16 P4 - | 4 | 1 | SH0104 | Antonia Neels; Helen Stoeckli-Evans; Jochen Neels; Abraham Clearfield; Damodara Poojary | <i>Ab Initio</i> Structure Determination of Ammonium Hydrogen Alkyl Phosphates from X-ray Powder Diffraction Data | Acta Crystallographica Section B | 1,998 | 54 | 4 | 478 | 484 | 10.1107/S0108768197015589 | 1.5406 | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Antonia Neels; Helen Stoeckli-Evans; Jochen Neels; Abraham Clearfield; Damodara Poojary
<i>Ab Initio</i> Structure Determination of Ammonium Hydrogen Alkyl Phosphates from X-ray Powder Diffraction Data
Acta Crystallographica Section B
54(4)
(1998)
478-484 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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2,003,114 | 12.6453 | 0.0004 | 7.1502 | 0.0002 | 7.9738 | 0.0002 | 90 | null | 108.875 | 0.002 | 90 | null | 682.19 | 0.03 | null | null | 293 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - C2 H10 N O4 P - | - C2 H10 N O4 P - | - C8 H40 N4 O16 P4 - | 4 | 1 | SH0104 | Antonia Neels; Helen Stoeckli-Evans; Jochen Neels; Abraham Clearfield; Damodara Poojary | <i>Ab Initio</i> Structure Determination of Ammonium Hydrogen Alkyl Phosphates from X-ray Powder Diffraction Data | Acta Crystallographica Section B | 1,998 | 54 | 4 | 478 | 484 | 10.1107/S0108768197015589 | 1.5406 | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Antonia Neels; Helen Stoeckli-Evans; Jochen Neels; Abraham Clearfield; Damodara Poojary
<i>Ab Initio</i> Structure Determination of Ammonium Hydrogen Alkyl Phosphates from X-ray Powder Diffraction Data
Acta Crystallographica Section B
54(4)
(1998)
478-484 | 301,791 | 2025-08-18 | 23:15:22 | #------------------------------------------------------------------------------
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