Crystallography Open Database
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Searching journal of publication like 'JOURNAL OF THE AMERICAN CHEMICAL SOCIETY'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 4100017 | CIF | C18 H24 O3 | P -1 | 9.932; 18.201; 8.7778 99.675; 90.281; 99.129 | 1543.7 | Journal of the American Chemical Society, 2005 |
| 4100018 | CIF | C23 H31 N O3 | P 21 21 21 | 6.0537; 17.481; 19.469 90; 90; 90 | 2060.3 | Xia, Wujiong; Yang, Chao; Patrick, Brian O.; Scheffer, John R.; Scott, Carl Journal of the American Chemical Society, 2005 |
| 4100019 | CIF | C22 H17 Fe N3 O | P 1 21/c 1 | 10.437; 18.322; 11.697 90; 121.391; 90 | 1909.38 | Liao, Yi; Kaminsky, Werner Systematic study of the structure-property relationship of a series of ferrocenyl nonlinear optical chromophores Journal of the American Chemical Society, 2005 |
| 4100020 | CIF | C30 H25 Cl4 Fe N3 O S | P -1 | 10.003; 11.271; 14.935 70.166; 89.948; 76.818 | 1536.82 | Liao, Yi; Robinson, Bruce; Kaminsky, Werner; Benedict, Jason Systematic study of the structure-property relationship of a series of ferrocenyl nonlinear optical chromophores Journal of the American Chemical Society, 2005 |
| 4100021 | CIF | C27.2 H16.39 Cl0.39 F3 Fe N3 O | P -1 | 13.47; 14.161; 14.661 73.342; 64.348; 68.832 | 2322.4 | Liao, Yi; Robinson, Bruce; Kaminsky, Werner Systematic study of the structure-property relationship of a series of ferrocenyl nonlinear optical chromophores Journal of the American Chemical Society, 2005 |
| 4100022 | CIF | C34 H22 Cl2 F3 Fe N3 O S | C 1 2/c 1 | 28.041; 15.294; 19.322 90; 131.96; 90 | 6161.9 | Liao, Yi; Robinson, Bruce; Kaminsky, Werner; Benedict, Jason Systematic study of the structure-property relationship of a series of ferrocenyl nonlinear optical chromophores Journal of the American Chemical Society, 2005 |
| 4100023 | CIF | C23 H33 B2 Cl2 F3 N4 O3 S | P 1 21 1 | 8.257; 8.37; 21.383 90; 100.054; 90 | 1455.1 | Journal of the American Chemical Society, 2005 |
| 4100024 | CIF | C40 H52 B2 N4 O5 W | P 1 21/n 1 | 12.506; 20.434; 16.308 90; 106.907; 90 | 3987.3 | Journal of the American Chemical Society, 2005 |
| 4100025 | CIF | C29 H46 B2 N4 | F d d 2 | 17.75; 41.914; 7.9239 90; 90; 90 | 5895.2 | Journal of the American Chemical Society, 2005 |
| 4100026 | CIF | C29 H47 N O4 | C 1 2 1 | 15.856; 9.4706; 20.2922 90; 112.441; 90 | 2816.4 | Palomo, Claudio; Oiarbide, Mikel; Kardak, Bharat G.; García, Jesús; Linden, Anthony α'-Hydoxy Enones as New Templates for Cu(II)-Catalyzed Enantioselective Pyrrole and Indole Friedel-Crafts Alkylations Journal of the American Chemical Society, 2005 |
| 4100027 | CIF | C50 H78 Sm2 | P 1 21/c 1 | 11.3456; 21.6734; 19.3685 90; 101.026; 90 | 4674.8 | Journal of the American Chemical Society, 2005 |
| 4100028 | CIF | C35 H36 Co O2 P S Si | P 1 21/n 1 | 9.978; 17.896; 18.049 90; 93.665; 90 | 3216.3 | Journal of the American Chemical Society, 2005 |
| 4100029 | CIF | C24 H24 Co2 S2 | C 1 2 1 | 17.381; 5.8345; 11.3055 90; 112.239; 90 | 1061.2 | Journal of the American Chemical Society, 2005 |
| 4100030 | CIF | C35 H36 Co O P S Si | P -1 | 9.0966; 10.7124; 17.936 74.952; 89.251; 75.278 | 1629.8 | Journal of the American Chemical Society, 2005 |
| 4100031 | CIF | C66 H86 N6 O10 S2 | C 1 c 1 | 20.4171; 16.487; 18.8953 90; 91.321; 90 | 6358.8 | Journal of the American Chemical Society, 2005 |
| 4100032 | CIF | C32 H39 Cl2 N3 O4 | P 1 21/n 1 | 9.537; 26.9572; 12.3589 90; 109.968; 90 | 2986.35 | Journal of the American Chemical Society, 2005 |
| 4100033 | CIF | C17 H10 Cl F4 N3 | P 1 21/n 1 | 13.958; 7.5579; 15.236 90; 114.6; 90 | 1461.4 | Journal of the American Chemical Society, 2005 |
| 4100034 | CIF | C17 H10 Cl F4 N3 | P -1 | 6.8075; 9.0631; 13.4888 70.863; 78.833; 75.604 | 755.8 | Journal of the American Chemical Society, 2005 |
| 4100035 | CIF | C19 H13 F4 N | P n m a | 7.5926; 12.408; 15.483 90; 90; 90 | 1458.7 | Journal of the American Chemical Society, 2005 |
| 4100036 | CIF | C18 H12 F4 N2 | P -1 | 7.711; 11.939; 15.819 91.697; 90.421; 98.628 | 1439.1 | Journal of the American Chemical Society, 2005 |
| 4100037 | CIF | C17 H13 F3 O5 S | P -1 | 8.546; 9.43; 11.165 73.016; 82.571; 81.014 | 846.6 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100038 | CIF | C20 H23 O6 P | P 21 21 21 | 10.033; 11.953; 16.295 90; 90; 90 | 1954.2 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100039 | CIF | C15 H12 Br2 O | P n m a | 7.334; 19.543; 9.082 90; 90; 90 | 1301.7 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100040 | CIF | C29 H31 F6 K O8 | P b c a | 13.91; 19.228; 23.515 90; 90; 90 | 6289.4 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100041 | CIF | C24 H23 B N2 O2 | P 1 21/n 1 | 16.378; 7.467; 16.966 90; 105.007; 90 | 2004.1 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100042 | CIF | C20 H25 B N2 | P 1 21/n 1 | 10.726; 12.542; 13.08 90; 91.437; 90 | 1759.04 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100043 | CIF | C18 H19 B Cl2 N2 | P 1 21/n 1 | 12.777; 12.551; 10.72 90; 90.546; 90 | 1719 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100044 | CIF | C22 H17 B O4 | P 1 21/a 1 | 11.962; 7.228; 20.281 90; 100.49; 90 | 1724.21 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100045 | CIF | C23 H19 B O5 | P c a 21 | 9.867; 14.292; 14.081 90; 90; 90 | 1985.7 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100046 | CIF | C22 H17 B O2 S2 | P n m a | 8.493; 14.313; 15.954 90; 90; 90 | 1939.4 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100047 | CIF | C18 H19 B O4 | P 1 21/n 1 | 18.729; 13.177; 21.8 90; 111.059; 90 | 5020.7 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100048 | CIF | C16 H13 B F2 O2 | P n a 21 | 12.187; 6.823; 32.524 90; 90; 90 | 2704.4 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100049 | CIF | C16 H13 B Cl2 O2 | P m n 21 | 6.95; 9.08; 11.323 90; 90; 90 | 714.55 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100050 | CIF | C16 H14 O2 | P 1 21/c 1 | 6.642; 12.169; 15.118 90; 91.913; 90 | 1221.3 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100051 | CIF | C14 H7 Br3 | P 1 21/c 1 | 10.153; 7.248; 17.358 90; 106.064; 90 | 1227.48 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100052 | CIF | C17 H13 N O2 | I 41/a :2 | 25.057; 25.057; 8.371 90; 90; 90 | 5255.8 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100053 | CIF | C19 H20 B2 F7 O4 | P 1 21/c 1 | 10.981; 14.701; 13.43 90; 107.81; 90 | 2064.2 | Yamashita, Makoto; Yamamoto, Yohsuke; Akiba, Kin-ya; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Nagase, Shigeru Syntheses and Structures of Hypervalent Pentacoordinate Carbon and Boron Compounds Bearing an Anthracene Skeleton ‒ Elucidation of Hypervalent Interaction Based on X-ray Analysis and DFT Calculation Journal of the American Chemical Society, 2005, 127, 4354-4371 |
| 4100054 | CIF | C18 H42 Ni Si4 | C 1 2/c 1 | 16.537; 12.438; 12.723 90; 90.155; 90 | 2617 | Journal of the American Chemical Society, 2005 |
| 4100055 | CIF | C18 H42 Ni Si4 | C 1 2/c 1 | 10.969; 19.144; 12.491 90; 103.151; 90 | 2554.1 | Journal of the American Chemical Society, 2005 |
| 4100056 | CIF | C18 H42 Ni Si4 | P 1 21/c 1 | 12.364; 10.2697; 21.0044 90; 99.389; 90 | 2631.3 | Journal of the American Chemical Society, 2005 |
| 4100057 | CIF | C18 H42 Br2 Ni2 Si4 | C 1 2/c 1 | 14.819; 23.37; 11.251 90; 130.197; 90 | 2976 | Journal of the American Chemical Society, 2005 |
| 4100058 | CIF | C18 H42 I2 Ni2 Si4 | C 2 2 21 | 16.448; 19.038; 19.669 90; 90; 90 | 6159 | Journal of the American Chemical Society, 2005 |
| 4100059 | CIF | C24 H36 Cs Ni O9 S10 | P -1 | 10.7634; 12.8715; 13.466 84.967; 87.007; 80.751 | 1832.9 | Journal of the American Chemical Society, 2005 |
| 4100060 | CIF | C24 H36 Cs Ni O9 S10 | P -1 | 10.774; 12.901; 13.481 84.828; 86.932; 80.859 | 1841 | Journal of the American Chemical Society, 2005 |
| 4100061 | CIF | C24 H36 Cs Ni O9 S10 | P -1 | 10.7902; 12.9099; 13.4876 84.719; 86.876; 80.733 | 1844.9 | Journal of the American Chemical Society, 2005 |
| 4100062 | CIF | C24 H36 Cs Ni O9 S10 | P -1 | 10.8075; 12.9228; 13.4987 84.676; 86.905; 80.678 | 1850.9 | Journal of the American Chemical Society, 2005 |
| 4100063 | CIF | C24 H36 Cs N3 Ni O9 S10 | P -1 | 10.81; 12.929; 13.526 84.43; 86.974; 80.52 | 1854.5 | Journal of the American Chemical Society, 2005 |
| 4100064 | CIF | C24 H36 Cs Ni O9 S10 | P -1 | 10.821; 12.935; 13.566 84.37; 87.094; 80.51 | 1862.6 | Journal of the American Chemical Society, 2005 |
| 4100065 | CIF | C24 H36 Cs Ni O9 S10 | P -1 | 10.804; 12.906; 13.573 84.226; 87.3; 80.552 | 1856.5 | Journal of the American Chemical Society, 2005 |
| 4100066 | CIF | C24 H36 Cs Ni O9 S10 | P -1 | 10.798; 12.928; 13.642 84.02; 87.631; 80.447 | 1867.2 | Journal of the American Chemical Society, 2005 |
| 4100067 | CIF | C24 H36 Cs Ni O9 S10 | P -1 | 10.802; 12.956; 13.709 83.92; 87.898; 80.611 | 1881.8 | Journal of the American Chemical Society, 2005 |
| 4100068 | CIF | C24 H36 Cs Ni O9 S10 | P -1 | 10.774; 12.977; 13.751 84.03; 88.06; 80.62 | 1886.3 | Journal of the American Chemical Society, 2005 |
| 4100069 | CIF | C24 H36 Cs Ni O9 S10 | P -1 | 10.782; 13.05; 13.818 84.03; 87.93; 80.58 | 1907.3 | Journal of the American Chemical Society, 2005 |
| 4100070 | CIF | C24 H36 Cs Ni O9 S10 | P -1 | 10.787; 13.061; 13.808 83.94; 88.09; 80.613 | 1908.4 | Journal of the American Chemical Society, 2005 |
| 4100071 | CIF | C24 H40 Fe N2 S4 | P 1 21/n 1 | 7.3798; 13.422; 13.582 90; 100.51; 90 | 1322.7 | Journal of the American Chemical Society, 2005 |
| 4100072 | CIF | C47 H58 As Co S4 | P 1 21/c 1 | 11.4045; 13.0763; 31.143 90; 93.2; 90 | 4637.1 | Journal of the American Chemical Society, 2005 |
| 4100073 | CIF | C35 H36 Co O P S Si | P 1 21/n 1 | 9.9942; 9.5495; 33.038 90; 95.405; 90 | 3139.1 | Journal of the American Chemical Society, 2005 |
| 4100074 | CIF | C1.65 H10 N0.82 O5.24 Se U0.59 | I 2 m m | 10.8864; 29.532; 47.439 90; 90; 90 | 15251.5 | Journal of the American Chemical Society, 2005 |
| 4100075 | CIF | C12 H14 Br N O2 | P 1 21 1 | 7.7697; 5.6329; 13.56 90; 100.345; 90 | 583.8 | Journal of the American Chemical Society, 2005 |
| 4100076 | CIF | C61 H58 B Cr F24 N2 O Si | P 1 21/c 1 | 13.628; 25.586; 18.371 90; 90.579; 90 | 6405.4 | Journal of the American Chemical Society, 2005 |
| 4100077 | CIF | C22 H8 Cr2 Fe N2 O10 | P 1 21/n 1 | 6.6386; 18.4782; 19.224 90; 97.679; 90 | 2337 | Siemeling, Ulrich; Rother, Dag; Fink, Heinrich Journal of the American Chemical Society, 2005 |
| 4100078 | CIF | C12 H8 Au2 Cl2 Fe N2 | P 1 21/n 1 | 6.48; 9.274; 23.403 90; 94.18; 90 | 1402.7 | Siemeling, Ulrich; Rother, Dag; Bruhn, Clemens Journal of the American Chemical Society, 2005 |
| 4100079 | CIF | C4 H3 F N2 O2 | P -1 | 8.6329; 9.156; 12.5796 99.119; 100.021; 90.017 | 966.4 | Hulme, Ashley T.; Tocher, Derek A. Journal of the American Chemical Society, 2005 |
| 4100080 | CIF | C4 H3 F N2 O2 | P 1 21/c 1 | 5.154; 15.001; 6.654 90; 110.336; 90 | 482.4 | Hulme, Ashley T.; Tocher, Derek A. Journal of the American Chemical Society, 2005 |
| 4100081 | CIF | C4 H3 F N2 O2 | P 1 21/c 1 | 5.0433; 14.935; 6.6049 90; 108.884; 90 | 470.72 | Hulme, Ashley T.; Tocher, Derek A. Journal of the American Chemical Society, 2005 |
| 4100082 | CIF | C32 H62 Li N2 O2 Pr S2 Si4 | P -1 | 8.693; 11.595; 22.719 103.694; 95.94; 90.653 | 2211.4 | Journal of the American Chemical Society, 2005 |
| 4100083 | CIF | C78 H118 Cl Li N4 Nd4 S8 Si8 | C 1 2/c 1 | 18.305; 24.227; 24.326 90; 98.52; 90 | 10669.3 | Journal of the American Chemical Society, 2005 |
| 4100084 | CIF | C52 H100 Cl5 Li N4 O S4 Si8 Sm4 | P -1 | 13.7062; 17.0964; 19.882 75.817; 83.698; 77.496 | 4401.8 | Journal of the American Chemical Society, 2005 |
| 4100085 | CIF | C48 H120 Cl4 Li2 N4 O6 Pr2 Si8 | P -1 | 12.201; 13.088; 15.082 101.45; 106.858; 114.631 | 1948.8 | Journal of the American Chemical Society, 2005 |
| 4100086 | CIF | C40 H104 Cl4 Li2 N4 O4 Si8 Sm2 | P 1 21/n 1 | 13.1658; 19.81; 13.5111 90; 94.19; 90 | 3514.5 | Journal of the American Chemical Society, 2005 |
| 4100087 | CIF | C64 H124 Cl Co N13 O31 P | P 21 21 21 | 29.486; 29.833; 37.579 90; 90; 90 | 33057 | Journal of the American Chemical Society, 2005 |
| 4100088 | CIF | C64 H127 Co N13 O32 P | P 21 21 21 | 15.806; 22.471; 25.338 90; 90; 90 | 8999 | Properties and Reactivity of Chlorovinylcobalamin and Vinylcobalamin and Their Implications for Vitamin B~12~-Catalyzed Reductive Dechlorination of Chlorinated Alkenes Journal of the American Chemical Society, 2005 |
| 4100089 | CIF | C9 H18 O6 | P 1 21/c 1 | 13.788; 10.664; 7.894 90; 91.77; 90 | 1160.1 | Journal of the American Chemical Society, 2005 |
| 4100090 | CIF | C25 H36 N14 O13 Pt S | P 1 21 1 | 10.838; 31.965; 11.817 90; 112.987; 90 | 3769 | Journal of the American Chemical Society, 2005 |
| 4100091 | CIF | C25 H44 N14 O14 Pt S | P -1 | 10.3067; 13.3068; 15.1285 78.244; 82.033; 70.672 | 1911.2 | Barry, Colin G.; Day, Cynthia S.; Bierbach, Ulrich Duplex Promoted Platination of Adenine-N3 in the Minor Groove of DNA. Challenging a Longstanding Bioinorganic Paradigm Journal of the American Chemical Society, 2005 |
| 4100092 | CIF | C40 H52 N4 Ni | P -1 | 16.812; 20.01; 21.378 94.557; 97.004; 109.382 | 6677.7 | Song, Yujiang; Haddad, Raid E.; Jia, Song-Ling; Hok, Saphon; Olmstead, Marilyn M.; Nurco, Daniel J.; Schore, Neal E.; Zhang, Jun; Ma, Jian-Guo; Smith, Kevin M.; Gazeau, Stéphanie; Pécaut, Jacques; Marchon, Jean-Claude; Medforth, Craig J.; Shelnutt, John A. Energetics and Structural Consequences of Axial Ligand Coordination in Nonplanar Nickel Porphyrins Journal of the American Chemical Society, 2005, 127, 1179-1192 |
| 4100093 | CIF | C40 H52 N4 Ni | P -1 | 8.4141; 13.293; 15.281 82.965; 81.68; 88.189 | 1678.3 | Song, Yujiang; Haddad, Raid E.; Jia, Song-Ling; Hok, Saphon; Olmstead, Marilyn M.; Nurco, Daniel J.; Schore, Neal E.; Zhang, Jun; Ma, Jian-Guo; Smith, Kevin M.; Gazeau, Stéphanie; Pécaut, Jacques; Marchon, Jean-Claude; Medforth, Craig J.; Shelnutt, John A. Energetics and Structural Consequences of Axial Ligand Coordination in Nonplanar Nickel Porphyrins Journal of the American Chemical Society, 2005, 127, 1179-1192 |
| 4100094 | CIF | C14 H16 O3 | P 1 21/n 1 | 14.931; 9.77; 14.931 90; 90.94; 90 | 2177.8 | Journal of the American Chemical Society, 2005 |
| 4100095 | CIF | C14 H16 O3 | P 21 21 21 | 7.0339; 9.7592; 16.0454 90; 90; 90 | 1101.4 | Journal of the American Chemical Society, 2005 |
| 4100096 | CIF | C14 H16 O2 | P 1 21/c 1 | 8.1004; 10.1648; 13.3393 90; 98.399; 90 | 1086.6 | Journal of the American Chemical Society, 2005 |
| 4100097 | CIF | C14 H20 O3 | P 1 21/c 1 | 12.7483; 8.5538; 11.2196 90; 96.766; 90 | 1214.9 | Journal of the American Chemical Society, 2005 |
| 4100098 | CIF | C21 H22 N2 O9 | P -1 | 6.5607; 12.2817; 25.088 88.583; 87.417; 82.263 | 2000.7 | Journal of the American Chemical Society, 2005 |
| 4100099 | CIF | C15 H19 N O3 S | P 21 21 21 | 8.3728; 10.2615; 18.297 90; 90; 90 | 1572 | Journal of the American Chemical Society, 2005 |
| 4100100 | CIF | C17 H21 N O3 | C 1 c 1 | 14.856; 9.209; 12.593 90; 110.039; 90 | 1618.5 | Journal of the American Chemical Society, 2005 |
| 4100101 | CIF | C15 H26 Cl N O | P 1 21 1 | 7.8777; 7.7795; 13.672 90; 102.036; 90 | 819.5 | Journal of the American Chemical Society, 2005 |
| 4100102 | CIF | C58 H70 Cl8 Fe2 P2 Pd2 | P 1 21 1 | 13.5209; 15.1921; 15.0232 90; 108.483; 90 | 2926.7 | Journal of the American Chemical Society, 2005 |
| 4100103 | CIF | C184 H150 Cl10 N44 O46 | P 1 21/c 1 | 27.8066; 14.6508; 44.3633 90; 91.67; 90 | 18065.4 | Journal of the American Chemical Society, 2005 |
| 4100104 | CIF | C17 H19 S | P 1 21/c 1 | 31.075; 7.395; 5.866 90; 93.97; 90 | 1344.8 | Journal of the American Chemical Society, 2005 |
| 4100105 | CIF | C22 H14 S2 | P c c n | 34.243; 7.5118; 6.0908 90; 90; 90 | 1566.7 | Journal of the American Chemical Society, 2005 |
| 4100106 | CIF | C17 H17 Cl N2 O2 | P 21 21 21 | 15.141; 16.7; 6.269 90; 90; 90 | 1585.2 | Hideko Koshima Journal of the American Chemical Society, 2005 |
| 4100107 | CIF | C70 H90 N4 | P -1 | 11.2352; 11.5362; 13.4393 65.127; 71.281; 79.797 | 1494.92 | Jeremiah A Marsden; MIke M. Haley; Fusen Han Journal of the American Chemical Society, 2005 |
| 4100108 | CIF | C54 H54 N4 O4 | P -1 | 13.001; 13.594; 14.847 112.913; 90.637; 103.57 | 2334.1 | Jeremiah A Marsden; MIke M. Haley; Fusen Han Journal of the American Chemical Society, 2005 |
| 4100109 | CIF | C33 H36 N3 Rh | P 1 21/c 1 | 11.4645; 17.7575; 13.7191 90; 92.69; 90 | 2789.9 | Custer, Paul D.; Garrison, Jered C.; Tessier, Claire A.; Youngs, Wiley J. Journal of the American Chemical Society, 2005 |
| 4100110 | CIF | C68 H75 Ag2 B2 F8 N7 Rh2 | P -1 | 13.552; 16.2471; 16.6517 77.66; 68.107; 71.664 | 3209.8 | Custer, Paul D.; Garrison, Jered C.; Tessier, Claire A.; Youngs, Wiley J. Journal of the American Chemical Society, 2005 |
| 4100111 | CIF | C38 H39 Ag3 F9 N4 O9 Rh S3 | P 1 21/c 1 | 21.9776; 10.6829; 21.8444 90; 113.597; 90 | 4699.9 | Custer, Paul D.; Garrison, Jered C.; Tessier, Claire A.; Youngs, Wiley J. Journal of the American Chemical Society, 2005 |
| 4100112 | CIF | C22 H35 N O3 | P 21 21 21 | 6.6718; 12.839; 26.802 90; 90; 90 | 2295.8 | Journal of the American Chemical Society, 2005 |
| 4100113 | CIF | C80 H104 F6 N10 O15 | P 21 21 21 | 9.639; 23.908; 38.807 90; 90; 90 | 8943.3 | Journal of the American Chemical Society, 2005 |
| 4100114 | CIF | C24 H22 As F6 N2 O2 S12 | P -1 | 6.4102; 7.5058; 17.987 83.523; 86.529; 85.458 | 856.03 | Journal of the American Chemical Society, 2005 |
| 4100115 | CIF | C24 H22 As F6 N2 O2 S12 | P 1 | 6.3918; 7.502; 17.941 83.197; 86.638; 85.548 | 850.6 | Journal of the American Chemical Society, 2005 |
| 4100116 | CIF | C24 H22 As F6 N2 O2 S12 | P 1 | 6.3962; 7.4884; 17.94 83.13; 86.579; 85.52 | 849.41 | Journal of the American Chemical Society, 2005 |
| 4100117 | CIF | C38 H37 F3 O3 P2 Ru S | P 1 21 1 | 9.4151; 17.713; 10.369 90; 92.19; 90 | 1727.9 | Journal of the American Chemical Society, 2005 |
| 4100118 | CIF | C42 H46 F3 N O4 P2 Ru S | P -1 | 10.976; 11.496; 16.223 96.64; 102.89; 97.58 | 1955.7 | Journal of the American Chemical Society, 2005 |
| 4100119 | CIF | C54 H120 Co K O9 Si8 | P -1 | 14.263; 15.89; 16.205 93.177; 94.693; 95.974 | 3632.9 | Journal of the American Chemical Society, 2005 |
| 4100120 | CIF | C64 H136 Co K N2 O10 Si8 | P -1 | 12.974; 16.173; 20.167 91.686; 103.374; 100.456 | 4037.2 | Journal of the American Chemical Society, 2005 |
| 4100121 | CIF | C51 H82 B F4 N2 O1.5 P2 Ru | P -1 | 13.6055; 18.4233; 21.069 75.016; 83.936; 89.959 | 5071.1 | Journal of the American Chemical Society, 2005 |
| 4100122 | CIF | C21 H13 O5 P W | P n m a | 16.6552; 10.3703; 11.7614 90; 90; 90 | 2031.42 | Borst, Mark L. G.; Bulo, R. E.; Winkel, Christiaan W.; Gibney, Daniele J.; Ehlers, Andreas W.; Schakel, Marius; Lutz, Martin; Spek, Anthony L.; Lammertsma, Koop Phosphepines: Convenient Access to Phosphinidene Complexes Journal of the American Chemical Society, 2005 |
| 4100123 | CIF | C23 H18 Mn O2 P | P 1 21/m 1 | 8.8819; 10.268; 10.9361 90; 108.66; 90 | 944.939 | Journal of the American Chemical Society, 2005 |
| 4100124 | CIF | ? | P 1 21/n 1 | 14.459; 11.522; 19.651 90; 109.542; 90 | 3085.2 | Akiba, Kin-ya; Moriyama, Yuji; Mizozoe, Mitsuhiro; Inohara, Hideki; Nishii, Takako; Yamamoto, Yohsuke; Minoura, Mao; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Ishimura, Kazuya; Nagase, Shigeru Synthesis and Characterization of Stable Hypervalent Carbon Compounds (10-C-5) Bearing a 2,6-Bis(p-substituted phenyloxymethyl)benzene Ligand Journal of the American Chemical Society, 2005, 127, 5893-5901 |
| 4100125 | CIF | ? | P b c n | 11.89; 14.086; 17.87 90; 90; 90 | 2992.9 | Akiba, Kin-ya; Moriyama, Yuji; Mizozoe, Mitsuhiro; Inohara, Hideki; Nishii, Takako; Yamamoto, Yohsuke; Minoura, Mao; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Ishimura, Kazuya; Nagase, Shigeru Synthesis and Characterization of Stable Hypervalent Carbon Compounds (10-C-5) Bearing a 2,6-Bis(p-substituted phenyloxymethyl)benzene Ligand Journal of the American Chemical Society, 2005, 127, 5893-5901 |
| 4100126 | CIF | ? | P -1 | 11.514; 15.328; 18.531 78.168; 78.935; 79.867 | 3109.6 | Akiba, Kin-ya; Moriyama, Yuji; Mizozoe, Mitsuhiro; Inohara, Hideki; Nishii, Takako; Yamamoto, Yohsuke; Minoura, Mao; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Ishimura, Kazuya; Nagase, Shigeru Synthesis and Characterization of Stable Hypervalent Carbon Compounds (10-C-5) Bearing a 2,6-Bis(p-substituted phenyloxymethyl)benzene Ligand Journal of the American Chemical Society, 2005, 127, 5893-5901 |
| 4100127 | CIF | ? | P -1 | 11.335; 11.064; 13.066 101.128; 102.83; 102.734 | 1507.1 | Akiba, Kin-ya; Moriyama, Yuji; Mizozoe, Mitsuhiro; Inohara, Hideki; Nishii, Takako; Yamamoto, Yohsuke; Minoura, Mao; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Ishimura, Kazuya; Nagase, Shigeru Synthesis and Characterization of Stable Hypervalent Carbon Compounds (10-C-5) Bearing a 2,6-Bis(p-substituted phenyloxymethyl)benzene Ligand Journal of the American Chemical Society, 2005, 127, 5893-5901 |
| 4100128 | CIF | C35 H31 Cl O8 | C 1 2/c 1 | 15.062; 20.078; 11.413 90; 114.277; 90 | 3146.2 | Akiba, Kin-ya; Moriyama, Yuji; Mizozoe, Mitsuhiro; Inohara, Hideki; Nishii, Takako; Yamamoto, Yohsuke; Minoura, Mao; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Ishimura, Kazuya; Nagase, Shigeru Synthesis and Characterization of Stable Hypervalent Carbon Compounds (10-C-5) Bearing a 2,6-Bis(p-substituted phenyloxymethyl)benzene Ligand Journal of the American Chemical Society, 2005, 127, 5893-5901 |
| 4100129 | CIF | C29 F8 O4 P | P b c n | 12.73; 14.609; 17.689 90; 90; 90 | 3289.7 | Akiba, Kin-ya; Moriyama, Yuji; Mizozoe, Mitsuhiro; Inohara, Hideki; Nishii, Takako; Yamamoto, Yohsuke; Minoura, Mao; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Ishimura, Kazuya; Nagase, Shigeru Synthesis and Characterization of Stable Hypervalent Carbon Compounds (10-C-5) Bearing a 2,6-Bis(p-substituted phenyloxymethyl)benzene Ligand Journal of the American Chemical Society, 2005, 127, 5893-5901 |
| 4100130 | CIF | C37 H35 F6 O6 P | P 1 21/n 1 | 13.507; 17.866; 14.609 90; 91.321; 90 | 3524.4 | Akiba, Kin-ya; Moriyama, Yuji; Mizozoe, Mitsuhiro; Inohara, Hideki; Nishii, Takako; Yamamoto, Yohsuke; Minoura, Mao; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Ishimura, Kazuya; Nagase, Shigeru Synthesis and Characterization of Stable Hypervalent Carbon Compounds (10-C-5) Bearing a 2,6-Bis(p-substituted phenyloxymethyl)benzene Ligand Journal of the American Chemical Society, 2005, 127, 5893-5901 |
| 4100131 | CIF | C35 H29 Cl3 O6 | P n a 21 | 18.461; 13.905; 12.337 90; 90; 90 | 3166.9 | Akiba, Kin-ya; Moriyama, Yuji; Mizozoe, Mitsuhiro; Inohara, Hideki; Nishii, Takako; Yamamoto, Yohsuke; Minoura, Mao; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Ishimura, Kazuya; Nagase, Shigeru Synthesis and Characterization of Stable Hypervalent Carbon Compounds (10-C-5) Bearing a 2,6-Bis(p-substituted phenyloxymethyl)benzene Ligand Journal of the American Chemical Society, 2005, 127, 5893-5901 |
| 4100132 | CIF | C100 H131 B N24 O8 S8 | P 1 2/n 1 | 12.845; 17.134; 23.896 90; 92.11; 90 | 5256 | Journal of the American Chemical Society, 2005 |
| 4100133 | CIF | C110 H124 B N20 O4 P S4 | P 1 2/n 1 | 13.045; 17.151; 24.023 90; 92.21; 90 | 5371 | Journal of the American Chemical Society, 2005 |
| 4100134 | CIF | C55 H55 B N22 O | P 1 2/n 1 | 12.601; 18.1778; 23.825 90; 97.436; 90 | 5411.4 | Journal of the American Chemical Society, 2005 |
| 4100135 | CIF | C26 H32 Cl2 N2 Pd Si2 | P -1 | 6.4971; 9.484; 12.703 81.847; 85.104; 70.768 | 731 | Journal of the American Chemical Society, 2005 |
| 4100136 | CIF | C9 H27 Br Cl3 Mo P3 | P 1 21/c 1 | 14.8055; 11.5568; 11.4021 90; 91.565; 90 | 1950.22 | Francois Stoffelbach; Sébastien Maria; Rinaldo Poli; Philippe Richard; Jean-Claude Daran Atom transfer radical polymerization catalysis with MoX3(PMe3)3 complexes (X = Cl, Br, I). On the nature and stability of the radical trapping species. Journal of the American Chemical Society, 2005 |
| 4100137 | CIF | C4.5 H13.5 Br2 Mo0.5 P1.5 | P n m a | 11.53; 14.853; 12.033 90; 90; 90 | 2060.7 | Journal of the American Chemical Society, 2005 |
| 4100138 | CIF | C9 H27 I5 Mo P3 | P 21 21 21 | 9.1302; 15.0703; 18.1518 90; 90; 90 | 2497.6 | Journal of the American Chemical Society, 2005 |
| 4100139 | CIF | C10 H29 Cl2 I3 Mo P3 | P b c 21 | 9.2861; 18.0913; 14.6712 90; 90; 90 | 2464.7 | Journal of the American Chemical Society, 2005 |
| 4100140 | CIF | C10 H8 Cl2 F2 N2 Pt | P -1 | 6.9562; 7.0192; 7.6303 64.148; 63.131; 81.167 | 298.64 | Journal of the American Chemical Society, 2005 |
| 4100141 | CIF | C10 H8 Cl4 N2 Pt | P -1 | 5.5441; 7.1432; 8.6648 71.147; 79.634; 85.992 | 319.41 | Journal of the American Chemical Society, 2005 |
| 4100142 | CIF | C10 H8 Br2 Cl2 N2 Pt | P -1 | 3.9786; 12.337; 13.624 89.538; 83.513; 82.951 | 659.4 | Journal of the American Chemical Society, 2005 |
| 4100143 | CIF | C10 H8 Br2 Cl2 N2 Pt | P -1 | 3.9673; 8.3332; 10.1785 89.126; 82.341; 78.44 | 326.71 | Journal of the American Chemical Society, 2005 |
| 4100144 | CIF | C10 H8 Cl2 I2 N2 Pt | C 1 2/c 1 | 25.414; 4.2034; 16.357 90; 126.464; 90 | 1405.3 | Journal of the American Chemical Society, 2005 |
| 4100145 | CIF | C11 H11 Cl2 F2 N2 O Pd | P 1 21/c 1 | 3.8484; 11.719; 15.637 90; 96.578; 90 | 700.6 | Journal of the American Chemical Society, 2005 |
| 4100146 | CIF | C10 H8 Cl4 N2 Pd | P 1 21/c 1 | 3.911; 13.721; 12.029 90; 94.979; 90 | 643.1 | Journal of the American Chemical Society, 2005 |
| 4100147 | CIF | C10 H8 Br2 Cl2 N2 Pd | P 1 21/c 1 | 3.9496; 13.924; 12.034 90; 93.529; 90 | 660.6 | Journal of the American Chemical Society, 2005 |
| 4100148 | CIF | C10 H8 Cl2 I2 N2 Pd | P -1 | 4.1501; 8.4147; 10.187 90.787; 96.369; 101.532 | 346.18 | Journal of the American Chemical Society, 2005 |
| 4100149 | CIF | C74 H106 Mg2 N6 O2 | C 1 2/c 1 | 28.4817; 13.1962; 18.012 90; 90.642; 90 | 6769.4 | Journal of the American Chemical Society, 2005 |
| 4100150 | CIF | C29 H37 N3 Zn | P -1 | 12.1589; 14.8318; 16.6799 87.773; 71.894; 67.208 | 2624.4 | Journal of the American Chemical Society, 2005 |
| 4100151 | CIF | C29 H37 Mg N3 | P 1 21/c 1 | 19.9588; 15.0135; 18.2663 90; 104.037; 90 | 5310.1 | Journal of the American Chemical Society, 2005 |
| 4100152 | CIF | C31 H41 Mg N3 | P 1 21/c 1 | 10.2515; 13.4228; 20.9001 90; 98.53; 90 | 2844.12 | Journal of the American Chemical Society, 2005 |
| 4100153 | CIF | C35 H49 Mg N3 | P 1 21/c 1 | 13.247; 17.1969; 15.0233 90; 114.499; 90 | 3114.29 | Journal of the American Chemical Society, 2005 |
| 4100154 | CIF | C31 H53 B F12 Mn2 N6 O4 P2 | P 1 2/c 1 | 22.0188; 10.7399; 17.5903 90; 102.75; 90 | 4057.2 | Journal of the American Chemical Society, 2005 |
| 4100155 | CIF | C31 H58 B Cl2 Mn2 N8 O15 | P -1 | 11.311; 12.638; 16.855 101.11; 108.28; 103.46 | 2130.9 | Journal of the American Chemical Society, 2005 |
| 4100156 | CIF | C28 H57 Cl2 Mn2 N7 O13 | P n m a | 17.0472; 12.1525; 18.6112 90; 90; 90 | 3855.6 | Journal of the American Chemical Society, 2005 |
| 4100157 | CIF | C77 H98 B2 Mn2 N8 O5 | P -1 | 12.6006; 13.6769; 23.4457 73.87; 84.33; 65.24 | 3524 | Journal of the American Chemical Society, 2005 |
| 4100158 | CIF | C27 H33 In N4 O8 | R -3 c :H | 15.787; 15.787; 51.509 90; 90; 120 | 11118 | Journal of the American Chemical Society, 2005 |
| 4100159 | CIF | C121 H139 In6 N21 O60 | P -1 | 14.4111; 16.0466; 16.7388 114.216; 95.441; 91.595 | 3504.8 | Journal of the American Chemical Society, 2005 |
| 4100160 | CIF | C20 H30 O2 Si W | I 41/a :2 | 17.1741; 17.1741; 28.797 90; 90; 90 | 8493.8 | Journal of the American Chemical Society, 2005 |
| 4100161 | CIF | C31 H36 O2 Si W | P 1 21/n 1 | 9.664; 18.513; 15.988 90; 93.601; 90 | 2854.8 | Journal of the American Chemical Society, 2005 |
| 4100162 | CIF | C33 H40 O3 Si W | P 1 21/c 1 | 13.37; 10.309; 21.3 90; 90.762; 90 | 2935.6 | Journal of the American Chemical Society, 2005 |
| 4100163 | CIF | C31 H44 Cl2 Cu F6 N6 O3 P | P -1 | 8.396; 14.281; 16.138 68.477; 84.072; 86.267 | 1790 | Journal of the American Chemical Society, 2005 |
| 4100164 | CIF | C107 H110 N4 Pd | P 1 21/a 1 | 15.31; 19.927; 28.867 90; 94.6626; 90 | 8778 | Yamashita, Makoto; Goto, Kei; Kawashima, Takayuki Fixation of Both O2 and CO2 from Air by a Crystalline Palladium Complex Bearing N-Heterocyclic Carbene Ligands Journal of the American Chemical Society, 2005, 127, 7294-7295 |
| 4100165 | CIF | C102 H102 Cl2 N4 O4 Pd | C 1 2/c 1 | 32.121; 13.23; 25.781 90; 125.41; 90 | 8929 | Yamashita, Makoto; Goto, Kei; Kawashima, Takayuki Fixation of Both O2 and CO2 from Air by a Crystalline Palladium Complex Bearing N-Heterocyclic Carbene Ligands Journal of the American Chemical Society, 2005, 127, 7294-7295 |
| 4100166 | CIF | C100 H102 N4 O3 Pd | C 1 2/c 1 | 34.854; 17.0305; 30.778 90; 114.649; 90 | 16605 | Yamashita, Makoto; Goto, Kei; Kawashima, Takayuki Fixation of Both O2 and CO2 from Air by a Crystalline Palladium Complex Bearing N-Heterocyclic Carbene Ligands Journal of the American Chemical Society, 2005, 127, 7294-7295 |
| 4100167 | CIF | C31 H45 Cl N Rh Si | C 1 c 1 | 10.6977; 17.3256; 16.045 90; 95.821; 90 | 2958.5 | Yves. Canac, Salvador. Conejero; Bruno Donnadieu, Guy. Bertrand; Wolfang. W. Schoeller Persistent (Amino)(Silyl)Carbenes Journal of the American Chemical Society, 2005 |
| 4100168 | CIF | C50 H66 Cl2 N2 O4 Rh2 Si2 | P 1 21/n 1 | 16.92; 19.249; 17.148 90; 108.045; 90 | 5310 | Journal of the American Chemical Society, 2005 |
| 4100169 | CIF | C30 H31 Cl N2 O2 Ru S | P 21 21 21 | 12.57; 17.252; 25.295 90; 90; 90 | 5486 | Journal of the American Chemical Society, 2005 |
| 4100170 | CIF | C44 H62 Al N2 O2 Yb | P 1 21/n 1 | 8.812; 37.845; 12.032 90; 97.06; 90 | 3982 | Journal of the American Chemical Society, 2005 |
| 4100171 | CIF | C44 H62 Al Er N2 O2 | P 1 21/n 1 | 8.85; 37.991; 12.072 90; 97.07; 90 | 4028 | Journal of the American Chemical Society, 2005 |
| 4100172 | CIF | C44 H62 Al Dy N2 O2 | P 1 21/n 1 | 8.854; 37.975; 12.106 90; 97.17; 90 | 4039 | Journal of the American Chemical Society, 2005 |
| 4100173 | CIF | C54 H70 Al N2 O Yb | P 1 21/n 1 | 9.13; 12.498; 42.211 90; 93.36; 90 | 4808 | Journal of the American Chemical Society, 2005 |
| 4100174 | CIF | C45 H60 Al Dy N2 O | P 1 21/m 1 | 10.188; 19.669; 10.536 90; 109.43; 90 | 1991 | Journal of the American Chemical Society, 2005 |
| 4100175 | CIF | C45 H60 Al N2 O Sm | P 1 21/m 1 | 10.214; 19.606; 10.556 90; 109.37; 90 | 1994 | Journal of the American Chemical Society, 2005 |
| 4100176 | CIF | C26 H38 O2 Sn2 Yb2 | P 1 21/n 1 | 8.288; 16.18; 10.394 90; 98.53; 90 | 1378 | Journal of the American Chemical Society, 2005 |
| 4100177 | CIF | C42 H58 N2 Yb | P 1 21/n 1 | 16.326; 9.565; 23.801 90; 94.17; 90 | 3707 | Journal of the American Chemical Society, 2005 |
| 4100178 | CIF | C35 H59 Cl N3 Si2 Yb | P 1 21/c 1 | 17.12; 18.184; 12.887 90; 104.48; 90 | 3884 | Journal of the American Chemical Society, 2005 |
| 4100179 | CIF | C40 H35 B Cl4 F4 Mn N O4 P2 | P 21 21 21 | 11.0401; 15.2369; 25 90; 90; 90 | 4205.5 | Marta E. G. Mosquera Crystal structure of compound 7 Journal of the American Chemical Society, 2005 |
| 4100180 | CIF | C40 H100 Cl N5 O36 V14 | P c a 21 | 24.315; 13.85; 21.742 90; 90; 90 | 7322 | Journal of the American Chemical Society, 2005 |
| 4100181 | CIF | C23 H28 N2 O7 S | P -1 | 9.9186; 11.3368; 11.9916 89.263; 67.54; 80.873 | 1228.66 | Sammis, Glenn M.; .; Ho, Douglas M.; Sorensen, Erik J.; . N'-(6-Acetyl-3-methyl-5-phenylcyclohex-2-enyl)-N'-methanesulfonyl- hydrazinedicarboxylic Acid Diallyl Ester Journal of the American Chemical Society, 2005 |
| 4100182 | CIF | Ga4 Se32 Ta16 | F -4 3 m | 10.358; 10.358; 10.358 90; 90; 90 | 1111.3 | Pocha, R.; Johrendt, D.; Ni, B.; Abd.Elmeguid, M.M. Crystal Structures, Electronic Properties and Presure Induced Superconductivity of the Tetrahedral Cluster Compounds GaNb4S8, GaNb4Se8 and GaTa4Se8 Journal of the American Chemical Society, 2005 |
| 4100183 | CIF | Ga4 Nb16 S32 | F -4 3 m | 9.985; 9.985; 9.985 90; 90; 90 | 995.5 | Journal of the American Chemical Society, 2005 |
| 4100184 | CIF | C75 H50 Cl4 O4 Ru2 | P -1 | 12.6109; 13.6479; 20.6566 102.68; 100.168; 107.999 | 3182.3 | Journal of the American Chemical Society, 2005 |
| 4100185 | CIF | C37 H25 I O2 Ru | P -1 | 7.9216; 10.1467; 19.4333 100.89; 90.896; 97.498 | 1519.46 | Journal of the American Chemical Society, 2005 |
| 4100186 | CIF | C37 H26 O2 Ru | P b c a | 13.8174; 20.133; 20.818 90; 90; 90 | 5791.3 | Journal of the American Chemical Society, 2005 |
| 4100187 | CIF | C22 H26 N2 S4 | P -1 | 7.4716; 8.133; 20.356 97.94; 93.89; 104.08 | 1181.7 | Javier Garin Journal of the American Chemical Society, 2005 |
| 4100188 | CIF | C27 H24 Br O6 | P -1 | 8.2219; 9.2783; 15.7089 99.007; 91.117; 97.868 | 1171.4 | Journal of the American Chemical Society, 2005 |
| 4100189 | CIF | C33 H35 Br O6 | P -1 | 7.7032; 10.0741; 20.765 88.043; 81.558; 69.923 | 1496.9 | Journal of the American Chemical Society, 2005 |
| 4100190 | CIF | C102 H120 O44 Si3 | I 41/a :2 | 16.926; 16.926; 38.794 90; 90; 90 | 11114 | Journal of the American Chemical Society, 2005 |
| 4100191 | CIF | C34 H36 O12 Si | I -4 2 d | 16.994; 16.994; 37.344 90; 90; 90 | 10785 | Journal of the American Chemical Society, 2005 |
| 4100192 | CIF | C24 H20 O8 Si | I -4 2 d | 17.3347; 17.3347; 36.855 90; 90; 90 | 11074.8 | Journal of the American Chemical Society, 2005 |
| 4100193 | CIF | C112 H140 O34 Si3 | I 41/a :2 | 17.106; 17.106; 38.635 90; 90; 90 | 11305 | Journal of the American Chemical Society, 2005 |
| 4100194 | CIF | C34.66667 H41.33333 O13.33333 Si | I -4 2 d | 17.05; 17.05; 37.082 90; 90; 90 | 10780 | Journal of the American Chemical Society, 2005 |
| 4100195 | CIF | C57 H53 N8 Ru2 S Si | P -1 | 10.411; 16.5299; 17.004 68.432; 83.805; 71.927 | 2587 | Journal of the American Chemical Society, 2005 |
| 4100196 | CIF | C30 H37 D8 N5 O4 Zr | P 1 21/c 1 | 12.3129; 12.915; 21.3187 90; 100.849; 90 | 3329.53 | Journal of the American Chemical Society, 2005 |
| 4100197 | CIF | C27 H19 N2 O | P -1 | 10.442; 10.423; 18.967 91.734; 97.363; 91.588 | 2045.4 | Journal of the American Chemical Society, 2005 |
| 4100198 | CIF | C30 H24 N2 O3 | P -1 | 9.7716; 10.2228; 12.723 91.335; 98.148; 91.295 | 1257.4 | Journal of the American Chemical Society, 2005 |
| 4100199 | CIF | C42 H46 N6 O2 | P 1 21 1 | 11.896; 11.812; 12.988 90; 90.592; 90 | 1824.8 | Journal of the American Chemical Society, 2005 |
| 4100200 | CIF | C40 H52 Br2 N4 Ni | C 1 2 1 | 31.635; 7.6556; 22.102 90; 133.882; 90 | 3858.1 | Journal of the American Chemical Society, 2005 |
| 4100201 | CIF | C11 H12 Br N O3 | P 21 21 21 | 5.574; 7.673; 27.77 90; 90; 90 | 1187.7 | Journal of the American Chemical Society, 2005 |
| 4100202 | CIF | C45 H103 Si7 | P -1 | 13.234; 13.33; 18.384 87.916; 76.263; 60.692 | 2734.9 | Journal of the American Chemical Society, 2005 |
| 4100203 | CIF | C95 H151 B F16 Si10 | P n a 21 | 39.64; 13.649; 20.009 90; 90; 90 | 10825.8 | Journal of the American Chemical Society, 2005 |
| 4100204 | CIF | C26 H45 Ga6 N4 O42 P9 Zn3 | C 1 2/c 1 | 30.746; 13.5846; 14.3291 90; 109.851; 90 | 5629.3 | Journal of the American Chemical Society, 2005 |
| 4100205 | CIF | C26 H45 Ga6 N4 O42 P9 Zn3 | C 1 2/c 1 | 30.748; 13.534; 14.31 90; 109.733; 90 | 5605 | Journal of the American Chemical Society, 2005 |
| 4100206 | CIF | C84.5 H111 N3 O3.5 U | R -3 :R | 16.0236; 16.0236; 16.0236 74.445; 74.445; 74.445 | 3732 | Journal of the American Chemical Society, 2005 |
| 4100207 | CIF | C28 H37 N1.5 O U0.33 | R -3 :R | 16.1204; 16.1204; 16.1204 73.85; 73.85; 73.85 | 3772.4 | Journal of the American Chemical Society, 2005 |
| 4100208 | CIF | C61 H100 N3 O4 U | I 41/a :2 | 27.6121; 27.6121; 31.7727 90; 90; 90 | 24224.4 | Journal of the American Chemical Society, 2005 |
| 4100209 | CIF | C38 H43 O8.5 S3 | R -3 :H | 13.7443; 13.7443; 60.7777 90; 90; 120 | 9943.1 | Song, Qiuling; Ho, Douglas M.; Pascal Jr.; Robert A. A Sterically Congested in-Methylcyclophane Journal of the American Chemical Society, 2005 |
| 4100210 | CIF | C28 H34 N3 Ni | P 1 21/c 1 | 8.822; 16.4; 17.952 90; 100.581; 90 | 2553.2 | Kogut, E.; Wiencko, H. L.; Zhang, L; Cordeau, D. E.; Warren, T. H. Journal of the American Chemical Society, 2005 |
| 4100211 | CIF | C30 H38 N3 Ni | P 1 21/c 1 | 11.544; 14.664; 16.55 90; 106.65; 90 | 2684 | Kogut, E.; Wiencko, H. L.; Zhang, L.; Cordeau, D. E.;Warren, T. H. Journal of the American Chemical Society, 2005 |
| 4100212 | CIF | C52 H65 N5 Ni2 | P 1 21/c 1 | 10.749; 15.625; 33.698 90; 98.613; 90 | 5596 | Kogut, E.; Wiencko, H. L.; Zhang, L; Cordeau, D. E.; Warren, T. H. Journal of the American Chemical Society, 2005 |
| 4100213 | CIF | C33 H44 N3 Ni | P n m a | 17.0088; 9.2319; 19.0881 90; 90; 90 | 2997.3 | Kogut, E.; Wiencko, H. L.; Zhang, L.; Cordeau, D. E.; Warren, Timothy H. Journal of the American Chemical Society, 2005 |
| 4100214 | CIF | C43 H54 Co N3 Ni | P n a 21 | 10.9909; 29.777; 11.2275 90; 90; 90 | 3674.5 | Journal of the American Chemical Society, 2005 |
| 4100215 | CIF | C33 H45 N3 Ni | P -4 21 c | 25.992; 25.992; 10.506 90; 90; 90 | 7098 | Kogut, E.; Wiencko, H. L.; Zhang, L.; Cordeau, D. E.; Warren, T. H. Journal of the American Chemical Society, 2005 |
| 4100216 | CIF | C48 H55 N O10 | P 1 21 1 | 6.552; 38.443; 8.845 90; 95.89; 90 | 2216.11 | Journal of the American Chemical Society, 2005 |
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