Crystallography Open Database
Search results
Result: there are 27655 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format
We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.
Searching year of publication is 2012
COD ID  |
Links | Formula |
Space group |
Cell parameters | Cell volume  |
Bibliography |
|---|---|---|---|---|---|---|
| 4117482 | CIF HKL | V | I m -3 m | 3.02032; 3.02032; 3.02032 90; 90; 90 | 27.5524 | Wojciech Miiller; Maxim Avdeev; Qingdi Zhou; Brendan J. Kennedy; Neeraj Sharma; Ramzi Kutteh; Gordon J. Kearley; Siegber Schmid; Kevin S. Knight; Peter E. R. Blanchard; Chris D. Ling Giant Magnetoelastic Effect at the Opening of a Spin-Gap in Ba3BiIr2O9 Journal of the American Chemical Society, 2012, 134, 3265-3270 |
| 9014404 | CIF | Fe Si2 | P 4/m m m | 2.696; 2.696; 5.147 90; 90; 90 | 37.411 | Li, G.; Bai, W.; Shi, N.; Fang, Q.; Xiong, M.; Yang, J.; Ma, Z.; Rong, H. Linzhiite, FeSi2, a redefined and revalidated new mineral species from Luobusha, Tibet, China European Journal of Mineralogy, 2012, 24, 1047-1052 |
| 9014113 | CIF | Fe | F m -3 m | 3.468; 3.468; 3.468 90; 90; 90 | 41.71 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 27.44 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9014851 | CIF | Fe | F m -3 m | 3.473; 3.473; 3.473 90; 90; 90 | 41.89 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M620, P = 26.55 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9016025 | CIF | Fe | F m -3 m | 3.475; 3.475; 3.475 90; 90; 90 | 41.963 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M622, P = 24.37 GPa, T = 1073 K American Mineralogist, 2012, 97, 1417-1420 |
| 9015906 | CIF | Fe | F m -3 m | 3.477; 3.477; 3.477 90; 90; 90 | 42.035 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 25.72 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9016329 | CIF | Fe | F m -3 m | 3.48; 3.48; 3.48 90; 90; 90 | 42.144 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 25.01 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9016648 | CIF | Fe | F m -3 m | 3.484; 3.484; 3.484 90; 90; 90 | 42.29 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M622, P = 22.34 GPa, T = 1073 K American Mineralogist, 2012, 97, 1417-1420 |
| 9015321 | CIF | Fe | F m -3 m | 3.485; 3.485; 3.485 90; 90; 90 | 42.326 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M620, P = 24.19 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9015019 | CIF | Fe | F m -3 m | 3.49; 3.49; 3.49 90; 90; 90 | 42.509 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M620, P = 23.17 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9015687 | CIF | Fe | F m -3 m | 3.494; 3.494; 3.494 90; 90; 90 | 42.655 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 22.44 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9016635 | CIF | Fe | F m -3 m | 3.495; 3.495; 3.495 90; 90; 90 | 42.692 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M622, P = 19.82 GPa, T = 1073 K American Mineralogist, 2012, 97, 1417-1420 |
| 9015105 | CIF | Fe | F m -3 m | 3.498; 3.498; 3.498 90; 90; 90 | 42.802 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 21.57 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9016184 | CIF | Fe | F m -3 m | 3.504; 3.504; 3.504 90; 90; 90 | 43.022 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 20.64 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9016506 | CIF | Fe | F m -3 m | 3.507; 3.507; 3.507 90; 90; 90 | 43.133 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M622, P = 17.47 GPa, T = 1073 K American Mineralogist, 2012, 97, 1417-1420 |
| 9015752 | CIF | Fe | F m -3 m | 3.509; 3.509; 3.509 90; 90; 90 | 43.207 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M620, P = 19.70 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9014285 | CIF | Fe | F m -3 m | 3.514; 3.514; 3.514 90; 90; 90 | 43.392 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 18.69 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9016480 | CIF | Fe | F m -3 m | 3.519; 3.519; 3.519 90; 90; 90 | 43.577 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M622, P = 15.37 GPa, T = 1073 K American Mineralogist, 2012, 97, 1417-1420 |
| 9014789 | CIF | Fe | F m -3 m | 3.521; 3.521; 3.521 90; 90; 90 | 43.651 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M620, P = 17.59 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9014540 | CIF | Fe | F m -3 m | 3.527; 3.527; 3.527 90; 90; 90 | 43.875 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M620, P = 16.63 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9015529 | CIF | Fe | F m -3 m | 3.531; 3.531; 3.531 90; 90; 90 | 44.024 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M622, P = 13.36 GPa, T = 1073 K American Mineralogist, 2012, 97, 1417-1420 |
| 9015258 | CIF | Fe | F m -3 m | 3.533; 3.533; 3.533 90; 90; 90 | 44.099 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 15.58 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9014231 | CIF | Fe | F m -3 m | 3.539; 3.539; 3.539 90; 90; 90 | 44.324 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 14.45 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9014287 | CIF | Fe | F m -3 m | 3.544; 3.544; 3.544 90; 90; 90 | 44.512 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M622, P = 11.48 GPa, T = 1073 K American Mineralogist, 2012, 97, 1417-1420 |
| 9015406 | CIF | Fe | F m -3 m | 3.545; 3.545; 3.545 90; 90; 90 | 44.55 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 13.63 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9014454 | CIF | Fe | F m -3 m | 3.551; 3.551; 3.551 90; 90; 90 | 44.777 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 12.71 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9014605 | CIF | Fe | F m -3 m | 3.555; 3.555; 3.555 90; 90; 90 | 44.928 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M622, P = 9.90 GPa, T = 1073 K American Mineralogist, 2012, 97, 1417-1420 |
| 9015445 | CIF | Fe | F m -3 m | 3.557; 3.557; 3.557 90; 90; 90 | 45.004 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 11.66 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9015166 | CIF | Fe | F m -3 m | 3.569; 3.569; 3.569 90; 90; 90 | 45.461 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M622, P = 8.02 GPa, T = 1073 K American Mineralogist, 2012, 97, 1417-1420 |
| 9014056 | CIF | Fe | F m -3 m | 3.581; 3.581; 3.581 90; 90; 90 | 45.921 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M622, P = 6.41 GPa, T = 1073 K American Mineralogist, 2012, 97, 1417-1420 |
| 9014591 | CIF | Fe | F m -3 m | 3.583; 3.583; 3.583 90; 90; 90 | 45.998 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 8.36 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9014476 | CIF | Fe | F m -3 m | 3.595; 3.595; 3.595 90; 90; 90 | 46.462 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 6.81 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 4117966 | CIF | Mn O | P 63 m c | 3.3717; 3.3717; 5.3855 90; 90; 120 | 53.022 | Ki Min Nam; Yong-Il Kim; Younghun Jo; Seung Mi Lee; Bog G. Kim; Ran Choi; Sang-Il Choi; Hyunjoon Song; Joon T. Park New Crystal Structure: Synthesis and Characterization of Hexagonal Wurtzite MnO Journal of the American Chemical Society, 2012, 134, 8392-8395 |
| 7020138 | CIF | Ca H2 O2 | P -3 m 1 | 3.59247; 3.59247; 4.9082 90; 90; 120 | 54.858 | Nielsen, Renie Birkedal; Norby, Poul; Kongshaug, Kjell Ove; Fjellvåg, Helmer Synthesis, crystal structure and thermal properties of Ca6(C12H14O4)4(CO3)(OH)2(H2O)x‒a 3D inorganic hybrid material. Dalton transactions (Cambridge, England : 2003), 2012, 41, 12082-12089 |
| 4330139 | CIF | Co0.5 Fe0.5 O3 Pr0.25 Sr0.75 | P m -3 m | 3.8809; 3.8809; 3.8809 90; 90; 90 | 58.452 | Laurent Jantsky; Hiroshi Okamoto; Antoine Demont; Helmer Fjellvåg Tuning of Water and Hydroxide Content of Intercalated Ruddlesden-Popper-type Oxides in the PrSr3Co1.5Fe1.5O10-δSystem Inorganic Chemistry, 2012, 51, 9181-9191 |
| 4330137 | CIF | Co0.5 Fe0.5 O3 Pr0.25 Sr0.75 | P m -3 m | 3.8832; 3.8832; 3.8832 90; 90; 90 | 58.556 | Laurent Jantsky; Hiroshi Okamoto; Antoine Demont; Helmer Fjellvåg Tuning of Water and Hydroxide Content of Intercalated Ruddlesden-Popper-type Oxides in the PrSr3Co1.5Fe1.5O10-δSystem Inorganic Chemistry, 2012, 51, 9181-9191 |
| 4330792 | CIF | H0.12 O2.88 Sr Ti | P m -3 m | 3.91119; 3.91119; 3.91119 90; 90; 90 | 59.8311 | Tatsunori Sakaguchi; Yoji Kobayashi; Takeshi Yajima; Masatoshi Ohkura; Cédric Tassel; Fumitaka Takeiri; Shingo Mitsuoka; Hiroshi Ohkubo; Takafumi Yamamoto; Jung eun Kim; Naruki Tsuji; Akihiko Fujihara; Yoshitaka Matsushita; James Hester; Maxim Avdeev; Kenji Ohoyama; Hiroshi Kageyama Oxyhydrides of (Ca,Sr,Ba)TiO3 Perovskite Solid Solutions Inorganic Chemistry, 2012, 51, 11371-11376 |
| 9016865 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9364; 3.9364; 3.9364 90; 90; 90 | 60.995 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 300 K, P = 55.09 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016829 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9365; 3.9365; 3.9365 90; 90; 90 | 61 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 300 K, P = 52.98 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016878 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9399; 3.9399; 3.9399 90; 90; 90 | 61.158 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 700 K, P = 57.85 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016840 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9414; 3.9414; 3.9414 90; 90; 90 | 61.228 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 700 K, P = 54.52 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016828 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9459; 3.9459; 3.9459 90; 90; 90 | 61.438 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 300 K, P = 51.31 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016851 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9481; 3.9481; 3.9481 90; 90; 90 | 61.541 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 1100 K, P = 55.47 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016839 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.951; 3.951; 3.951 90; 90; 90 | 61.677 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 700 K, P = 52.70 GPa American Mineralogist, 2012, 97, 176-183 |
| 4330791 | CIF | Ba0.4 H0.29 O2.71 Sr0.6 Ti | P m -3 m | 3.95164; 3.95164; 3.95164 90; 90; 90 | 61.7067 | Tatsunori Sakaguchi; Yoji Kobayashi; Takeshi Yajima; Masatoshi Ohkura; Cédric Tassel; Fumitaka Takeiri; Shingo Mitsuoka; Hiroshi Ohkubo; Takafumi Yamamoto; Jung eun Kim; Naruki Tsuji; Akihiko Fujihara; Yoshitaka Matsushita; James Hester; Maxim Avdeev; Kenji Ohoyama; Hiroshi Kageyama Oxyhydrides of (Ca,Sr,Ba)TiO3 Perovskite Solid Solutions Inorganic Chemistry, 2012, 51, 11371-11376 |
| 9016864 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9525; 3.9525; 3.9525 90; 90; 90 | 61.747 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 300 K, P = 52.35 GPa American Mineralogist, 2012, 97, 176-183 |
| 9015340 | CIF | Cr H O2 | P 21 n m | 4.8623; 4.2972; 2.9567 90; 90; 90 | 61.778 | Jahn, S.; Wunder, B.; Koch-Muller M; Tarrieu, L.; Pohle, M.; Watenphul, A.; Taran, M. N. Pressure-induced hydrogen bond symmetrisation in guyanaite, B-CrOOH: evidence from spectroscopy and ab initio simulations Sample: Run LT9 European Journal of Mineralogy, 2012, 24, 839-850 |
| 9015967 | CIF | Cr H2 O2 | P n n m | 4.8623; 4.2972; 2.9567 90; 90; 90 | 61.778 | Jahn, S.; Wunder, B.; Koch-Muller M; Tarrieu, L.; Pohle, M.; Watenphul, A.; Taran, M. N. Pressure-induced hydrogen bond symmetrisation in guyanaite, B-CrOOH: evidence from spectroscopy and ab initio simulations Sample: Run LT9 European Journal of Mineralogy, 2012, 24, 839-850 |
| 9016827 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.957; 3.957; 3.957 90; 90; 90 | 61.958 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 300 K, P = 48.91 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016877 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9576; 3.9576; 3.9576 90; 90; 90 | 61.986 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 700 K, P = 54.28 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016850 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9581; 3.9581; 3.9581 90; 90; 90 | 62.01 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 1100 K, P = 53.53 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016890 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9602; 3.9602; 3.9602 90; 90; 90 | 62.109 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 1100 K, P = 55.52 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016838 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9613; 3.9613; 3.9613 90; 90; 90 | 62.16 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 700 K, P = 50.40 GPa American Mineralogist, 2012, 97, 176-183 |
| 9014615 | CIF | Cr H2 O2 | P n n m | 4.8691; 4.3184; 2.9594 90; 90; 90 | 62.226 | Jahn, S.; Wunder, B.; Koch-Muller M; Tarrieu, L.; Pohle, M.; Watenphul, A.; Taran, M. N. Pressure-induced hydrogen bond symmetrisation in guyanaite, B-CrOOH: evidence from spectroscopy and ab initio simulations Sample: Run #630 European Journal of Mineralogy, 2012, 24, 839-850 |
| 9016826 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9673; 3.9673; 3.9673 90; 90; 90 | 62.443 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 300 K, P = 46.39 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016849 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9676; 3.9676; 3.9676 90; 90; 90 | 62.457 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 1100 K, P = 51.61 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016837 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9708; 3.9708; 3.9708 90; 90; 90 | 62.609 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 700 K, P = 48.26 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016863 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9717; 3.9717; 3.9717 90; 90; 90 | 62.651 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 300 K, P = 48.08 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016876 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9743; 3.9743; 3.9743 90; 90; 90 | 62.774 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 700 K, P = 50.28 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016848 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9775; 3.9775; 3.9775 90; 90; 90 | 62.926 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 1100 K, P = 49.32 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016889 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9786; 3.9786; 3.9786 90; 90; 90 | 62.978 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 1100 K, P = 51.42 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016825 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9812; 3.9812; 3.9812 90; 90; 90 | 63.102 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 300 K, P = 43.04 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016836 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9855; 3.9855; 3.9855 90; 90; 90 | 63.307 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 700 K, P = 44.55 GPa American Mineralogist, 2012, 97, 176-183 |
| 4330790 | CIF | Ba0.8 H0.2 O2.8 Sr0.2 Ti | P m -3 m | 3.98739; 3.98739; 3.98739 90; 90; 90 | 63.3966 | Tatsunori Sakaguchi; Yoji Kobayashi; Takeshi Yajima; Masatoshi Ohkura; Cédric Tassel; Fumitaka Takeiri; Shingo Mitsuoka; Hiroshi Ohkubo; Takafumi Yamamoto; Jung eun Kim; Naruki Tsuji; Akihiko Fujihara; Yoshitaka Matsushita; James Hester; Maxim Avdeev; Kenji Ohoyama; Hiroshi Kageyama Oxyhydrides of (Ca,Sr,Ba)TiO3 Perovskite Solid Solutions Inorganic Chemistry, 2012, 51, 11371-11376 |
| 9016862 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9877; 3.9877; 3.9877 90; 90; 90 | 63.411 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 300 K, P = 44.23 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016875 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9908; 3.9908; 3.9908 90; 90; 90 | 63.559 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 700 K, P = 46.21 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016847 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9911; 3.9911; 3.9911 90; 90; 90 | 63.574 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 1100 K, P = 45.80 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016824 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9962; 3.9962; 3.9962 90; 90; 90 | 63.818 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 300 K, P = 39.40 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016888 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 3.9972; 3.9972; 3.9972 90; 90; 90 | 63.866 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 1100 K, P = 47.43 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016835 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0014; 4.0014; 4.0014 90; 90; 90 | 64.067 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 700 K, P = 40.83 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016861 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0044; 4.0044; 4.0044 90; 90; 90 | 64.211 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 300 K, P = 40.01 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016846 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0069; 4.0069; 4.0069 90; 90; 90 | 64.332 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 1100 K, P = 42.17 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016874 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0072; 4.0072; 4.0072 90; 90; 90 | 64.346 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 700 K, P = 42.01 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016887 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0122; 4.0122; 4.0122 90; 90; 90 | 64.587 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 1100 K, P = 43.63 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016823 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0145; 4.0145; 4.0145 90; 90; 90 | 64.699 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 300 K, P = 35.19 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016860 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0148; 4.0148; 4.0148 90; 90; 90 | 64.713 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 300 K, P = 37.59 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016873 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0179; 4.0179; 4.0179 90; 90; 90 | 64.863 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 700 K, P = 39.67 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016834 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.021; 4.021; 4.021 90; 90; 90 | 65.013 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 700 K, P = 36.52 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016886 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0244; 4.0244; 4.0244 90; 90; 90 | 65.178 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 1100 K, P = 41.10 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016845 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0251; 4.0251; 4.0251 90; 90; 90 | 65.212 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 1100 K, P = 38.32 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016859 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0269; 4.0269; 4.0269 90; 90; 90 | 65.3 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 300 K, P = 34.79 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016872 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0318; 4.0318; 4.0318 90; 90; 90 | 65.539 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 700 K, P = 36.52 GPa American Mineralogist, 2012, 97, 176-183 |
| 4330784 | CIF | Ba H0.19 O2.81 Ti | P 4 m m | 4.0318; 4.0318; 4.0402 90; 90; 90 | 65.675 | Tatsunori Sakaguchi; Yoji Kobayashi; Takeshi Yajima; Masatoshi Ohkura; Cédric Tassel; Fumitaka Takeiri; Shingo Mitsuoka; Hiroshi Ohkubo; Takafumi Yamamoto; Jung eun Kim; Naruki Tsuji; Akihiko Fujihara; Yoshitaka Matsushita; James Hester; Maxim Avdeev; Kenji Ohoyama; Hiroshi Kageyama Oxyhydrides of (Ca,Sr,Ba)TiO3 Perovskite Solid Solutions Inorganic Chemistry, 2012, 51, 11371-11376 |
| 9016885 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0352; 4.0352; 4.0352 90; 90; 90 | 65.705 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 1100 K, P = 38.72 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016822 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0369; 4.0369; 4.0369 90; 90; 90 | 65.788 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 300 K, P = 30.25 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016858 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.041; 4.041; 4.041 90; 90; 90 | 65.988 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 300 K, P = 31.78 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016833 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0423; 4.0423; 4.0423 90; 90; 90 | 66.052 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 700 K, P = 32.06 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016871 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0442; 4.0442; 4.0442 90; 90; 90 | 66.145 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 700 K, P = 33.92 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016844 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0489; 4.0489; 4.0489 90; 90; 90 | 66.376 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 1100 K, P = 33.12 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016884 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0515; 4.0515; 4.0515 90; 90; 90 | 66.504 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 1100 K, P = 35.29 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016857 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.059; 4.059; 4.059 90; 90; 90 | 66.874 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 300 K, P = 28.32 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016870 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0634; 4.0634; 4.0634 90; 90; 90 | 67.092 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 700 K, P = 30.14 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016821 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0654; 4.0654; 4.0654 90; 90; 90 | 67.191 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 300 K, P = 24.85 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016883 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0689; 4.0689; 4.0689 90; 90; 90 | 67.364 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 1100 K, P = 31.64 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016832 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0707; 4.0707; 4.0707 90; 90; 90 | 67.454 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 700 K, P = 26.22 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016843 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0785; 4.0785; 4.0785 90; 90; 90 | 67.842 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 1100 K, P = 27.50 GPa American Mineralogist, 2012, 97, 176-183 |
| 2310043 | CIF Paper | Bi12 Fe10 O52 Sr18 | X2/m(\a0\g)0s | 3.6174; 5.48; 3.4641 90; 81.2438; 90 | 67.87 | Elcoro, Luis; Pérez, Olivier; Perez-Mato, J. M.; Petříček, Václav Unified (3+1)-dimensional superspace description of the 2212-type stair-like [Bi~2~Sr~3~Fe~2~O~9~]~<i>m~</i>[Bi~4~Sr~6~Fe~2~O~16~] family of compounds Acta Crystallographica Section B, 2012, 68, 341-355 |
| 9016856 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0824; 4.0824; 4.0824 90; 90; 90 | 68.037 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 300 K, P = 23.83 GPa American Mineralogist, 2012, 97, 176-183 |
| 2310038 | CIF Paper | Bi14 Fe12 O61 Sr21 | X2/m(\a0\g)0s | 3.5905; 5.4903; 3.4954 90; 81.8989; 90 | 68.217 | Elcoro, Luis; Pérez, Olivier; Perez-Mato, J. M.; Petříček, Václav Unified (3+1)-dimensional superspace description of the 2212-type stair-like [Bi~2~Sr~3~Fe~2~O~9~]~<i>m~</i>[Bi~4~Sr~6~Fe~2~O~16~] family of compounds Acta Crystallographica Section B, 2012, 68, 341-355 |
| 9016869 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0867; 4.0867; 4.0867 90; 90; 90 | 68.252 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 700 K, P = 25.78 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016882 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.0925; 4.0925; 4.0925 90; 90; 90 | 68.543 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 1100 K, P = 27.45 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016820 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.1049; 4.1049; 4.1049 90; 90; 90 | 69.168 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 300 K, P = 17.63 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016855 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.1101; 4.1101; 4.1101 90; 90; 90 | 69.432 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 300 K, P = 18.85 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016831 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.1113; 4.1113; 4.1113 90; 90; 90 | 69.492 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 700 K, P = 19.50 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016868 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.1158; 4.1158; 4.1158 90; 90; 90 | 69.721 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 700 K, P = 20.51 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016842 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.1187; 4.1187; 4.1187 90; 90; 90 | 69.868 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 1100 K, P = 20.82 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016881 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.1211; 4.1211; 4.1211 90; 90; 90 | 69.991 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 1100 K, P = 22.46 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016854 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.143; 4.143; 4.143 90; 90; 90 | 71.112 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 300 K, P = 13.05 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016867 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.145; 4.145; 4.145 90; 90; 90 | 71.215 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 700 K, P = 15.12 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016819 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.1506; 4.1506; 4.1506 90; 90; 90 | 71.504 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 300 K, P = 10.62 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016880 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.1545; 4.1545; 4.1545 90; 90; 90 | 71.706 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 1100 K, P = 16.80 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016830 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.1581; 4.1581; 4.1581 90; 90; 90 | 71.893 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 700 K, P = 12.11 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016841 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.1676; 4.1676; 4.1676 90; 90; 90 | 72.387 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 1100 K, P = 13.45 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016853 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.1714; 4.1714; 4.1714 90; 90; 90 | 72.585 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 300 K, P = 8.96 GPa American Mineralogist, 2012, 97, 176-183 |
| 4329325 | CIF | Ni O | F m -3 m | 4.1771; 4.1771; 4.1771 90; 90; 90 | 72.8827 | Andrew C. Malingowski; Peter W. Stephens; Ashfia Huq; Qingzhen Huang; Syed Khalid; Peter G. Khalifah Substitutional Mechanism of Ni into the Wide-Band-Gap Semiconductor InTaO4 and Its Implications for Water Splitting Activity in the Wolframite Structure Type Inorganic Chemistry, 2012, 51, 6096-6103 |
| 9016866 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.1782; 4.1782; 4.1782 90; 90; 90 | 72.94 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 700 K, P = 10.94 GPa American Mineralogist, 2012, 97, 176-183 |
| 4329323 | CIF | Ni O | F m -3 m | 4.17861; 4.17861; 4.17861 90; 90; 90 | 72.962 | Andrew C. Malingowski; Peter W. Stephens; Ashfia Huq; Qingzhen Huang; Syed Khalid; Peter G. Khalifah Substitutional Mechanism of Ni into the Wide-Band-Gap Semiconductor InTaO4 and Its Implications for Water Splitting Activity in the Wolframite Structure Type Inorganic Chemistry, 2012, 51, 6096-6103 |
| 9016879 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.1874; 4.1874; 4.1874 90; 90; 90 | 73.423 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 1100 K, P = 12.27 GPa American Mineralogist, 2012, 97, 176-183 |
| 1517802 | CIF | C O2 | I -4 2 d | 3.5518; 3.5518; 5.9184 90; 90; 90 | 74.662 | Datchi, Frédéric; Mallick, Bidyut; Salamat, Ashkan; Ninet, Sandra Structure of Polymeric Carbon Dioxide CO~2~-V Physical Review Letters, 2012, 108, 125701 |
| 9016818 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.2331; 4.2331; 4.2331 90; 90; 90 | 75.853 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.83,Fe0.17)O, T = 300 K, P = 0.0 GPa American Mineralogist, 2012, 97, 176-183 |
| 9016852 | CIF | Fe0.17 Mg0.83 O | F m -3 m | 4.2426; 4.2426; 4.2426 90; 90; 90 | 76.365 | Matsui, M.; Ito, E.; Yamazaki, D.; Yoshino, T.; Guo, X.; Shan, S.; Higo, Y.; Funakoshi, F. I. Static compression of (Mg0.83,Fe0.17)O and (Mg0.75,Fe0.25)O ferropericlase up to 58 GPa at 300, 700, and 1100 K Note: (Mg0.75,Fe0.25)O, T = 300 K, P = 0.0 GPa American Mineralogist, 2012, 97, 176-183 |
| 7208132 | CIF | Mg Mo N2 | P 63/m m c | 2.91081; 2.91081; 10.55029 90; 90; 120 | 77.415 | Wang, Liangbiao; Tang, Kaibin; Zhu, Yongchun; Li, Qianwen; Zhu, Baichuan; Wang, LianCheng; Si, Lulu; Qian, Yitai Solid state synthesis of a new ternary nitride MgMoN2 nanosheets and micromeshes Journal of Materials Chemistry, 2012, 22, 14559 |
| 9015763 | CIF | As Ni Rh | P 4/n m m :2 | 3.5498; 3.5498; 6.1573 90; 90; 90 | 77.589 | Vymazalova, A.; Laufek, F.; Drabek, M.; Stanley, C. J.; Baker, R. J.; Bermejo, R.; Garuti, G.; Thalhammer, O.; Proenza, J. A.; Longo, F. Zaccariniite, RhNiAs, a new platinum-group mineral from Loma Peguera, Dominican Republic The Canadian Mineralogist, 2012, 50, 1321-1329 |
| 4329645 | CIF | Fe Se | P 4/n m m :1 | 3.779; 3.779; 5.5111 90; 90; 90 | 78.703 | Fabian Nitsche; Til Goltz; Hans-Henning Klauss; Anna Isaeva; Ulrike Müller; Walter Schnelle; Paul Simon; Thomas Doert; Michael Ruck Room-Temperature Synthesis, Hydrothermal Recrystallization, and Properties of Metastable Stoichiometric FeSe Inorganic Chemistry, 2012, 51, 7370-7376 |
| 9015335 | CIF | Fe0.46 Mg0.04 Mn0.16 S Zn0.32 | P 63 m c | 3.8357; 3.8357; 6.3002 90; 90; 120 | 80.274 | Ma, C.; Beckett, J. R.; Rossman, G. R. Buseckite, (Fe,Zn,Mn)S, a new mineral from the Zaklodzie meteorite American Mineralogist, 2012, 97, 1226-1233 |
| 4328598 | CIF HKL | N3 Th2 | P -3 m 1 | 3.8855; 3.8855; 6.1846 90; 90; 120 | 80.86 | G. W. Chinthaka Silva; Charles B. Yeamans; Philppe F. Weck; John D. Hunn; Gary S. Cerefice; Alfred P. Sattelberger; Ken R. Czerwinski Synthesis and Characterization of Th2N2(NH) Isomorphous to Th2N3 Inorganic Chemistry, 2012, 51, 3332-3340 |
| 1563057 | CIF | Cu1.6 S2 Yb0.8 | P -3 m 1 | 3.866; 3.866; 6.272 90; 90; 120 | 81.18 | Gulay, L.D.; Daszkiewicz, M.; Shemet, V.Ya. Crystal structure of ∼RCu3S3 and ∼RCuTe2 (R=Gd‒Lu) compounds Journal of Solid State Chemistry, 2012, 186, 142-148 |
| 1563052 | CIF | Cu2 Lu0.67 S2 | P -3 m 1 | 3.8694; 3.8694; 6.3263 90; 90; 120 | 82.03 | Gulay, L.D.; Daszkiewicz, M.; Shemet, V.Ya. Crystal structure of ∼RCu3S3 and ∼RCuTe2 (R=Gd‒Lu) compounds Journal of Solid State Chemistry, 2012, 186, 142-148 |
| 1563051 | CIF | Cu2 Ho0.67 S2 | P -3 m 1 | 3.886; 3.886; 6.385 90; 90; 120 | 83.5 | Gulay, L.D.; Daszkiewicz, M.; Shemet, V.Ya. Crystal structure of ∼RCu3S3 and ∼RCuTe2 (R=Gd‒Lu) compounds Journal of Solid State Chemistry, 2012, 186, 142-148 |
| 2310050 | CIF Paper | Ag0.034 In0.037 Sb0.764 Te0.165 | R-3m(00\g)00 | 4.3037; 4.3037; 5.6452 90; 90; 120 | 90.551 | Matsunaga, Toshiyuki; Kojima, Rie; Yamada, Noboru; Kubota, Yoshiki; Kifune, Kouichi Structural transformation of Sb-based high-speed phase-change material Acta Crystallographica Section B, 2012, 68, 559-570 |
| 2310058 | CIF Paper | Sb0.89 Te0.11 | R-3m(00\g)00 | 4.29686; 4.29686; 5.6759 90; 90; 120 | 90.754 | Matsunaga, Toshiyuki; Kojima, Rie; Yamada, Noboru; Kubota, Yoshiki; Kifune, Kouichi Structural transformation of Sb-based high-speed phase-change material Acta Crystallographica Section B, 2012, 68, 559-570 |
| 2310057 | CIF Paper | Sb0.87 Te0.13 | R-3m(00\g)00 | 4.3181; 4.3181; 5.7267 90; 90; 120 | 92.474 | Matsunaga, Toshiyuki; Kojima, Rie; Yamada, Noboru; Kubota, Yoshiki; Kifune, Kouichi Structural transformation of Sb-based high-speed phase-change material Acta Crystallographica Section B, 2012, 68, 559-570 |
| 4505482 | CIF | Co Li O2 | R -3 m :H | 2.815; 2.815; 14.0516 90; 90; 120 | 96.43 | Lin, Qiyin; Li, Qing’an; Gray, Kenneth E.; Mitchell, John F. Vapor Growth and Chemical Delithiation of Stoichiometric LiCoO2Crystals Crystal Growth & Design, 2012, 12, 1232 |
| 2310031 | CIF Paper | Ga0.889 O4.222 Zn2.889 | C2/m(\a0\g)00 | 19.66; 3.2487; 1.6065 90; 105.9; 90 | 98.7 | Michiue, Yuichi; Kimizuka, Noboru; Kanke, Yasushi; Mori, Takao Structure of (Ga~2~O~3~)~2~(ZnO)~13~ and a unified description of the homologous series (Ga~2~O~3~)~2~(ZnO)~2~~<i>n~+1</i> Acta Crystallographica Section B, 2012, 68, 250-260 |
| 1562978 | CIF | F Na | F m -3 m | 4.6391; 4.6391; 4.6391 90; 90; 90 | 99.839 | Shirako, Y.; Shi, Y.G.; Aimi, A.; Mori, D.; Kojitani, H.; Yamaura, K.; Inaguma, Y.; Akaogi, M. High-pressure stability relations, crystal structures, and physical properties of perovskite and post-perovskite of NaNiF3 Journal of Solid State Chemistry, 2012, 191, 167-174 |
| 1562921 | CIF | C Zr | F m -3 m | 4.700422; 4.700422; 4.700422 90; 90; 90 | 103.851 | Chinthaka Silva, G.W.; Kercher, Andrew A.; Hunn, John D.; Martin, Rodger C.; Jellison, Gerald E.; Meyer, Harry M. Characterization of zirconium carbides using electron microscopy, optical anisotropy, Auger depth profiles, X-ray diffraction, and electron density calculated by charge flipping method Journal of Solid State Chemistry, 2012, 194, 91-99 |
| 4329013 | CIF HKL | K0.72 Li0.24 O2 Sn0.76 | P 63/m m c | 3.09884; 3.09884; 12.566 90; 90; 120 | 104.502 | Igor L. Shukaev; Vera V. Butova New P2 Compound with Brucite-Like Layers: Potassium Lithiostannate Inorganic Chemistry, 2012, 51, 4931-4937 |
| 4329799 | CIF | O S Th | P 4/n m m :2 | 3.958; 3.958; 6.7468 90; 90; 90 | 105.694 | Lukasz A. Koscielski; Emilie Ringe; Richard P. Van Duyne; Donald E. Ellis; James A. Ibers Single-Crystal Structures, Optical Absorptions, and Electronic Distributions of Thorium Oxychalcogenides ThOQ (Q = S, Se, Te) Inorganic Chemistry, 2012, 51, 8112-8118 |
| 1563053 | CIF | Cu Lu Te2 | P -3 m 1 | 4.26; 4.26; 6.905 90; 90; 120 | 108.52 | Gulay, L.D.; Daszkiewicz, M.; Shemet, V.Ya. Crystal structure of ∼RCu3S3 and ∼RCuTe2 (R=Gd‒Lu) compounds Journal of Solid State Chemistry, 2012, 186, 142-148 |
| 1563056 | CIF | Cu0.78 Te2 Tm1.07 | P -3 m 1 | 4.261; 4.261; 6.904 90; 90; 120 | 108.56 | Gulay, L.D.; Daszkiewicz, M.; Shemet, V.Ya. Crystal structure of ∼RCu3S3 and ∼RCuTe2 (R=Gd‒Lu) compounds Journal of Solid State Chemistry, 2012, 186, 142-148 |
| 2233312 | CIF HKL Paper | La Zn5 | P 6/m m m | 5.4654; 5.4654; 4.2574 90; 90; 120 | 110.13 | Oshchapovsky, Igor; Zelinska, Oksana; Rozdzynska-Kielbik, Beata; Pavlyuk, Volodymyr Redetermination of LaZn~5~ based on single crystal X-ray diffraction data Acta Crystallographica Section E, 2012, 68, i1 |
| 2300370 | CIF | O2 Si | P 32 2 1 | 4.91636; 4.91636; 5.4084 90; 90; 120 | 113.211 | Lignie, Adrien; Granier, Dominique; Armand, Pascale; Haines, Julien; Papet, Philippe Modulation of quartz-like GeO~2~ structure by Si substitution: an X-ray diffraction study of Ge~1{-~<i>x</i>}Si<i>~x~</i>O~2~ (0 {łeq} <i>x</i> < 0.2) flux-grown single crystals Journal of Applied Crystallography, 2012, 45, 272-278 |
| 4329800 | CIF | O Se Th | P 4/n m m :2 | 4.0176; 4.0176; 7.0198 90; 90; 90 | 113.307 | Lukasz A. Koscielski; Emilie Ringe; Richard P. Van Duyne; Donald E. Ellis; James A. Ibers Single-Crystal Structures, Optical Absorptions, and Electronic Distributions of Thorium Oxychalcogenides ThOQ (Q = S, Se, Te) Inorganic Chemistry, 2012, 51, 8112-8118 |
| 2300369 | CIF HKL | Ge0.83 O2 Si0.17 | P 31 2 1 | 4.9707; 4.9707; 5.5873 90; 90; 120 | 119.555 | Lignie, Adrien; Granier, Dominique; Armand, Pascale; Haines, Julien; Papet, Philippe Modulation of quartz-like GeO~2~ structure by Si substitution: an X-ray diffraction study of Ge~1{-~<i>x</i>}Si<i>~x~</i>O~2~ (0 {łeq} <i>x</i> < 0.2) flux-grown single crystals Journal of Applied Crystallography, 2012, 45, 272-278 |
| 2300368 | CIF HKL | Ge0.9 O2 Si0.1 | P 32 2 1 | 4.97517; 4.97517; 5.60565 90; 90; 120 | 120.163 | Lignie, Adrien; Granier, Dominique; Armand, Pascale; Haines, Julien; Papet, Philippe Modulation of quartz-like GeO~2~ structure by Si substitution: an X-ray diffraction study of Ge~1{-~<i>x</i>}Si<i>~x~</i>O~2~ (0 {łeq} <i>x</i> < 0.2) flux-grown single crystals Journal of Applied Crystallography, 2012, 45, 272-278 |
| 2300367 | CIF | Ge0.96 O2 Si0.04 | P 31 2 1 | 4.9805; 4.9805; 5.627 90; 90; 120 | 120.88 | Lignie, Adrien; Granier, Dominique; Armand, Pascale; Haines, Julien; Papet, Philippe Modulation of quartz-like GeO~2~ structure by Si substitution: an X-ray diffraction study of Ge~1{-~<i>x</i>}Si<i>~x~</i>O~2~ (0 {łeq} <i>x</i> < 0.2) flux-grown single crystals Journal of Applied Crystallography, 2012, 45, 272-278 |
| 2300366 | CIF | Ge0.97 O2 Si0.03 | P 32 2 1 | 4.983; 4.983; 5.6339 90; 90; 120 | 121.149 | Lignie, Adrien; Granier, Dominique; Armand, Pascale; Haines, Julien; Papet, Philippe Modulation of quartz-like GeO~2~ structure by Si substitution: an X-ray diffraction study of Ge~1{-~<i>x</i>}Si<i>~x~</i>O~2~ (0 {łeq} <i>x</i> < 0.2) flux-grown single crystals Journal of Applied Crystallography, 2012, 45, 272-278 |
| 2300365 | CIF HKL | Ge O2 | P 31 2 1 | 4.989; 4.989; 5.6527 90; 90; 120 | 121.847 | Lignie, Adrien; Granier, Dominique; Armand, Pascale; Haines, Julien; Papet, Philippe Modulation of quartz-like GeO~2~ structure by Si substitution: an X-ray diffraction study of Ge~1{-~<i>x</i>}Si<i>~x~</i>O~2~ (0 {łeq} <i>x</i> < 0.2) flux-grown single crystals Journal of Applied Crystallography, 2012, 45, 272-278 |
| 4330061 | CIF | Cu4 Eu P3 | P 4/m m m | 4.0579; 4.0579; 7.4396 90; 90; 90 | 122.505 | Dmitri O. Charkin; Arthur V. Urmanov; Sergey M. Kazakov; Dmitri Batuk; Artem M. Abakumov; Stephan Knöner; Elena Gati; Bernd Wolf; Michael Lang; Andrey V. Shevelkov; Gustaaf Van Tendeloo; Evgeni V. Antipov Synthesis, Crystal Structure, Transport, and Magnetic Properties of Novel Ternary Copper Phosphides, A2Cu6P5 (A = Sr, Eu) and EuCu4P3 Inorganic Chemistry, 2012, 51, 8948-8955 |
| 4118243 | CIF | Ca D Ge Ni | P 4/n m m :2 | 3.999502; 3.999502; 7.75966 90; 90; 90 | 124.124 | Xiaofeng Liu; Satoru Matsuishi; Satoru Fujitsu; Toru Ishigaki; Takashi Kamiyama; Hideo Hosono Layered Hydride CaNiGeH with a ZrCuSiAs-type Structure: Crystal Structure, Chemical Bonding, and Magnetism Induced by Mn Doping Journal of the American Chemical Society, 2012, 134, 11687-11694 |
| 4118242 | CIF | Ca Ge H Mn0.05 Ni0.95 | P 4/n m m :2 | 4.00062; 4.00062; 7.77622 90; 90; 90 | 124.458 | Xiaofeng Liu; Satoru Matsuishi; Satoru Fujitsu; Toru Ishigaki; Takashi Kamiyama; Hideo Hosono Layered Hydride CaNiGeH with a ZrCuSiAs-type Structure: Crystal Structure, Chemical Bonding, and Magnetism Induced by Mn Doping Journal of the American Chemical Society, 2012, 134, 11687-11694 |
| 4118244 | CIF | Ca Ge H Ni | P 4/n m m :2 | 4.00379; 4.00379; 7.76501 90; 90; 90 | 124.476 | Xiaofeng Liu; Satoru Matsuishi; Satoru Fujitsu; Toru Ishigaki; Takashi Kamiyama; Hideo Hosono Layered Hydride CaNiGeH with a ZrCuSiAs-type Structure: Crystal Structure, Chemical Bonding, and Magnetism Induced by Mn Doping Journal of the American Chemical Society, 2012, 134, 11687-11694 |
| 4118241 | CIF | Ca Ge H Mn0.1 Ni0.9 | P 4/n m m :2 | 3.9995; 3.9995; 7.80056 90; 90; 90 | 124.778 | Xiaofeng Liu; Satoru Matsuishi; Satoru Fujitsu; Toru Ishigaki; Takashi Kamiyama; Hideo Hosono Layered Hydride CaNiGeH with a ZrCuSiAs-type Structure: Crystal Structure, Chemical Bonding, and Magnetism Induced by Mn Doping Journal of the American Chemical Society, 2012, 134, 11687-11694 |
| 4329801 | CIF | O Te Th | P 4/n m m :2 | 4.1173; 4.1173; 7.5289 90; 90; 90 | 127.631 | Lukasz A. Koscielski; Emilie Ringe; Richard P. Van Duyne; Donald E. Ellis; James A. Ibers Single-Crystal Structures, Optical Absorptions, and Electronic Distributions of Thorium Oxychalcogenides ThOQ (Q = S, Se, Te) Inorganic Chemistry, 2012, 51, 8112-8118 |
| 4329932 | CIF | As Dy O Ru | P m m n :2 | 4.02033; 4.00791; 8.00483 90; 90; 90 | 128.983 | Michael A. McGuire; Andrew F. May; Brian C. Sales Crystallographic and Magnetic Phase Transitions in the Layered Ruthenium Oxyarsenides TbRuAsO and DyRuAsO Inorganic Chemistry, 2012, 51, 8502-8508 |
| 4329931 | CIF | As Dy O Ru | P 4/n m m :2 | 4.01728; 4.01728; 8.03272 90; 90; 90 | 129.636 | Michael A. McGuire; Andrew F. May; Brian C. Sales Crystallographic and Magnetic Phase Transitions in the Layered Ruthenium Oxyarsenides TbRuAsO and DyRuAsO Inorganic Chemistry, 2012, 51, 8502-8508 |
| 4329930 | CIF | As O Ru Tb | P 4/n m m :2 | 4.0254; 4.0254; 8.07102 90; 90; 90 | 130.782 | Michael A. McGuire; Andrew F. May; Brian C. Sales Crystallographic and Magnetic Phase Transitions in the Layered Ruthenium Oxyarsenides TbRuAsO and DyRuAsO Inorganic Chemistry, 2012, 51, 8502-8508 |
| 2105050 | CIF Paper | Li0.62 Zn0.87 | P -3 m 1 | 4.3528; 4.3528; 8.003 90; 90; 120 | 131.32 | Pavlyuk, Volodymyr; Chumak, Ihor; Ehrenberg, Helmut Polymorphism of Li~2~Zn~3~ Acta Crystallographica Section B, 2012, 68, 34-39 |
| 1543080 | CIF | Ag2 Mg2 Sb2 | P 4/n m m :2 | 4.41991; 4.41991; 6.8896 90; 90; 90 | 134.593 | Kirkham, Melanie J.; dos Santos, Antonio M.; Rawn, Claudia J.; Lara-Curzio, Edgar; Sharp, Jeff W.; Thompson, Alan J. Abinitio determination of crystal structures of the thermoelectric material MgAgSb Physical Review B, 2012, 85, 144120 |
| 7152130 | CIF | C6 H7 F O3 | P 1 | 5.1716; 5.2806; 6.082 68.403; 67.501; 80.743 | 142.64 | Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride. Organic & biomolecular chemistry, 2012, 10, 394-403 |
| 4329324 | CIF | In0.91 Ni0.06 O4 Ta1.03 | P 1 2/c 1 | 4.81863; 5.77023; 5.152369 90; 91.3467; 90 | 143.22 | Andrew C. Malingowski; Peter W. Stephens; Ashfia Huq; Qingzhen Huang; Syed Khalid; Peter G. Khalifah Substitutional Mechanism of Ni into the Wide-Band-Gap Semiconductor InTaO4 and Its Implications for Water Splitting Activity in the Wolframite Structure Type Inorganic Chemistry, 2012, 51, 6096-6103 |
| 4329322 | CIF HKL | In0.94 Ni0.04 O4 Ta1.02 | P 1 2/c 1 | 4.824528; 5.773787; 5.155303 90; 91.3764; 90 | 143.564 | Andrew C. Malingowski; Peter W. Stephens; Ashfia Huq; Qingzhen Huang; Syed Khalid; Peter G. Khalifah Substitutional Mechanism of Ni into the Wide-Band-Gap Semiconductor InTaO4 and Its Implications for Water Splitting Activity in the Wolframite Structure Type Inorganic Chemistry, 2012, 51, 6096-6103 |
| 4329321 | CIF HKL | In O4 Ta | P 1 2/c 1 | 4.830251; 5.775132; 5.15715 90; 91.4251; 90 | 143.816 | Andrew C. Malingowski; Peter W. Stephens; Ashfia Huq; Qingzhen Huang; Syed Khalid; Peter G. Khalifah Substitutional Mechanism of Ni into the Wide-Band-Gap Semiconductor InTaO4 and Its Implications for Water Splitting Activity in the Wolframite Structure Type Inorganic Chemistry, 2012, 51, 6096-6103 |
| 9015333 | CIF | F H Mg O | P n m a | 10.1299; 3.0723; 4.676 90; 90; 90 | 145.527 | Crichton, W. A.; Parise, J. B.; Muller, H.; Breger, J.; Marshall, W. G.; Welch, M. D. Synthesis and structure of magnesium hydroxide fluoride, Mg(OH)F: a topological intermediate between brucite- and rutile-type structures Mineralogical Magazine, 2012, 76, 25-36 |
| 9014902 | CIF | F H O Zn | P n m a | 10.228; 3.1125; 4.7165 90; 90; 90 | 150.148 | Crichton, W. A.; Parise, J. B.; Muller, H.; Breger, J.; Marshall, W. G.; Welch, M. D. Synthesis and structure of magnesium hydroxide fluoride, Mg(OH)F: a topological intermediate between brucite- and rutile-type structures Note: transformed from Serier et al (2007) Mineralogical Magazine, 2012, 76, 25-36 |
| 4117452 | CIF HKL | N2 Np | F m -3 m | 5.32356; 5.32356; 5.32356 90; 90; 90 | 150.871 | G. W. Chinthaka Silva; Philippe F. Weck; Eunja Kim; Charles B. Yeamans; Gary S. Cerefice; Alfred P. Sattelberger; Kenneth R. Czerwinski Crystal and Electronic Structures of Neptunium Nitrides Synthesized Using a Fluoride Route Journal of the American Chemical Society, 2012, 134, 3111-3119 |
| 9017839 | CIF | Al0.89 Fe0.11 K O8 S2 | P 3 1 2 | 4.7281; 4.7281; 7.9936 90; 90; 120 | 154.756 | Murashko, M. N.; Pekov, I. V.; Krivovichev, S. V.; Chernyatyeava, A. P.; Yapaskurt, V. O.; Zadov, A. E.; Zelensky, M. E. Steklite, KAl(SO4)2: the find at Tolbachik volcano (Kamchatka, Russia). Validation as a mineral species and crystal structure Zapiski Rossiiskogo Mineralogicheskogo Obshchetstva, 2012, 141, 36-44 |
| 7214849 | CIF | Al Ca Er O4 | I 4/m m m | 3.642; 3.642; 11.814 90; 90; 90 | 156.7 | Zhu, Zhaojie; Zeng, Huiyi; Li, Jianfu; You, Zhenyu; Wang, Yan; Huang, Zixiang; Tu, Chaoyang Growth, structure and spectral properties of a novel crystal CaErAlO4 for 2.7 μm lasers CrystEngComm, 2012, 14, 7423 |
| 1562989 | CIF | Ce O2 | F m -3 m | 5.4073; 5.4073; 5.4073 90; 90; 90 | 158.103 | Artini, Cristina; Costa, Giorgio A.; Pani, Marcella; Lausi, Andrea; Plaisier, Jasper Structural characterization of the CeO2/Gd2O3 mixed system by synchrotron X-ray diffraction Journal of Solid State Chemistry, 2012, 190, 24-28 |
| 9014886 | CIF | Fe O7 Ti3 | I m m 2 | 9.9522; 2.7397; 5.9953 90; 90; 90 | 163.468 | Nishio-Hamane D; Zhang, M.; Yagi, T.; Ma, Y. High-pressure and high-temperature phase transitions in FeTiO3 and a new dense FeTi3O7 structure Note: P = 61 GPa, T = 300 K American Mineralogist, 2012, 97, 568-572 |
| 2236685 | CIF HKL Paper | Li2 Mn O4 Si | P m n 21 | 6.3133; 5.3677; 4.9685 90; 90; 90 | 168.37 | Sato, Mineo; Ishigaki, Tadashi; Uematsu, Kazuyoshi; Toda, Kenji; Okawa, Hirokazu Redetermination of the low-temperature polymorph of Li~2~MnSiO~4~ from single-crystal X-ray data Acta Crystallographica Section E, 2012, 68, i68-i69 |
| 2310042 | CIF Paper | Bi0.727 Mo0.273 O1.909 | F2/m(\a0\g)0s | 5.64477; 5.63038; 5.4499 90; 89.7498; 90 | 173.208 | Bereciartua, P. J.; Zuñiga, F. J.; Perez-Mato, J. M.; Petříček, V.; Vila, E.; Castro, A.; Rodríguez-Carvajal, J.; Doyle, S. Structure refinement and superspace description of the system Bi~2(<i>n~+2)</i>Mo~<i>n~</i>O~6(<i>n~+1)</i> (<i>n</i> = 3, 4, 5 and 6) Acta Crystallographica Section B, 2012, 68, 323-340 |
| 2310039 | CIF Paper | Bi0.737 Mo0.263 O1.895 | F2(\a0\g)0 | 5.66785; 5.64098; 5.45603 90; 89.6677; 90 | 174.439 | Bereciartua, P. J.; Zuñiga, F. J.; Perez-Mato, J. M.; Petříček, V.; Vila, E.; Castro, A.; Rodríguez-Carvajal, J.; Doyle, S. Structure refinement and superspace description of the system Bi~2(<i>n~+2)</i>Mo~<i>n~</i>O~6(<i>n~+1)</i> (<i>n</i> = 3, 4, 5 and 6) Acta Crystallographica Section B, 2012, 68, 323-340 |
| 9016639 | CIF | As Fe S | P 1 21/c 1 | 5.7612; 5.6841; 5.7674 90; 111.721; 90 | 175.456 | Bindi, L.; Moelo, Y.; Leone, P.; Suchaud, M. Stoichiometric arsenopyrite, FeAsS, from La Roche-Balue Quarry, Loire-Atlantique, France: Crystal structure and Mossbauer study The Canadian Mineralogist, 2012, 50, 471-479 |
| 9014938 | CIF | Ca0.002 Fe0.01 Mn0.993 S | F -4 3 m | 5.601; 5.601; 5.601 90; 90; 90 | 175.71 | Ma, C.; Beckett, J. R.; Rossman, G. R. Browneite, MnS, a new sphalerite-group mineral from the Zaklodzie meteorite American Mineralogist, 2012, 97, 2056-2059 |
| 2310040 | CIF Paper | Bi0.75 Mo0.25 O1.875 | F2/m(\a0\g)0s | 5.70284; 5.64841; 5.46579 90; 89.5999; 90 | 176.06 | Bereciartua, P. J.; Zuñiga, F. J.; Perez-Mato, J. M.; Petříček, V.; Vila, E.; Castro, A.; Rodríguez-Carvajal, J.; Doyle, S. Structure refinement and superspace description of the system Bi~2(<i>n~+2)</i>Mo~<i>n~</i>O~6(<i>n~+1)</i> (<i>n</i> = 3, 4, 5 and 6) Acta Crystallographica Section B, 2012, 68, 323-340 |
| 7208461 | CIF | C5 H9 N O3 S | P 1 | 5.04324; 5.80332; 6.4627 95.944; 103.086; 102.516 | 177.525 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 9014857 | CIF | H6 Mg O6 Si | P 21 21 21 | 4.976; 5.023; 7.115 90; 89.89; 90 | 177.835 | Wunder, B.; Jahn, S.; Koch-Muller M; Speziale, S. The 3.65 A phase, MgSi(OH)6: structural insights from DFT-calculations and T-dependent IR spectroscopy Note: theoretical structure, LDA from P2_12_12_1 American Mineralogist, 2012, 97, 1043-1048 |
| 2310041 | CIF Paper | Bi0.769 Mo0.231 O1.846 | F2(\a0\g)0 | 5.76634; 5.64745; 5.46529 90; 89.7935; 90 | 177.977 | Bereciartua, P. J.; Zuñiga, F. J.; Perez-Mato, J. M.; Petříček, V.; Vila, E.; Castro, A.; Rodríguez-Carvajal, J.; Doyle, S. Structure refinement and superspace description of the system Bi~2(<i>n~+2)</i>Mo~<i>n~</i>O~6(<i>n~+1)</i> (<i>n</i> = 3, 4, 5 and 6) Acta Crystallographica Section B, 2012, 68, 323-340 |
| 7208460 | CIF | C5 H9 N O3 S | P 1 | 5.053; 5.81773; 6.4717 96.051; 103.212; 102.439 | 178.456 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 9016723 | CIF | H6 Mg O6 Si | P 1 21 1 | 4.958; 5.056; 7.14 90; 89.87; 90 | 178.983 | Wunder, B.; Jahn, S.; Koch-Muller M; Speziale, S. The 3.65 A phase, MgSi(OH)6: structural insights from DFT-calculations and T-dependent IR spectroscopy Note: theoretical structure, LDA from Pnam American Mineralogist, 2012, 97, 1043-1048 |
| 9017499 | CIF | C0.34 H2 Al0.377 Ni0.623 O3.02 | R -3 m :H | 3.029; 3.029; 22.5995 90; 90; 120 | 179.568 | Mills, S. J.; Whitfield, P. S.; Kampf, A. R.; Wilson, S. A.; Dipple, G. M.; Raudsepp, M.; Favreau, G. Contribution to the crystallography of hydrotalcites: the crystal structures of woodallite and takovite Note: polytype 3R Note: calculated chemical formula differs from expected Journal of Geosciences, 2012, 58, 273-279 |
| 7208459 | CIF | C5 H9 N O3 S | P 1 | 5.06381; 5.83621; 6.4864 96.162; 103.409; 102.331 | 179.669 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 7208458 | CIF | C5 H9 N O3 S | P 1 | 5.07618; 5.8583; 6.5043 96.3; 103.661; 102.203 | 181.091 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 7208457 | CIF | C5 H9 N O3 S | P 1 | 5.08996; 5.8843; 6.5214 96.452; 103.859; 102.076 | 182.703 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 9015034 | CIF | C0.2 H2.912 Al0.4 O3.056 Zn0.6 | R -3 m :H | 3.06616; 3.06616; 22.6164 90; 90; 120 | 184.138 | Lozano, R. P.; Rossi, C.; La Iglesia, A.; Matesanz, E. Zaccagnaite-3R, a new Zn-Al hydrotalcite polytype from El Soplao cave (Cantabria, Spain) Note: polytype zaccagnaite-3R American Mineralogist, 2012, 97, 513-523 |
| 4327810 | CIF | Ba Co S2 | P 4/n m m :2 | 4.564; 4.564; 8.938 90; 90; 90 | 186.18 | Francesco Mezzadri; Edmondo Gilioli; Gianluca Calestani; Andrea Migliori; Mark R. Harrison; David A. Headspith; M. Grazia Francesconi Using High Pressure to Prepare Polymorphs of the Ba2Co1-xZnxS3 (0 <= x <= 1.0) Compounds Inorganic Chemistry, 2012, 51, 397-404 |
| 4506380 | CIF | C6 H6 B2 F2 O4 | P -1 | 4.9838; 5.2569; 7.423 74.671; 84.636; 89 | 186.73 | Durka, Krzysztof; Jarzembska, Katarzyna N.; Kamiński, Radosław; Luliński, Sergiusz; Serwatowski, Janusz; Woźniak, Krzysztof Structural and Energetic Landscape of Fluorinated 1,4-Phenylenediboronic Acids Crystal Growth & Design, 2012, 12, 3720 |
| 4329109 | CIF | Ag2 S | P 1 21/n 1 | 4.092; 5.7519; 7.9702 90; 93.819; 90 | 187.18 | David Santamaría-Pérez; Miriam Marqués; Raquel Chuliá-Jordán; José Manuel Menendez; Oscar Gomis; Javier Ruiz-Fuertes; Juan Antonio Sans; Daniel Errandonea; José Manuel Recio Compression of Silver Sulfide: X-ray Diffraction Measurements and Total-Energy Calculations Inorganic Chemistry, 2012, 51, 5289-5298 |
| 1562847 | CIF | Al0.9 Ni1.1 Sc | P 63/m m c | 5.1337; 5.1337; 8.2078 90; 90; 120 | 187.335 | Sahlberg, Martin; Ångström, Jonas; Zlotea, Claudia; Beran, Premysl; Latroche, Michel; Pay Gómez, Cesar Structure and hydrogen storage properties of the hexagonal Laves phase Sc(Al1−xNix)2 Journal of Solid State Chemistry, 2012, 196, 132-137 |
| 1544363 | CIF | O7 P2 Si | P 1 21/c 1 | 4.3042; 7.1505; 6.2987 90; 103.805; 90 | 188.26 | Leinenweber, K.; Stearns, L.A.; Nite, J.M.; Nemeth, P.; Groy, T.L. Structure of a new form of silicon phosphate (SiP2O7) synthesized at high pressures and temperatures Journal of Solid State Chemistry, 2012, 225, 190-221 |
| 4328837 | CIF HKL | Ce1.3 Cl Nd0.7 O3 | P 4/n m m :1 | 3.8948; 3.8948; 12.467 90; 90; 90 | 189.12 | Jean-François Vigier; Catherine Renard; Natacha Henry; Annabelle Laplace; Francis Abraham Molten Salt Synthesis of a Mixed-Valent Lanthanide(III/IV) Oxychloride with an Unprecedented Sillen X24 Structure: Ce1.3Nd0.7O3Cl Inorganic Chemistry, 2012, 51, 4352-4358 |
| 1562848 | CIF | Al0.686 D0.387 Ni1.314 Sc | P 63/m m c | 5.1682; 5.1682; 8.2865 90; 90; 120 | 191.682 | Sahlberg, Martin; Ångström, Jonas; Zlotea, Claudia; Beran, Premysl; Latroche, Michel; Pay Gómez, Cesar Structure and hydrogen storage properties of the hexagonal Laves phase Sc(Al1−xNix)2 Journal of Solid State Chemistry, 2012, 196, 132-137 |
| 9014233 | CIF | H6 Mg O6 Si | P 1 21 1 | 5.1131; 5.1898; 7.3303 90; 90.03; 90 | 194.517 | Wunder, B.; Jahn, S.; Koch-Muller M; Speziale, S. The 3.65 A phase, MgSi(OH)6: structural insights from DFT-calculations and T-dependent IR spectroscopy American Mineralogist, 2012, 97, 1043-1048 |
| 9017500 | CIF | C0.07 H2 Al0.039 Cl0.11 Cr0.124 Fe0.087 Mg0.75 O2.851 | R -3 m :H | 3.10124; 3.10124; 23.6817 90; 90; 120 | 197.249 | Mills, S. J.; Whitfield, P. S.; Kampf, A. R.; Wilson, S. A.; Dipple, G. M.; Raudsepp, M.; Favreau, G. Contribution to the crystallography of hydrotalcites: the crystal structures of woodallite and takovite Note: polytype 3R Note: calculated chemical formula differs from expected Journal of Geosciences, 2012, 58, 273-279 |
| 1514067 | CIF | Li2 Mn O3 | C 1 2/m 1 | 4.9167; 8.5069; 5.0099 90; 109.373; 90 | 197.679 | Lee, Sanghyun; Choi, Seongil; Kim, Jiyeon; Sim, Hasung; Won, Choongjae; Lee, Seongsu; Kim, Shin; Hur, Namjung; Park, Je-Geun Antiferromagnetic ordering in Li2 Mn O3 single crystals with a 2- dimensional honeycomb lattice Journal of Physics: Condensed Matter, 2012, 24, 456004-1-456004-9 |
| 1514066 | CIF | Li2 Mn O3 | C 1 2/m 1 | 4.9166; 8.5065; 5.0117 90; 109.376; 90 | 197.733 | Lee, Sanghyun; Choi, Seongil; Kim, Jiyeon; Sim, Hasung; Won, Choongjae; Lee, Seongsu; Kim, Shin; Hur, Namjung; Park, Je-Geun Antiferromagnetic ordering in Li2 Mn O3 single crystals with a 2-dimensional honeycomb lattice Journal of Physics: Condensed Matter, 2012, 24, 456004-1-456004-9 |
| 9016368 | CIF | H6 Mg O6 Si | P 21 21 21 | 5.173; 5.21; 7.371 90; 89.88; 90 | 198.658 | Wunder, B.; Jahn, S.; Koch-Muller M; Speziale, S. The 3.65 A phase, MgSi(OH)6: structural insights from DFT-calculations and T-dependent IR spectroscopy Note: theoretical structure, GGA from P2_12_12_1 American Mineralogist, 2012, 97, 1043-1048 |
| 1508533 | CIF | B4 H16 Zr | P -4 3 m | 5.8387; 5.8387; 5.8387 90; 90; 90 | 199.04 | Rude, Line H.; Corno, Marta; Ugliengo, Piero; Baricco, Marcello; Lee, Young-Su; Cho, Young Whan; Besenbacher, Flemming; Overgaard, Jacob; Jensen, Torben R. Synthesis and Structural Investigation of Zr(BH4)4 The Journal of Physical Chemistry C, 2012, 116, 20239 |
| 9014516 | CIF | H6 Mg O6 Si | P 1 21 1 | 5.148; 5.252; 7.404 90; 89.88; 90 | 200.184 | Wunder, B.; Jahn, S.; Koch-Muller M; Speziale, S. The 3.65 A phase, MgSi(OH)6: structural insights from DFT-calculations and T-dependent IR spectroscopy Note: theoretical structure, GGA from Pnam American Mineralogist, 2012, 97, 1043-1048 |
| 4329108 | CIF | Ag2 S | P 21 21 21 | 6.725; 4.1479; 7.2945 90; 90; 90 | 203.48 | David Santamaría-Pérez; Miriam Marqués; Raquel Chuliá-Jordán; José Manuel Menendez; Oscar Gomis; Javier Ruiz-Fuertes; Juan Antonio Sans; Daniel Errandonea; José Manuel Recio Compression of Silver Sulfide: X-ray Diffraction Measurements and Total-Energy Calculations Inorganic Chemistry, 2012, 51, 5289-5298 |
| 4117906 | CIF | K0.8 Ni2 Se2 | I 4/m m m | 3.8922; 3.8922; 13.523 90; 90; 90 | 204.863 | James R. Neilson; Tyrel M. McQueen Bonding, Ion Mobility, and Rate-Limiting Steps in Deintercalation Reactions with ThCr2Si2-type KNi2Se2 Journal of the American Chemical Society, 2012, 134, 7750-7757 |
| 4117904 | CIF | K0.95 Ni2 Se2 | I 4/m m m | 3.9061; 3.9061; 13.4278 90; 90; 90 | 204.876 | James R. Neilson; Tyrel M. McQueen Bonding, Ion Mobility, and Rate-Limiting Steps in Deintercalation Reactions with ThCr2Si2-type KNi2Se2 Journal of the American Chemical Society, 2012, 134, 7750-7757 |
| 4117903 | CIF | K Ni2 Se2 | I 4/m m m | 3.9089; 3.9089; 13.412281 90; 90; 90 | 204.933 | James R. Neilson; Tyrel M. McQueen Bonding, Ion Mobility, and Rate-Limiting Steps in Deintercalation Reactions with ThCr2Si2-type KNi2Se2 Journal of the American Chemical Society, 2012, 134, 7750-7757 |
| 4117905 | CIF | K0.9 Ni2 Se2 | I 4/m m m | 3.9018; 3.9018; 13.469 90; 90; 90 | 205.053 | James R. Neilson; Tyrel M. McQueen Bonding, Ion Mobility, and Rate-Limiting Steps in Deintercalation Reactions with ThCr2Si2-type KNi2Se2 Journal of the American Chemical Society, 2012, 134, 7750-7757 |
| 9015264 | CIF | Cl F O Pb2 | I 4/m m m | 4.065; 4.065; 12.631 90; 90; 90 | 208.717 | Turner, R. W.; Siidra, O. I.; Krivovichev, S. V.; Stanley, C. J.; Spratt, J. Rumseyite, [Pb2OF]Cl, the first naturally occurring fluoroxychloride mineral with the parent crystal structure for layered lead oxychlorides Mineralogical Magazine, 2012, 76, 1247-1255 |
| 4329107 | CIF | Ag2 S | P 1 21/n 1 | 4.1266; 6.6989; 7.8383 90; 99.672; 90 | 213.6 | David Santamaría-Pérez; Miriam Marqués; Raquel Chuliá-Jordán; José Manuel Menendez; Oscar Gomis; Javier Ruiz-Fuertes; Juan Antonio Sans; Daniel Errandonea; José Manuel Recio Compression of Silver Sulfide: X-ray Diffraction Measurements and Total-Energy Calculations Inorganic Chemistry, 2012, 51, 5289-5298 |
| 7208188 | CIF | C8 H8 N2 O4 | P -1 | 5.1006; 6.1168; 6.9894 85.396; 82.199; 85.176 | 214.76 | Arhangelskis, Mihails; Lloyd, Gareth O.; Jones, William Mechanochemical synthesis of pyrazine:dicarboxylic acid cocrystals and a study of dissociation by quantitative phase analysis CrystEngComm, 2012, 14, 5203 |
| 4331324 | CIF | K3 O8 Sc V2 | P -3 m 1 | 5.7638; 5.7638; 7.4746 90; 90; 120 | 215.05 | Martin M. Kimani; Lindsey Thompson; Whitney Snider; Colin D. McMillen; Joseph W. Kolis Hydrothermal Synthesis and Spectroscopic Properties of a New Glaserite Material, K3RE(VO4)2 (RE = Sc, Y, Dy, Ho, Er, Yb, Lu, or Tm) with Potential Lasing and Optical Properties Inorganic Chemistry, 2012, 51, 13271-13280 |
| 4117647 | CIF | Au3 Ge Sr | P 4/n m m :2 | 6.249; 6.249; 5.5104 90; 90; 90 | 215.18 | Qisheng Lin; John D Corbett Formation of Nets of Corner-Shared Bicapped Gold Squares in SrAu3Ge: How a BaAl4- Type Derivative Reconciles Fewer Valence Electrons and the Origin of Its Uniaxial Negative Thermal Expansion Journal of the American Chemical Society, 2012, 134, 4877-4884 |
| 4117646 | CIF | Au3 Ge Sr | P 4/n m m :2 | 6.2638; 6.2638; 5.5082 90; 90; 90 | 216.12 | Qisheng Lin; John D Corbett Formation of Nets of Corner-Shared Bicapped Gold Squares in SrAu3Ge: How a BaAl4- Type Derivative Reconciles Fewer Valence Electrons and the Origin of Its Uniaxial Negative Thermal Expansion Journal of the American Chemical Society, 2012, 134, 4877-4884 |
| 4117645 | CIF | Au3 Ge Sr | P 4/n m m :2 | 6.2741; 6.2741; 5.4944 90; 90; 90 | 216.28 | Qisheng Lin; John D Corbett Formation of Nets of Corner-Shared Bicapped Gold Squares in SrAu3Ge: How a BaAl4- Type Derivative Reconciles Fewer Valence Electrons and the Origin of Its Uniaxial Negative Thermal Expansion Journal of the American Chemical Society, 2012, 134, 4877-4884 |
| 7207729 | CIF | C6 H4 I2 N2 | P -1 | 4.2383; 7.3655; 7.8486 113.047; 99.614; 93.365 | 220.2 | Perkins, Catherine; Libri, Stefano; Adams, Harry; Brammer, Lee Diiodoacetylene: compact, strong ditopic halogen bond donor CrystEngComm, 2012, 14, 3033 |
| 4328980 | CIF | Mg Na2 Sn | P 63/m m c | 5.0486; 5.0486; 10.095 90; 90; 120 | 222.83 | Takahiro Yamada; Volker L. Deringer; Richard Dronskowski; Hisanori Yamane Synthesis, Crystal Structure, Chemical Bonding, and Physical Properties of the Ternary Na/Mg Stannide Na2MgSn Inorganic Chemistry, 2012, 51, 4810-4816 |
| 4330627 | CIF | Cu2 Li8 O12 Te2 | C 1 2/m 1 | 5.2697; 8.7858; 5.2352 90; 113.142; 90 | 222.878 | Vinod Kumar; Neha Bhardwaj; Nobel Tomar; Vaishali Thakral; S. Uma Novel Lithium-Containing Honeycomb Structures Inorganic Chemistry, 2012, 51, 10471-10473 |
| 4330629 | CIF | Co2 Li8 O12 Te2 | C 1 2/m 1 | 5.2262; 8.892; 5.1601 90; 110.93; 90 | 223.97 | Vinod Kumar; Neha Bhardwaj; Nobel Tomar; Vaishali Thakral; S. Uma Novel Lithium-Containing Honeycomb Structures Inorganic Chemistry, 2012, 51, 10471-10473 |
| 4331326 | CIF | K3 O8 V2 Yb | P -3 m 1 | 5.8453; 5.8453; 7.5694 90; 90; 120 | 223.98 | Martin M. Kimani; Lindsey Thompson; Whitney Snider; Colin D. McMillen; Joseph W. Kolis Hydrothermal Synthesis and Spectroscopic Properties of a New Glaserite Material, K3RE(VO4)2 (RE = Sc, Y, Dy, Ho, Er, Yb, Lu, or Tm) with Potential Lasing and Optical Properties Inorganic Chemistry, 2012, 51, 13271-13280 |
| 4331328 | CIF | Ho K3 O8 V2 | P -3 m 1 | 5.8495; 5.8495; 7.5737 90; 90; 120 | 224.43 | Martin M. Kimani; Lindsey Thompson; Whitney Snider; Colin D. McMillen; Joseph W. Kolis Hydrothermal Synthesis and Spectroscopic Properties of a New Glaserite Material, K3RE(VO4)2 (RE = Sc, Y, Dy, Ho, Er, Yb, Lu, or Tm) with Potential Lasing and Optical Properties Inorganic Chemistry, 2012, 51, 13271-13280 |
| 4330789 | CIF | Ca H0.07 O2.93 Ti | P b n m | 5.3882; 5.44716; 7.65383 90; 90; 90 | 224.643 | Tatsunori Sakaguchi; Yoji Kobayashi; Takeshi Yajima; Masatoshi Ohkura; Cédric Tassel; Fumitaka Takeiri; Shingo Mitsuoka; Hiroshi Ohkubo; Takafumi Yamamoto; Jung eun Kim; Naruki Tsuji; Akihiko Fujihara; Yoshitaka Matsushita; James Hester; Maxim Avdeev; Kenji Ohoyama; Hiroshi Kageyama Oxyhydrides of (Ca,Sr,Ba)TiO3 Perovskite Solid Solutions Inorganic Chemistry, 2012, 51, 11371-11376 |
| 4331329 | CIF | K3 Lu O8 V2 | P -3 m 1 | 5.855; 5.855; 7.578 90; 90; 120 | 224.98 | Martin M. Kimani; Lindsey Thompson; Whitney Snider; Colin D. McMillen; Joseph W. Kolis Hydrothermal Synthesis and Spectroscopic Properties of a New Glaserite Material, K3RE(VO4)2 (RE = Sc, Y, Dy, Ho, Er, Yb, Lu, or Tm) with Potential Lasing and Optical Properties Inorganic Chemistry, 2012, 51, 13271-13280 |
| 9015717 | CIF | C Ca0.997 O3 Sr0.003 | P m c n | 4.9541; 7.9494; 5.7186 90; 90; 90 | 225.211 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 184 K American Mineralogist, 2012, 97, 707-712 |
| 1562977 | CIF | F3 Na Ni | C m c m | 3.02605; 10.0579; 7.40138 90; 90; 90 | 225.266 | Shirako, Y.; Shi, Y.G.; Aimi, A.; Mori, D.; Kojitani, H.; Yamaura, K.; Inaguma, Y.; Akaogi, M. High-pressure stability relations, crystal structures, and physical properties of perovskite and post-perovskite of NaNiF3 Journal of Solid State Chemistry, 2012, 191, 167-174 |
| 7020065 | CIF | C2 H8 N12 O | P -1 | 4.708; 7.429; 7.483 102.21; 107.68; 106.78 | 225.54 | Fischer, Niko; Hüll, Katharina; Klapötke, Thomas M; Stierstorfer, Jörg; Laus, Gerhard; Hummel, Michael; Froschauer, Carmen; Wurst, Klaus; Schottenberger, Herwig 5,5'-Azoxytetrazolates - a new nitrogen-rich dianion and its comparison to 5,5'-azotetrazolate. Dalton transactions (Cambridge, England : 2003), 2012, 41, 11201-11211 |
| 9016597 | CIF | C Ca0.997 O3 Sr0.003 | P m c n | 4.9564; 7.9536; 5.7253 90; 90; 90 | 225.698 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 224 K American Mineralogist, 2012, 97, 707-712 |
| 7017668 | CIF | Li3 Ni2 O6 Sb | C 1 2/m 1 | 5.1828; 8.9678; 5.1578 90; 109.695; 90 | 225.702 | Zvereva, Elena A.; Evstigneeva, Maria A.; Nalbandyan, Vladimir B.; Savelieva, Olga A.; Ibragimov, Sergey A.; Volkova, Olga S.; Medvedeva, Larisa I.; Vasiliev, Alexander N.; Klingeler, Ruediger; Buechner, Bernd Monoclinic honeycomb-layered compound Li3Ni2SbO6: preparation, crystal structure and magnetic properties. Dalton transactions (Cambridge, England : 2003), 2012, 41, 572-580 |
| 9016338 | CIF | C Ca0.997 O3 Sr0.003 | P m c n | 4.9579; 7.9595; 5.7328 90; 90; 90 | 226.23 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 265 K American Mineralogist, 2012, 97, 707-712 |
| 9015425 | CIF | C Ca0.997 O3 Sr0.003 | P m c n | 4.9596; 7.9644; 5.7416 90; 90; 90 | 226.795 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 300 K American Mineralogist, 2012, 97, 707-712 |
| 9015942 | CIF | C Ca0.997 O3 Sr0.003 | P m c n | 4.9596; 7.9644; 5.7416 90; 90; 90 | 226.795 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 300 K, low-temperature experiment American Mineralogist, 2012, 97, 707-712 |
| 9015320 | CIF | C Ca0.997 O3 Sr0.003 | P m c n | 4.9615; 7.9629; 5.7428 90; 90; 90 | 226.886 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 300 K, high-temperature experiment American Mineralogist, 2012, 97, 707-712 |
| 4506788 | CIF | C8 H4 O6 U | P -1 | 5.1044; 5.5593; 8.4574 89.989; 85.615; 71.995 | 227.5 | Mihalcea, Ionut; Henry, Natacha; Bousquet, Till; Volkringer, Christophe; Loiseau, Thierry Six-Fold Coordinated Uranyl Cations in Extended Coordination Polymers Crystal Growth & Design, 2012, 12, 4641 |
| 4331327 | CIF | Er K3 O8 V2 | P -3 m 1 | 5.8798; 5.8798; 7.6035 90; 90; 120 | 227.65 | Martin M. Kimani; Lindsey Thompson; Whitney Snider; Colin D. McMillen; Joseph W. Kolis Hydrothermal Synthesis and Spectroscopic Properties of a New Glaserite Material, K3RE(VO4)2 (RE = Sc, Y, Dy, Ho, Er, Yb, Lu, or Tm) with Potential Lasing and Optical Properties Inorganic Chemistry, 2012, 51, 13271-13280 |
| 9014833 | CIF | C Ca0.997 O3 Sr0.003 | P m c n | 4.9638; 7.9698; 5.7545 90; 90; 90 | 227.651 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 359 K American Mineralogist, 2012, 97, 707-712 |
| 4330788 | CIF | Ca0.8 H0.22 O2.78 Sr0.2 Ti | P b n m | 5.42792; 5.45549; 7.69587 90; 90; 90 | 227.89 | Tatsunori Sakaguchi; Yoji Kobayashi; Takeshi Yajima; Masatoshi Ohkura; Cédric Tassel; Fumitaka Takeiri; Shingo Mitsuoka; Hiroshi Ohkubo; Takafumi Yamamoto; Jung eun Kim; Naruki Tsuji; Akihiko Fujihara; Yoshitaka Matsushita; James Hester; Maxim Avdeev; Kenji Ohoyama; Hiroshi Kageyama Oxyhydrides of (Ca,Sr,Ba)TiO3 Perovskite Solid Solutions Inorganic Chemistry, 2012, 51, 11371-11376 |
| 4330628 | CIF | Cu2.72 Li7.4 O12 Te1.88 | C 1 2/m 1 | 5.4477; 8.6822; 5.3247 90; 115.19; 90 | 227.9 | Vinod Kumar; Neha Bhardwaj; Nobel Tomar; Vaishali Thakral; S. Uma Novel Lithium-Containing Honeycomb Structures Inorganic Chemistry, 2012, 51, 10471-10473 |
| 4331330 | CIF | K3 O8 Tm V2 | P -3 m 1 | 5.8835; 5.8835; 7.6085 90; 90; 120 | 228.09 | Martin M. Kimani; Lindsey Thompson; Whitney Snider; Colin D. McMillen; Joseph W. Kolis Hydrothermal Synthesis and Spectroscopic Properties of a New Glaserite Material, K3RE(VO4)2 (RE = Sc, Y, Dy, Ho, Er, Yb, Lu, or Tm) with Potential Lasing and Optical Properties Inorganic Chemistry, 2012, 51, 13271-13280 |
| 4330510 | CIF | Al0.45 Mg1.55 Si | P n m a | 6.9242; 4.138; 7.9618 90; 90; 90 | 228.124 | Shidong Ji; Masashi Tanaka; Shuai Zhang; Shoji Yamanaka High Pressure Synthesis and Superconductivity of the Ternary Compounds Mg(Mg1-xAlx)Si with the Anticotunnite Structure Inorganic Chemistry, 2012, 51, 10300-10305 |
| 9014618 | CIF | C Ca0.997 O3 Sr0.003 | P m c n | 4.9667; 7.9775; 5.768 90; 90; 90 | 228.539 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 415 K American Mineralogist, 2012, 97, 707-712 |
| 1562979 | CIF | F3 Na Ni | P n m a | 5.53607; 7.7056; 5.36741 90; 90; 90 | 228.967 | Shirako, Y.; Shi, Y.G.; Aimi, A.; Mori, D.; Kojitani, H.; Yamaura, K.; Inaguma, Y.; Akaogi, M. High-pressure stability relations, crystal structures, and physical properties of perovskite and post-perovskite of NaNiF3 Journal of Solid State Chemistry, 2012, 191, 167-174 |
| 4331323 | CIF | K3 O8 V2 Y | P -3 m 1 | 5.8889; 5.8889; 7.6295 90; 90; 120 | 229.14 | Martin M. Kimani; Lindsey Thompson; Whitney Snider; Colin D. McMillen; Joseph W. Kolis Hydrothermal Synthesis and Spectroscopic Properties of a New Glaserite Material, K3RE(VO4)2 (RE = Sc, Y, Dy, Ho, Er, Yb, Lu, or Tm) with Potential Lasing and Optical Properties Inorganic Chemistry, 2012, 51, 13271-13280 |
| 4331325 | CIF | Dy K3 O8 V2 | P -3 m 1 | 5.9016; 5.9016; 7.6047 90; 90; 120 | 229.38 | Martin M. Kimani; Lindsey Thompson; Whitney Snider; Colin D. McMillen; Joseph W. Kolis Hydrothermal Synthesis and Spectroscopic Properties of a New Glaserite Material, K3RE(VO4)2 (RE = Sc, Y, Dy, Ho, Er, Yb, Lu, or Tm) with Potential Lasing and Optical Properties Inorganic Chemistry, 2012, 51, 13271-13280 |
| 9014887 | CIF | C Ca0.997 O3 Sr0.003 | P m c n | 4.9692; 7.9873; 5.7796 90; 90; 90 | 229.395 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 471 K American Mineralogist, 2012, 97, 707-712 |
| 4329604 | CIF | C4 H10 Cl2 N2 O2 Pt | P -1 | 4.2101; 6.5803; 8.7596 75.388; 82.707; 78.825 | 229.59 | Yulia Yu. Scaffidi-Domianello; Anton A. Legin; Michael A. Jakupec; Alexander Roller; Vadim Yu. Kukushkin; Markus Galanski; Bernhard K. Keppler Novel Oximato-Bridged Platinum(II) Di- and Trimer(s): Synthetic, Structural, and in Vitro Anticancer Activity Studies Inorganic Chemistry, 2012, 51, 7153-7163 |
| 1562922 | CIF | Ag2 As2 Ba | I 4/m m m | 4.6025; 4.6025; 10.8672 90; 90; 90 | 230.2 | Stoyko, Stanislav S.; Blanchard, Peter E.R.; Mar, Arthur Crystal structure, electrical resistivity, and X-ray photoelectron spectroscopy of BaAg2As2 Journal of Solid State Chemistry, 2012, 194, 113-118 |
| 9015886 | CIF | C Ca0.997 O3 Sr0.003 | P m c n | 4.9723; 7.9983; 5.7931 90; 90; 90 | 230.391 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 527 K American Mineralogist, 2012, 97, 707-712 |
| 4330787 | CIF | Ca0.6 H0.11 O2.89 Sr0.4 Ti | P b n m | 5.47021; 5.4611; 7.72283 90; 90; 90 | 230.707 | Tatsunori Sakaguchi; Yoji Kobayashi; Takeshi Yajima; Masatoshi Ohkura; Cédric Tassel; Fumitaka Takeiri; Shingo Mitsuoka; Hiroshi Ohkubo; Takafumi Yamamoto; Jung eun Kim; Naruki Tsuji; Akihiko Fujihara; Yoshitaka Matsushita; James Hester; Maxim Avdeev; Kenji Ohoyama; Hiroshi Kageyama Oxyhydrides of (Ca,Sr,Ba)TiO3 Perovskite Solid Solutions Inorganic Chemistry, 2012, 51, 11371-11376 |
| 4328521 | CIF | C2 Mn N2 | P n -3 m :1 | 6.14879; 6.14879; 6.14879 90; 90; 90 | 232.471 | Christopher M. Kareis; Saul H. Lapidus; Peter W. Stephens; Joel S. Miller Interpenetrating Three-Dimensional Diamondoid Lattices and Antiferromagnetic Ordering (Tc= 73 K) of MnII(CN)2 Inorganic Chemistry, 2012, 51, 3046-3050 |
| 7112516 | CIF | C2 H5 N O2 | P 31 | 7.0111; 7.0111; 5.4843 90; 90; 120 | 233.47 | Ishikawa, Kazuhiko; Tanaka, Masahito; Suzuki, Toshiya; Sekine, Akiko; Kawasaki, Tsuneomi; Soai, Kenso; Shiro, Motoo; Lahav, Meir; Asahi, Toru Absolute chirality of the γ-polymorph of glycine: correlation of the absolute structure with the optical rotation. Chemical communications (Cambridge, England), 2012, 48, 6031 |
| 7112517 | CIF | C2 H5 N O2 | P 32 | 7.01706; 7.01706; 5.48499 90; 90; 120 | 233.893 | Ishikawa, Kazuhiko; Tanaka, Masahito; Suzuki, Toshiya; Sekine, Akiko; Kawasaki, Tsuneomi; Soai, Kenso; Shiro, Motoo; Lahav, Meir; Asahi, Toru Absolute chirality of the γ-polymorph of glycine: correlation of the absolute structure with the optical rotation. Chemical communications (Cambridge, England), 2012, 48, 6031 |
| 4330786 | CIF | Ca0.4 H0.11 O2.89 Sr0.6 Ti | I 4/m c m | 5.48347; 5.48347; 7.7796 90; 90; 90 | 233.92 | Tatsunori Sakaguchi; Yoji Kobayashi; Takeshi Yajima; Masatoshi Ohkura; Cédric Tassel; Fumitaka Takeiri; Shingo Mitsuoka; Hiroshi Ohkubo; Takafumi Yamamoto; Jung eun Kim; Naruki Tsuji; Akihiko Fujihara; Yoshitaka Matsushita; James Hester; Maxim Avdeev; Kenji Ohoyama; Hiroshi Kageyama Oxyhydrides of (Ca,Sr,Ba)TiO3 Perovskite Solid Solutions Inorganic Chemistry, 2012, 51, 11371-11376 |
| 4330304 | CIF HKL | C2 Co N2 S2 | C 1 2/m 1 | 10.5959; 3.72504; 6.16597 90; 105.862; 90 | 234.105 | Endrit Shurdha; Saul H. Lapidus; Peter W. Stephens; Curtis E. Moore; Arnold L. Rheingold; Joel S. Miller Extended Network Thiocyanate- and Tetracyanoethanide-Based First-Row Transition Metal Complexes Inorganic Chemistry, 2012, 51, 9655-9665 |
| 9016427 | CIF | Cr2 O3 | R -3 c :H | 4.605; 4.605; 12.854 90; 90; 120 | 236.063 | Kantor, A.; Kantor, I.; Merlini, M.; Glazyrin, K.; Prescher, C.; Hanfland, M.; Dubrovinsky, L. High-pressure structural studies of eskolaite by means of single-crystal X-ray diffraction Note: P = 70.4 GPa American Mineralogist, 2012, 97, 1764-1770 |
| 7207940 | CIF | Mg Mo O6 Te | P 21 21 2 | 5.0378; 5.2691; 8.8985 90; 90; 90 | 236.208 | Zhang, Junjie; Zhang, Zhonghan; Sun, Youxuan; Zhang, Chengqian; Zhang, Shaojun; Liu, Yang; Tao, Xutang MgTeMoO6: A neutral layered material showing strong second-harmonic generation Journal of Materials Chemistry, 2012, 22, 9921 |
| 4330785 | CIF | Ca0.2 H0.2 O2.8 Sr0.8 Ti | I 4/m c m | 5.50506; 5.50506; 7.7972 90; 90; 90 | 236.299 | Tatsunori Sakaguchi; Yoji Kobayashi; Takeshi Yajima; Masatoshi Ohkura; Cédric Tassel; Fumitaka Takeiri; Shingo Mitsuoka; Hiroshi Ohkubo; Takafumi Yamamoto; Jung eun Kim; Naruki Tsuji; Akihiko Fujihara; Yoshitaka Matsushita; James Hester; Maxim Avdeev; Kenji Ohoyama; Hiroshi Kageyama Oxyhydrides of (Ca,Sr,Ba)TiO3 Perovskite Solid Solutions Inorganic Chemistry, 2012, 51, 11371-11376 |
| 4330360 | CIF | C6 H6 Ag N5 O3 | P -1 | 5.27077; 6.76852; 7.21407 94.8177; 82.4034; 111.993 | 236.37 | Aurel Tăbăcaru; Claudio Pettinari; Fabio Marchetti; Corrado di Nicola; Konstantin V. Domasevitch; Simona Galli; Norberto Masciocchi; Stefania Scuri; Iolanda Grappasonni; Mario Cocchioni Antibacterial Action of 4,4'-Bipyrazolyl-Based Silver(I) Coordination Polymers Embedded in PE Disks Inorganic Chemistry, 2012, 51, 9775-9788 |
| 4330141 | CIF | Co1.5 Fe1.5 H2 O10 Pr Sr3 | P m m m | 3.86; 3.867; 15.85 90; 90; 90 | 236.6 | Laurent Jantsky; Hiroshi Okamoto; Antoine Demont; Helmer Fjellvåg Tuning of Water and Hydroxide Content of Intercalated Ruddlesden-Popper-type Oxides in the PrSr3Co1.5Fe1.5O10-δSystem Inorganic Chemistry, 2012, 51, 9181-9191 |
| 4117957 | CIF | Cs I3 Sn | P m -3 m | 6.2057; 6.2057; 6.2057 90; 90; 90 | 238.99 | In Chung; Jung-Hwan Song; Jino Im; John Androulakis; Christos D. Malliakas; Hao Li; Arthur J. Freeman; John T. Kenney; Mercouri G. Kanatzidis CsSnI3: Semiconductor or Metal? High Electrical Conductivity and Strong Near-Infrared Photoluminescence from a Single Material. High Hole Mobility and Phase-Transitions Journal of the American Chemical Society, 2012, 134, 8579-8587 |
| 9014067 | CIF | Cr2 O3 | R -3 c :H | 4.629; 4.629; 12.88 90; 90; 120 | 239.013 | Kantor, A.; Kantor, I.; Merlini, M.; Glazyrin, K.; Prescher, C.; Hanfland, M.; Dubrovinsky, L. High-pressure structural studies of eskolaite by means of single-crystal X-ray diffraction Note: P = 63.9 GPa American Mineralogist, 2012, 97, 1764-1770 |
| 4001678 | CIF | Ag3 O4 V | I -4 2 m | 4.9795; 4.9795; 9.7271 90; 90; 90 | 241.19 | Cloet, V.; Raw, A.; Poeppelmeier, K. R.; Trimarchi, G.; Peng, H.; Im, J.; Freeman, A.J.; Perry, N. H.; Mason, T. O.; Zakutayev, A.; Ndione, P. F.; Ginley, D. S.; Perkins, J. D. Structural, Optical, and Transport Properties of α- and β-Ag3VO4 Chemistry of Materials, 2012, 24, 3346 |
| 9017411 | CIF | C Ca O3 | P 21 21 21 | 4.3668; 6.5831; 8.4282 90; 90; 90 | 242.286 | Demichelis, R.; Raiteri, P.; Gale, J. D.; Dovesi, R. A new structural model for disorder in vaterite from first-principles calculations CrystEngComm, 2012, 14, 44-47 |
| 4330138 | CIF | Co1.5 Fe1.5 H2 O10 Pr Sr3 | P m m m | 3.874; 3.875; 16.1953 90; 90; 90 | 243.1 | Laurent Jantsky; Hiroshi Okamoto; Antoine Demont; Helmer Fjellvåg Tuning of Water and Hydroxide Content of Intercalated Ruddlesden-Popper-type Oxides in the PrSr3Co1.5Fe1.5O10-δSystem Inorganic Chemistry, 2012, 51, 9181-9191 |
| 4330757 | CIF | Li0.88 N3.48 Nb3 O0.52 | P 63/m c m | 5.2043; 5.2043; 10.3942 90; 90; 120 | 243.81 | Teruki Motohashi; Masahiko Ito; Yuji Masubuchi; Makoto Wakeshima; Shinichi Kikkawa Crystal Structure and Superconducting Properties of Hexagonal Lithium-Niobium Oxynitride Inorganic Chemistry, 2012, 51, 11184-11189 |
| 9017410 | CIF | C Ca O3 | A m a 2 | 8.4905; 6.3905; 4.5026 90; 90; 90 | 244.305 | Demichelis, R.; Raiteri, P.; Gale, J. D.; Dovesi, R. A new structural model for disorder in vaterite from first-principles calculations CrystEngComm, 2012, 14, 44-47 |
| 9015442 | CIF | Cr2 O3 | R -3 c :H | 4.674; 4.674; 12.941 90; 90; 120 | 244.836 | Kantor, A.; Kantor, I.; Merlini, M.; Glazyrin, K.; Prescher, C.; Hanfland, M.; Dubrovinsky, L. High-pressure structural studies of eskolaite by means of single-crystal X-ray diffraction Note: P = 55.1 GPa American Mineralogist, 2012, 97, 1764-1770 |
| 1508416 | CIF | Ba In0.2 Sn2.8 | P 63/m m c | 7.2604; 7.2604; 5.382 90; 90; 120 | 245.69 | Schαfer, Marion C.; Yamasaki, Yuki; Fritsch, Veronika; Bobev, Svilen Indium Doping in BaSn3-x Inx (0 <= x <= 0.2) with Ni3Sn Structure Crystals, 2012, 1, 104-111 |
| 9015501 | CIF | As2 Cu0.4 H8 O12 Zn2.6 | P -1 | 5.9756; 7.6002; 5.4471 84.2892; 90.492; 87.9958 | 245.988 | Hawthorne, F. C.; Cooper, M. A.; Abdu, Y. A.; Ball, N. A.; Back, M. E.; Tait, K. T. Davidlloydite, ideally Zn3(AsO4)2(H2O)4, a new arsenate mineral from the Tsumeb mine, Otjikoto (Oshikoto) region, Namibia: description and crystal structure Mineralogical Magazine, 2012, 76, 45-57 |
| 9014824 | CIF | Cr2 O3 | R -3 c :H | 4.69; 4.69; 12.972 90; 90; 120 | 247.106 | Kantor, A.; Kantor, I.; Merlini, M.; Glazyrin, K.; Prescher, C.; Hanfland, M.; Dubrovinsky, L. High-pressure structural studies of eskolaite by means of single-crystal X-ray diffraction Note: P = 50.2 GPa American Mineralogist, 2012, 97, 1764-1770 |
| 1508415 | CIF | Ba Sn3 | P 63/m m c | 7.2279; 7.2279; 5.469 90; 90; 120 | 247.44 | Schαfer, Marion C.; Yamasaki, Yuki; Fritsch, Veronika; Bobev, Svilen Indium Doping in BaSn3-x Inx (0 <= x <= 0.2) with Ni3Sn Structure Crystals, 2012, 1, 104-111 |
| 1563082 | CIF | Mo O6 Sr2 Zn | I 4/m | 5.58682; 5.58682; 7.9864 90; 90; 90 | 249.276 | Day, Bradley E.; Bley, Nicholas D.; Jones, Heather R.; McCullough, Ryan M.; Eng, Hank W.; Porter, Spencer H.; Woodward, Patrick M.; Barnes, Paris W. Structures of ordered tungsten- or molybdenum-containing quaternary perovskite oxides Journal of Solid State Chemistry, 2012, 185, 107-116 |
| 1563083 | CIF | O6 Sr2 W Zn | P 1 21/n 1 | 5.63213; 5.60804; 7.9266 90; 89.962; 90 | 250.36 | Day, Bradley E.; Bley, Nicholas D.; Jones, Heather R.; McCullough, Ryan M.; Eng, Hank W.; Porter, Spencer H.; Woodward, Patrick M.; Barnes, Paris W. Structures of ordered tungsten- or molybdenum-containing quaternary perovskite oxides Journal of Solid State Chemistry, 2012, 185, 107-116 |
| 9015692 | CIF | Cr2 O3 | R -3 c :H | 4.714; 4.714; 13.029 90; 90; 120 | 250.738 | Kantor, A.; Kantor, I.; Merlini, M.; Glazyrin, K.; Prescher, C.; Hanfland, M.; Dubrovinsky, L. High-pressure structural studies of eskolaite by means of single-crystal X-ray diffraction Note: P = 44.8 GPa American Mineralogist, 2012, 97, 1764-1770 |
| 1562939 | CIF | Co0.6666 La0.9999 O2.9997 Sb0.3333 | P 1 21/n 1 | 5.60457; 5.66639; 7.9448 90; 89.995; 90 | 252.308 | Franco, D.G.; Fuertes, V.C.; Blanco, M.C.; Fernández-Díaz, M.T.; Sánchez, R.D.; Carbonio, R.E. Synthesis, structure and magnetic properties of La3Co2SbO9: A double perovskite with competing antiferromagnetic and ferromagnetic interactions Journal of Solid State Chemistry, 2012, 194, 385-391 |
| 9014261 | CIF | Cr2 O3 | R -3 c :H | 4.737; 4.737; 13.071 90; 90; 120 | 254.007 | Kantor, A.; Kantor, I.; Merlini, M.; Glazyrin, K.; Prescher, C.; Hanfland, M.; Dubrovinsky, L. High-pressure structural studies of eskolaite by means of single-crystal X-ray diffraction Note: P = 39.7 GPa American Mineralogist, 2012, 97, 1764-1770 |
| 1562937 | CIF | Co0.6666 La0.9999 O2.9997 Sb0.3333 | P 1 21/n 1 | 5.61685; 5.68375; 7.9597 90; 89.997; 90 | 254.112 | Franco, D.G.; Fuertes, V.C.; Blanco, M.C.; Fernández-Díaz, M.T.; Sánchez, R.D.; Carbonio, R.E. Synthesis, structure and magnetic properties of La3Co2SbO9: A double perovskite with competing antiferromagnetic and ferromagnetic interactions Journal of Solid State Chemistry, 2012, 194, 385-391 |
| 1562938 | CIF | Co0.6666 La0.9999 O2.9997 Sb0.3333 | P 1 21/n 1 | 5.6196; 5.68299; 7.965 90; 90.003; 90 | 254.371 | Franco, D.G.; Fuertes, V.C.; Blanco, M.C.; Fernández-Díaz, M.T.; Sánchez, R.D.; Carbonio, R.E. Synthesis, structure and magnetic properties of La3Co2SbO9: A double perovskite with competing antiferromagnetic and ferromagnetic interactions Journal of Solid State Chemistry, 2012, 194, 385-391 |
| 9015600 | CIF | C Ca0.147 O3 Sr0.853 | P m c n | 5.0914; 8.3519; 5.9901 90; 90; 90 | 254.716 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 300 K American Mineralogist, 2012, 97, 707-712 |
| 4506047 | CIF | C4 H4 N2 O S | P -1 | 4.2484; 5.9704; 10.566 105.734; 94.894; 91.898 | 256.58 | Jarzembska, Katarzyna N.; Kubsik, Marcin; Kamiński, Radosław; Woźniak, Krzysztof; Dominiak, Paulina M. From a Single Molecule to Molecular Crystal Architectures: Structural and Energetic Studies of Selected Uracil Derivatives Crystal Growth & Design, 2012, 12, 2508 |
| 9014594 | CIF | Cr2 O3 | R -3 c :H | 4.756; 4.756; 13.109 90; 90; 120 | 256.793 | Kantor, A.; Kantor, I.; Merlini, M.; Glazyrin, K.; Prescher, C.; Hanfland, M.; Dubrovinsky, L. High-pressure structural studies of eskolaite by means of single-crystal X-ray diffraction Note: P = 35.4 GPa American Mineralogist, 2012, 97, 1764-1770 |
| 1563081 | CIF | Ca3 O6 W | P 1 21/n 1 | 5.55175; 5.81004; 8.0066 90; 90.1915; 90 | 258.26 | Day, Bradley E.; Bley, Nicholas D.; Jones, Heather R.; McCullough, Ryan M.; Eng, Hank W.; Porter, Spencer H.; Woodward, Patrick M.; Barnes, Paris W. Structures of ordered tungsten- or molybdenum-containing quaternary perovskite oxides Journal of Solid State Chemistry, 2012, 185, 107-116 |
| 2234344 | CIF HKL Paper | C10 H12 N2 O4 | P -1 | 4.9542; 6.4194; 8.418 79.29; 79.351; 88.64 | 258.51 | Li, Zhi 1,4-Phenylenebis(methylene) dicarbamate Acta Crystallographica Section E, 2012, 68, o1227 |
| 1562945 | CIF | Cl3 Cs Ni | P 63/m m c | 7.1185; 7.1185; 5.9085 90; 90; 120 | 259.289 | Raw, Adam D.; Ibers, James A.; Poeppelmeier, Kenneth R. Syntheses and structure of hydrothermally prepared CsNiX3 (X=Cl, Br, I) Journal of Solid State Chemistry, 2012, 192, 34-37 |
| 9014203 | CIF | Cr2 O3 | R -3 c :H | 4.785; 4.785; 13.162 90; 90; 120 | 260.986 | Kantor, A.; Kantor, I.; Merlini, M.; Glazyrin, K.; Prescher, C.; Hanfland, M.; Dubrovinsky, L. High-pressure structural studies of eskolaite by means of single-crystal X-ray diffraction Note: P = 29.6 GPa American Mineralogist, 2012, 97, 1764-1770 |
| 4118236 | CIF | Ba0.8 Fe O2 Sr0.2 | P 4/m m m | 8.30167; 8.30167; 3.84632 90; 90; 90 | 265.08 | Takafumi Yamamoto; Yoji Kobayashi; Naoaki Hayashi; Cédric Tassel; Takashi Saito; Shoji Yamanaka; Mikio Takano; Kenji Ohoyama; Yuichi Shimakawa; Kazuyoshi Yoshimura; Hiroshi Kageyama (Sr1-xBax)FeO2 (0.4 <=x<= 1): A New Oxygen-Deficient Perovskite Structure Journal of the American Chemical Society, 2012, 134, 11444-11454 |
| 9015653 | CIF | Cr2 O3 | R -3 c :H | 4.8152; 4.8152; 13.242 90; 90; 120 | 265.897 | Kantor, A.; Kantor, I.; Merlini, M.; Glazyrin, K.; Prescher, C.; Hanfland, M.; Dubrovinsky, L. High-pressure structural studies of eskolaite by means of single-crystal X-ray diffraction Note: P = 24.1 GPa American Mineralogist, 2012, 97, 1764-1770 |
| 2234591 | CIF HKL Paper | B2 Na3 O6 Sc | P 1 21/c 1 | 5.0739; 8.993; 7.029 90; 123.6; 90 | 267.14 | Fang, Jinzhi; Zhang, Xinyuan; Yao, Jiyong; Zhang, Guochun; Wang, Kunpeng Trisodium scandium bis(orthoborate) Acta Crystallographica Section E, 2012, 68, i36 |
| 9016563 | CIF | Cr2 O3 | R -3 c :H | 4.8273; 4.8273; 13.264 90; 90; 120 | 267.679 | Kantor, A.; Kantor, I.; Merlini, M.; Glazyrin, K.; Prescher, C.; Hanfland, M.; Dubrovinsky, L. High-pressure structural studies of eskolaite by means of single-crystal X-ray diffraction Note: P = 20.4 GPa American Mineralogist, 2012, 97, 1764-1770 |
| 2236697 | CIF HKL Paper | Ba Be2 O7 Si2 | P m n 21 | 11.6491; 4.9175; 4.6746 90; 90; 90 | 267.78 | Domizio, Adrien J. Di; Downs, Robert T.; Yang, Hexiong Redetermination of clinobarylite, BaBe~2~Si~2~O~7~ Acta Crystallographica Section E, 2012, 68, i78-i79 |
| 9016604 | CIF | C Ca0.001 O3 Pb | P m c n | 5.182; 8.4953; 6.1436 90; 90; 90 | 270.458 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 300 K American Mineralogist, 2012, 97, 707-712 |
| 4328405 | CIF | Nb6 Sn6 Y | P 6/m m m | 5.7498; 5.7498; 9.5003 90; 90; 120 | 272 | Cheng-Yang Yue; Xiao-Wu Lei Syntheses and Structures of Sc2Nb4-xSn5, YNb6Sn6, and ErNb6Sn5: Exploratory Studies in Ternary Rare-Earth Niobium Stannides Inorganic Chemistry, 2012, 51, 2461-2471 |
| 4506592 | CIF | Ag1.56 Mn8 O16 | I 4/m | 9.756; 9.756; 2.858 90; 90; 90 | 272 | Takeuchi, Kenneth J.; Yau, Shali Z.; Menard, Melissa C.; Marschilok, Amy C.; Takeuchi, Esther S. Synthetic control of composition and crystallite size of silver hollandite, Ag(x)Mn8O16: impact on electrochemistry. ACS applied materials & interfaces, 2012, 4, 5547-5554 |
| 2234341 | CIF HKL Paper | C11.12 H7.12 Cu N2.88 O4 | P -1 | 5.1912; 7.3362; 8.076 72.38; 73.35; 72.06 | 272.47 | Albanez, Joselyn; Brito, Iván; Cárdenas, Alejandro; López-Rodríguez, Matías Disorder in the anionic part of <i>catena</i>-poly[[(pyrazine-2-carboxylato)copper(II)]-μ-pyrazine-2-carboxylato] Acta Crystallographica Section E, 2012, 68, m498-m499 |
| 9014432 | CIF | Cr2 O3 | R -3 c :H | 4.8645; 4.8645; 13.355 90; 90; 120 | 273.685 | Kantor, A.; Kantor, I.; Merlini, M.; Glazyrin, K.; Prescher, C.; Hanfland, M.; Dubrovinsky, L. High-pressure structural studies of eskolaite by means of single-crystal X-ray diffraction Note: P = 14.0 GPa American Mineralogist, 2012, 97, 1764-1770 |
| 4329009 | CIF | C0.1 B0.9 Ba2 Cl1.1 O3 | P -3 m 1 | 5.4708; 5.4708; 10.64 90; 90; 120 | 275.79 | Jing Zhao; R. K. Li Ba2(BO3)1-x(CO3)xCl1+x: A Mixed Borate and Carbonate Chloride Crystallized from High-Temperature Solution Inorganic Chemistry, 2012, 51, 4568-4571 |
| 4118396 | CIF | Eu1.6 Ge2 Pb Sr0.4 | C m m m | 3.989; 15.243; 4.5365 90; 90; 90 | 275.84 | Nian-Tzu Suen; James Hooper; Eva Zurek; Svilen Bobev On the Nature of Ge-Pb Bonding in the Solid State. Synthesis, Structural Characterization, and Electronic Structures of Two Unprecedented Germanide-Plumbides Journal of the American Chemical Society, 2012, 134, 12708-12716 |
| 4506591 | CIF | Ag1.15 Mn8 O16 | I 4/m | 9.831; 9.831; 2.872 90; 90; 90 | 277.6 | Takeuchi, Kenneth J.; Yau, Shali Z.; Menard, Melissa C.; Marschilok, Amy C.; Takeuchi, Esther S. Synthetic control of composition and crystallite size of silver hollandite, Ag(x)Mn8O16: impact on electrochemistry. ACS applied materials & interfaces, 2012, 4, 5547-5554 |
| 7208191 | CIF | C12 H10 N2 O4 | P -1 | 3.81056; 7.07204; 11.50344 94.9505; 93.5324; 115.275 | 277.604 | Arhangelskis, Mihails; Lloyd, Gareth O.; Jones, William Mechanochemical synthesis of pyrazine:dicarboxylic acid cocrystals and a study of dissociation by quantitative phase analysis CrystEngComm, 2012, 14, 5203 |
| 9014810 | CIF | Cr2 O3 | R -3 c :H | 4.8949; 4.8949; 13.432 90; 90; 120 | 278.714 | Kantor, A.; Kantor, I.; Merlini, M.; Glazyrin, K.; Prescher, C.; Hanfland, M.; Dubrovinsky, L. High-pressure structural studies of eskolaite by means of single-crystal X-ray diffraction Note: P = 8.1 GPa American Mineralogist, 2012, 97, 1764-1770 |
| 9016123 | CIF | As2 H10 Mn3 O14 | P 1 | 5.5828; 9.766; 5.5455 94.467; 111.348; 93.85 | 279.26 | Callegari, A. M.; Boiocchi, M.; Ciriotti, M. E.; Balestra, C. Coralloite, Mn2+Mn3+2(AsO4)2(OH)2*4H2O, a new mixed valence Mn hydrate arsenate: crystal structure and relationships with bermanite and whitmoreite mineral groups American Mineralogist, 2012, 97, 727-734 |
| 2233659 | CIF HKL Paper | Hg2 I2 | I 4/m m m | 4.8974; 4.8974; 11.649 90; 90; 90 | 279.4 | Kars, Mohammed; Roisnel, Thierry; Dorcet, Vincent; Rebbah, Allaoua; Carlos, Otero-Diáz L. Redetermination of Hg~2~I~2~ Acta Crystallographica, Section E: Structure Reports Online, 2012, 68, i11-i11 |
| 4328186 | CIF | Au4.43 Ga7.57 K2 | I m m m | 4.407; 7.339; 8.664 90; 90; 90 | 280.22 | Volodymyr Smetana; John D. Corbett; Gordon J. Miller Four Polyanionic Compounds in the K-Au-Ga System: A Case Study in Exploratory Synthesis and of the Art of Structural Analysis Inorganic Chemistry, 2012, 51, 1695-1702 |
| 9016634 | CIF | Al0.5 Nb0.5 O2 | C 1 2/m 1 | 12.1545; 3.735; 6.4884 90; 107.62; 90 | 280.735 | Ardit, M.; Dondi, M.; Cruciani, G. Structural stability, cation ordering, and local relaxation along the AlNbO4-Al0.5Cr0.5NbO4 join Note: Sample label: N00 American Mineralogist, 2012, 97, 910-917 |
| 4027001 | CIF | C11 H17 N O3 | P 1 | 5.8915; 6.4911; 8.4228 107.971; 101.168; 105.691 | 281.14 | Adele E. Pasqua; James J. Crawford; De-Liang Long; Rodolfo Marquez Protecting Group Free, Stereocontrolled Synthesis of β-Halo-enamides Journal of Organic Chemistry, 2012, 77, 2149-2158 |
| 9016072 | CIF | Al0.94 Cr0.06 Nb O4 | C 1 2/m 1 | 12.162; 3.7454; 6.491 90; 107.64; 90 | 281.772 | Ardit, M.; Dondi, M.; Cruciani, G. Structural stability, cation ordering, and local relaxation along the AlNbO4-Al0.5Cr0.5NbO4 join Note: Sample label: N06 American Mineralogist, 2012, 97, 910-917 |
| 7208242 | CIF | C3 H4 Li O5 S | P -1 | 4.8192; 7.1534; 8.3947 92.21; 93.66; 101.87 | 282.23 | Wan, Wang; Zhu, Zhi-Biao; Huo, Li-Hua; Deng, Zhao-Peng; Zhao, Hui; Gao, Shan Syntheses, structures and luminescent properties of lithium(i)-sulfonate complexes constructed from ortho-hydroxyl arenedisulfonic acids: structural evolution tuned by the pH, coordination geometry and modes CrystEngComm, 2012, 14, 5274 |
| 2236005 | CIF HKL Paper | C4 H8 Co N6 S4 | P -1 | 3.855; 7.585; 10.094 92.424; 98.172; 104.166 | 282.4 | Rajarajan, K.; Sendil Kumar, K.; Ramesh, V.; Shihabuddeen, V.; Murugavel, S. <i>catena</i>-Poly[[bis(thiocyanato-κ<i>N</i>)cobalt(II)]-di-μ-thiourea-κ^4^<i>S</i>:<i>S</i>] Acta Crystallographica Section E, 2012, 68, m1125-m1126 |
| 9014324 | CIF | Al0.875 Cr0.125 Nb O4 | C 1 2/m 1 | 12.1724; 3.755; 6.4957 90; 107.67; 90 | 282.894 | Ardit, M.; Dondi, M.; Cruciani, G. Structural stability, cation ordering, and local relaxation along the AlNbO4-Al0.5Cr0.5NbO4 join Note: Sample label: N12 American Mineralogist, 2012, 97, 910-917 |
| 9015325 | CIF | Al0.76 Cr0.24 Nb O4 | C 1 2/m 1 | 12.1881; 3.7726; 6.5033 90; 107.7; 90 | 284.872 | Ardit, M.; Dondi, M.; Cruciani, G. Structural stability, cation ordering, and local relaxation along the AlNbO4-Al0.5Cr0.5NbO4 join Note: Sample label: N25 American Mineralogist, 2012, 97, 910-917 |
| 9014885 | CIF | Al0.76 Cr0.24 Nb O4 | C 1 2/m 1 | 12.1886; 3.7748; 6.5033 90; 107.72; 90 | 285.018 | Ardit, M.; Dondi, M.; Cruciani, G. Structural stability, cation ordering, and local relaxation along the AlNbO4-Al0.5Cr0.5NbO4 join Note: Sample label: N37 American Mineralogist, 2012, 97, 910-917 |
| 9016399 | CIF | Hg Pt2 Se3 | P -3 m 1 | 7.3477; 7.3477; 5.2955 90; 90; 90 | 285.897 | Vymazalova, A.; Laufek, F.; Drabek, M.; Cabral, A. R.; Haloda, J.; Sidorinova, T.; Lehmann, B.; Galbiatti, H. F.; Drahokoupil, J. Jacutingaite, Pt2HgSe3, a new platinum-group mineral species from the Caue iron-ore deposit, Itabira District, Minas Gerais, Brazil Localiy: the Caue iron-ore deposit, Itabira District, Minas Gerais, Brazil The Canadian Mineralogist, 2012, 50, 431-440 |
| 7052848 | CIF | C7 H6 N2 | P 1 21 1 | 7.4285; 5.748; 7.6305 90; 118.462; 90 | 286.43 | González, J. J. L.; Ureña, F. P.; Moreno, J. R. A.; Mata, I.; Molins, E.; Claramunt, R. M.; López, C.; Alkorta, I.; Elguero, J. The chiral structure of 1H-indazoles in the solid state: a crystallographic, vibrational circular dichroism and computational study New Journal of Chemistry, 2012, 36, 749 |
| 4026855 | CIF | C16 H16 O | P -1 | 5.7182; 5.9604; 8.6336 96.773; 92.481; 99.717 | 287.41 | Prasad Ganji; Hasim Ibrahim Deoxygenation of Hydroquinones as a General Route to Norbornane-Fused Aromatic Systems: An Entry into Substituted and Functionalized Dimethano- and Methanoanthracenes Journal of Organic Chemistry, 2012, 77, 511-518 |
| 9016213 | CIF | Cr2 O3 | R -3 c :H | 4.953; 4.953; 13.5884 90; 90; 120 | 288.693 | Kantor, A.; Kantor, I.; Merlini, M.; Glazyrin, K.; Prescher, C.; Hanfland, M.; Dubrovinsky, L. High-pressure structural studies of eskolaite by means of single-crystal X-ray diffraction Note: P = 0 GPa, data from Ovsyannikov and Dubrovinsky (2011) American Mineralogist, 2012, 97, 1764-1770 |
| 4329846 | CIF | C H3 N6 Sb | P -1 | 5.7533; 6.9654; 7.9576 100.263; 107.369; 100.598 | 289.78 | Christian Hering; Mathias Lehmann; Axel Schulz; Alexander Villinger Chlorine/Methyl Exchange Reactions in Silylated Aminostibanes: A New Route To Stibinostibonium Cations Inorganic Chemistry, 2012, 51, 8212-8224 |
| 2018541 | CIF HKL Paper | Fe3.74 Li3.88 O16 P4 | P n m a | 10.306; 6.0041; 4.69281 90; 90; 90 | 290.383 | Dal Bo, Fabrice; Hatert, Frédéric Li~0.97~Fe^II^~0.79~Fe^III^~0.15~(PO~4~), a new oxidized triphylite-type phosphate Acta Crystallographica Section C, 2012, 68, i53-i54 |
| 1544624 | CIF | Fe0.38 Mg1.62 O4 Si | P b n m | 4.7686; 10.2542; 6.0036 90; 90; 90 | 293.565 | Ejima, T.; Akasaka, M.; Nagao, T.; Ohfuji, H. Oxidation state of Fe in olivine in andesitic scoria from Kasayama volcano, Hagi, Yamaguchi Prefecture, Japan Journal of Mineralogical and Petrological Sciences, 2012, 107, 215-225 |
| 9014301 | CIF | H0.5 K1.5 Mg2 O7 Si2 | P 63/m c m | 5.0646; 5.0646; 13.2379 90; 90; 120 | 294.063 | Welch, M. D.; Konzett, J.; Bindi, L.; Kohn, S. C.; Frost, D. J. New structural features of the high-pressure synthetic sheet-disilicate Phase-X, K(2-x)Mg2Si2O7Hx American Mineralogist, 2012, 97, 1849-1857 |
| 8103312 | CIF | C4 H7 Cs N8 S2 | P -1 | 6.27; 6.41; 8.97 69.6; 73.99; 61.6 | 294.58 | Shijun Chen Crystal structure of catena-(m4-1-methyl-1H-1,2,3,4-tetrazole-5-thiolato)cesium(I), Cs(C2H3.5N4S)2 Zeitschrift für Kristallographie - New Crystal Structures, 2012, 227, 213 |
| 4330457 | CIF | Cu3.03 Mn2 O4 Se4 Sr4 | I 4/m m m | 4.06894; 4.06894; 17.876 90; 90; 90 | 295.96 | Shifeng Jin; Xiaolong Chen; Jiangang Guo; Ming Lei; Jingjing Lin; Jianguo Xi; Wenjun Wang; Wanyan Wang Sr2Mn3Sb2O2 Type Oxyselenides: Structures, Magnetism, and Electronic Properties of Sr2AO2M2Se2 (A = Co, Mn; M = Cu, Ag) Inorganic Chemistry, 2012, 51, 10185-10192 |
| 9015031 | CIF | Dy0.03 Er0.05 Gd0.02 H2 O4 Si0.73 Y0.78 Yb0.12 | I -4 2 d | 6.947; 6.947; 6.133 90; 90; 90 | 295.984 | Malcherek, T.; Mihailova, B.; Schluter, J.; Husdal, T. Atelisite-(Y), a new rare earth defect silicate of the KDP structure type European Journal of Mineralogy, 2012, 24, 1053-1060 |
| 1563079 | CIF | Ba2 Ca O6 W | I 4/m | 5.93741; 5.93741; 8.4015 90; 90; 90 | 296.18 | Day, Bradley E.; Bley, Nicholas D.; Jones, Heather R.; McCullough, Ryan M.; Eng, Hank W.; Porter, Spencer H.; Woodward, Patrick M.; Barnes, Paris W. Structures of ordered tungsten- or molybdenum-containing quaternary perovskite oxides Journal of Solid State Chemistry, 2012, 185, 107-116 |
| 1562944 | CIF | Br3 Cs Ni | P 63/m m c | 7.4312; 7.4312; 6.2023 90; 90; 120 | 296.621 | Raw, Adam D.; Ibers, James A.; Poeppelmeier, Kenneth R. Syntheses and structure of hydrothermally prepared CsNiX3 (X=Cl, Br, I) Journal of Solid State Chemistry, 2012, 192, 34-37 |
| 2235168 | CIF HKL Paper | C4 H7 N3 S | P 1 21/m 1 | 5.0922; 6.7526; 8.6578 90; 90.17; 90 | 297.7 | Jing, Bi; Du, Yuao-Chao; Zhu, Ai-Xin 3-Ethyl-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione Acta Crystallographica Section E, 2012, 68, o1802 |
| 4118937 | CIF | C Na3 Ni O7 P | P 1 21/m 1 | 8.82621; 6.586832; 5.127293 90; 89.2669; 90 | 298.06 | Hailong Chen; Geoffroy Hautier; Gerbrand Ceder Synthesis, Computed Stability, and Crystal Structure of a New Family of Inorganic Compounds: Carbonophosphates Journal of the American Chemical Society, 2012, 134, 19619-19627 |
| 1563032 | CIF | Er2 O2 S3 U | I 4/m m m | 3.7876; 3.7876; 20.7971 90; 90; 90 | 298.35 | Raw, Adam D.; Ibers, James A. Synthesis and structural characterization of the new compound UEr2O2S3 and the evidence for the old compound U2ErO2S3 Journal of Solid State Chemistry, 2012, 187, 282-285 |
| 1563033 | CIF | Er2 O2 S3 U | I 4/m m m | 3.785; 3.785; 20.83 90; 90; 90 | 298.42 | Raw, Adam D.; Ibers, James A. Synthesis and structural characterization of the new compound UEr2O2S3 and the evidence for the old compound U2ErO2S3 Journal of Solid State Chemistry, 2012, 187, 282-285 |
| 9014292 | CIF | Fe0.195 Li0.748 Mn0.8 O4 P | P b n m | 4.7651; 10.3379; 6.0595 90; 90; 90 | 298.498 | Hatert, F.; Ottolini, L.; Wouters, J.; Fontan, F. A structural study of the lithiophilite-sicklerite series Sample 5, deep orange The Canadian Mineralogist, 2012, 50, 843-854 |
| 7152121 | CIF | C6 H8 O4 | P 1 21 1 | 6.1357; 5.1847; 9.4064 90; 93.064; 90 | 298.81 | Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride. Organic & biomolecular chemistry, 2012, 10, 394-403 |
| 4118935 | CIF | C Cu Na3 O7 P | P 1 21/m 1 | 9.0079; 6.43969; 5.16525 90; 88.942; 90 | 299.58 | Hailong Chen; Geoffroy Hautier; Gerbrand Ceder Synthesis, Computed Stability, and Crystal Structure of a New Family of Inorganic Compounds: Carbonophosphates Journal of the American Chemical Society, 2012, 134, 19619-19627 |
| 8103305 | CIF | Ba3 N8 O6 P6 | P -3 | 7.40227; 7.40227; 6.31436 90; 90; 120 | 299.633 | Stefan J. Sedlmaier; Daniel Weber; Wolfgang Schnick Crystal structure of barium oxonitridophosphate, Ba3P6O6N8 Zeitschrift für Kristallographie - New Crystal Structures, 2012, 227, 1 |
| 4506743 | CIF | C14 H8 Ag N3 O4 | P -1 | 3.7843; 7.7515; 10.297 92.957; 95.118; 92.835 | 300 | Tao, Tao; Lei, Yan-Hua; Peng, Yu-Xin; Wang, Ying; Huang, Wei; Chen, Zhao-Xu; You, Xiao-Zeng The First Observation of One-Dimensional Naphthalenediimidato-Based Transition-Metal Coordination Polymers: Syntheses, Crystal Structures and Properties Crystal Growth & Design, 2012, 12, 4580 |
| 9015172 | CIF | Fe0.2 Li0.84 Mn0.8 O4 P | P b n m | 4.7403; 10.4145; 6.0795 90; 90; 90 | 300.132 | Hatert, F.; Ottolini, L.; Wouters, J.; Fontan, F. A structural study of the lithiophilite-sicklerite series Sample 3, yellow The Canadian Mineralogist, 2012, 50, 843-854 |
| 7019634 | CIF | C6 H14 Ga2 S4 | P -1 | 6.6025; 6.7608; 7.1157 73.926; 80.799; 83.692 | 300.57 | Kluge, Oliver; Friedrich, Dirk; Wagner, Gerald; Krautscheid, Harald New organometallic single-source precursors for CuGaS(2)- polytypism in gallite nanocrystals obtained by thermolysis. Dalton transactions (Cambridge, England : 2003), 2012, 41, 8635-8642 |
| 4329524 | CIF | Cd O3.9433 Rh2 | P n m a | 9.12016; 3.05648; 10.785 90; 90; 90 | 300.638 | Xia Wang; Yanfeng Guo; Youguo Shi; Alexei A. Belik; Yoshihiro Tsujimoto; Wei Yi; Ying Sun; Yuichi Shirako; Masao Arai; Masaki Akaogi; Yoshitaka Matsushita; Kazunari Yamaura High-Pressure Synthesis, Crystal Structure, and Electromagnetic Properties of CdRh2O4: an Analogous Oxide of the Postspinel Mineral MgAl2O4 Inorganic Chemistry, 2012, 51, 6868-6875 |
| 9014354 | CIF | Fe0.183 Li0.86 Mn0.8 O4 P | P b n m | 4.734; 10.423; 6.094 90; 90; 90 | 300.693 | Hatert, F.; Ottolini, L.; Wouters, J.; Fontan, F. A structural study of the lithiophilite-sicklerite series Sample 2, light yellow The Canadian Mineralogist, 2012, 50, 843-854 |
| 9015611 | CIF | Fe0.183 Li0.91 Mn0.8 O4 P | P b n m | 4.736; 10.432; 6.088 90; 90; 90 | 300.783 | Hatert, F.; Ottolini, L.; Wouters, J.; Fontan, F. A structural study of the lithiophilite-sicklerite series Sample 1, colorless The Canadian Mineralogist, 2012, 50, 843-854 |
| 1543079 | CIF | Ag4 Mg4 Sb4 | F -4 3 m | 6.7004; 6.7004; 6.7004 90; 90; 90 | 300.817 | Kirkham, Melanie J.; dos Santos, Antonio M.; Rawn, Claudia J.; Lara-Curzio, Edgar; Sharp, Jeff W.; Thompson, Alan J. Abinitio determination of crystal structures of the thermoelectric material MgAgSb Physical Review B, 2012, 85, 144120 |
| 4330455 | CIF | Co Cu2 O2 Se2 Sr2 | I 4/m m m | 4.048762; 4.048762; 18.3571 90; 90; 90 | 300.918 | Shifeng Jin; Xiaolong Chen; Jiangang Guo; Ming Lei; Jingjing Lin; Jianguo Xi; Wenjun Wang; Wanyan Wang Sr2Mn3Sb2O2 Type Oxyselenides: Structures, Magnetism, and Electronic Properties of Sr2AO2M2Se2 (A = Co, Mn; M = Cu, Ag) Inorganic Chemistry, 2012, 51, 10185-10192 |
| 4118939 | CIF | C Mg Na3 O7 P | P 1 21/m 1 | 8.82663; 6.61646; 5.15605 90; 89.6919; 90 | 301.114 | Hailong Chen; Geoffroy Hautier; Gerbrand Ceder Synthesis, Computed Stability, and Crystal Structure of a New Family of Inorganic Compounds: Carbonophosphates Journal of the American Chemical Society, 2012, 134, 19619-19627 |
| 9014497 | CIF | Fe0.18 Li0.76 Mn0.8 O4 P | P b n m | 4.767; 10.403; 6.072 90; 90; 90 | 301.117 | Hatert, F.; Ottolini, L.; Wouters, J.; Fontan, F. A structural study of the lithiophilite-sicklerite series Sample 4, orange The Canadian Mineralogist, 2012, 50, 843-854 |
| 7152126 | CIF | C6 H7 F O3 | P 1 21 1 | 6.1181; 7.1297; 6.9272 90; 94.628; 90 | 301.18 | Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride. Organic & biomolecular chemistry, 2012, 10, 394-403 |
| 1546383 | CIF | Fe2 O3 | R -3 c :H | 5.03; 5.03; 13.75 90; 90; 120 | 301.279 | El Mendili, Yassine; Bardeau, Jean-François; Randrianantoandro, Nirina; Grasset, Fabien; Greneche, Jean-Marc Insights into the Mechanism Related to the Phase Transition from α-Fe2O3 to γ-Fe2O3 Nanoparticles Induced by Thermal Treatment and Laser Irradiation The Journal of Physical Chemistry C, 2012, 116, 23785-23792 |
| 2235021 | CIF HKL Paper | C6 H20 Br2 N2 O2 | P -1 | 6.2975; 7.018; 7.2143 71.54; 86.62; 85.54 | 301.32 | Sun, Su-Wen 1,4-Dimethylpiperazine-1,4-diium dibromide dihydrate Acta Crystallographica Section E, 2012, 68, o1703 |
| 2105299 | CIF Paper | C2 H4 K O6 P | P 1 21 1 | 7.842; 4.577; 8.56 90; 100.04; 90 | 302.5 | Mermer, Adrian; Starynowicz, Przemysław Charge-density distribution in potassium dihydrogen phosphoglycolate ‒ a comparison of phosphate and phosphonate groups Acta Crystallographica Section B, 2012, 68, 625-635 |
| 4118936 | CIF | C Co Na3 O7 P | P 1 21/m 1 | 8.89282; 6.61758; 5.1456 90; 89.4853; 90 | 302.801 | Hailong Chen; Geoffroy Hautier; Gerbrand Ceder Synthesis, Computed Stability, and Crystal Structure of a New Family of Inorganic Compounds: Carbonophosphates Journal of the American Chemical Society, 2012, 134, 19619-19627 |
| 2310002 | CIF Paper | C2 H5 N O2 | P 1 21/n 1 | 5.087; 11.773; 5.46 90; 111.99; 90 | 303.21 | Mondal, Swastik; Prathapa, Siriyara Jagannatha; van Smaalen, Sander Experimental dynamic electron densities of multipole models at different temperatures Acta Crystallographica Section A, 2012, 68, 568-581 |
| 7019865 | CIF | S3 Tl2 Zr | P 1 21/m 1 | 7.9159; 3.7651; 10.2756 90; 97.476; 90 | 303.65 | Sankar, Cheriyedath Raj; Kuropatwa, Bryan A.; Assoud, Abdeljalil; Kleinke, Holger Structures and properties of the ternary thallium chalcogenides Tl(2)MQ(3) (M = Zr, Hf; Q = S, Se). Dalton transactions (Cambridge, England : 2003), 2012, 41, 9646-9650 |
| 9016592 | CIF | C Ba0.981 O3 Sr0.019 | P m c n | 5.3193; 8.9056; 6.4353 90; 90; 90 | 304.85 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 300 K American Mineralogist, 2012, 97, 707-712 |
| 4118940 | CIF | C Fe Na3 O7 P | P 1 21/m 1 | 8.95419; 6.61129; 5.16023 90; 89.6001; 90 | 305.472 | Hailong Chen; Geoffroy Hautier; Gerbrand Ceder Synthesis, Computed Stability, and Crystal Structure of a New Family of Inorganic Compounds: Carbonophosphates Journal of the American Chemical Society, 2012, 134, 19619-19627 |
| 9016593 | CIF | Ba0.001 Fe0.001 O4 S Sr0.966 | P b n m | 6.87032; 8.3603; 5.34732 90; 90; 90 | 307.139 | Antao, S. M. Structural trends for celestite (SrSO4), anglesite (PbSO4), and barite (BaSO4): confirmation of expected variations within SO4 groups American Mineralogist, 2012, 97, 661-665 |
| 9014859 | CIF | Fe0.85 Mg0.49 Mn1.66 O8 P2 | P 1 21/c 1 | 6.088; 4.814; 10.484 90; 89.42; 90 | 307.245 | Hatert, F.; Roda-Robles E; de Parseval, P.; Wouters, J. Zavaliaite, (Mn2+,Fe2+,Mg)3(PO4)2, a new member of the sarcopside group from La Empleada pegmatite, San Luis Province, Argentina The Canadian Mineralogist, 2012, 50, 1445-1452 |
| 4027304 | CIF | C14 H4 F6 N4 | P -1 | 4.693; 8.435; 8.485 103.867; 102.721; 99.713 | 309.3 | Sonja Geib; Susanne C. Martens; Ute Zschieschang; Florian Lombeck; Hubert Wadepohl; Hagen Klauk; Lutz H. Gade 1,3,6,8-Tetraazapyrenes: Synthesis, Solid-State Structures, and Properties as Redox-Active Materials Journal of Organic Chemistry, 2012, 77, 6107-6116 |
| 7207028 | CIF | C6 H20 Cu N4 O6 | P -1 | 6.4347; 6.917; 7.7596 90.268; 107.581; 108.201 | 310.89 | Keene, Tony D.; Hursthouse, Michael B.; Price, Daniel J. Recurrent H-bond graph motifs between metal tris-ethylenediamine cations and uncoordinated oxalate anions: Fitting a three pin plug into a two pin socket CrystEngComm, 2012, 14, 116 |
| 2018728 | CIF HKL Paper | C11 H20 N2 O3 | P 1 | 6.006; 6.8782; 7.9717 90.202; 98.272; 107.193 | 310.96 | Kiyotani, Tamiko; Sugawara, Yoko <small>L</small>-Leucylglycine 0.67-hydrate and [(4<i>S</i>)-2,2-dimethyl-4-(2-methylpropyl)-5-oxoimidazolidin-3-ium-1-yl]acetate Acta Crystallographica Section C, 2012, 68, o498-o501 |
| 4331457 | CIF | Gd0.571 Mo Na0.286 O4 | I -4(\a\-b0,\b\a0)00 | 5.2127; 5.2127; 11.4523 90; 90; 90 | 311.18 | Vladimir A. Morozov; Alla V. Arakcheeva; Boris S. Redkin; Vitaliy V. Sinitsyn; Salavat S. Khasanov; Elena V. Kudrenko; Maria V. Raskina; Oleg I. Lebedev; Gustaaf Van Tendeloo Na2/7Gd4/7MoO4: a Modulated Scheelite-Type Structure and Conductivity Properties Inorganic Chemistry, 2012, 51, 5313-5324 |
| 7152120 | CIF | C6 H8 O4 | P 1 21 1 | 6.6936; 7.0452; 6.707 90; 99.357; 90 | 312.08 | Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride. Organic & biomolecular chemistry, 2012, 10, 394-403 |
| 7207135 | CIF | C6 H10 N4 O8 S2 Zn | P -1 | 7.2109; 7.3813; 7.3993 61.433; 66.1; 71.148 | 312.1 | Fernando, Isurika R.; Jianrattanasawat, Sarut; Daskalakis, Nikos; Demadis, Konstantinos D.; Mezei, Gellert Mapping the supramolecular chemistry of pyrazole-4-sulfonate: layered inorganic‒organic networks with Zn2+, Cd2+, Ag+, Na+ and NH4+, and their use in copper anticorrosion protective films CrystEngComm, 2012, 14, 908 |
| 2105049 | CIF HKL Paper | Li0.63 Zn0.87 | R -3 m :H | 4.386; 4.386; 18.738 90; 90; 120 | 312.2 | Pavlyuk, Volodymyr; Chumak, Ihor; Ehrenberg, Helmut Polymorphism of Li~2~Zn~3~ Acta Crystallographica Section B, 2012, 68, 34-39 |
| 2234419 | CIF HKL Paper | C5 H8 N2 O | P -1 | 5.8916; 6.4349; 9.1263 95.659; 102.379; 109.859 | 312.27 | Xu, Jia-Ying; Cheng, Wei-Hua 2-Cyano-2-methylpropanamide Acta Crystallographica Section E, 2012, 68, o1250 |
| 4118938 | CIF | C Mn Na3 O7 P | P 1 21/m 1 | 8.98593; 6.73577; 5.15998 90; 90.1225; 90 | 312.318 | Hailong Chen; Geoffroy Hautier; Gerbrand Ceder Synthesis, Computed Stability, and Crystal Structure of a New Family of Inorganic Compounds: Carbonophosphates Journal of the American Chemical Society, 2012, 134, 19619-19627 |
| 2233885 | CIF HKL Paper | C14 H8 Br2 N2 O2 | P -1 | 4.4177; 6.224; 11.841 94.455; 99.97; 100.859 | 312.865 | Seidel, Nadine; Seichter, Wilhelm; Weber, Edwin 1,5-Diamino-2,6-dibromo-9,10-anthraquinone Acta Crystallographica Section E, 2012, 68, o838 |
| 4330310 | CIF | C8 H12 Fe N2 O2 S2 | P -1 | 5.7215; 7.6941; 7.8456 109.864; 99.983; 97.286 | 313.41 | Endrit Shurdha; Saul H. Lapidus; Peter W. Stephens; Curtis E. Moore; Arnold L. Rheingold; Joel S. Miller Extended Network Thiocyanate- and Tetracyanoethanide-Based First-Row Transition Metal Complexes Inorganic Chemistry, 2012, 51, 9655-9665 |
| 4027647 | CIF | C6 H7 N3 O | P -1 | 5.6718; 7.7144; 8.1495 68.847; 80.1; 71.118 | 314.04 | Borys Ośmiałowski; Erkki Kolehmainen; Satu Ikonen; Arto Valkonen; Adam Kwiatkowski; Izabela Grela; Esa Haapaniemi 2-Acylamino- and 2,4-Bis(acylamino)pyrimidines as Supramolecular Synthons Analyzed by Multiple Noncovalent Interactions. DFT, X-ray Diffraction, and NMR Spectral Studies Journal of Organic Chemistry, 2012, 77, 9609-9619 |
| 7017702 | CIF | Ge3 Na P3 | P m c 21 | 3.6276; 8.4068; 10.332 90; 90; 90 | 315.09 | Feng, Kai; Yin, Wenlong; He, Ran; Lin, Zheshuai; Jin, Shifeng; Yao, Jiyong; Fu, Peizhen; Wu, Yicheng NaGe3P3: a new ternary germanium phosphide featuring an unusual [Ge3P7] ring. Dalton transactions (Cambridge, England : 2003), 2012, 41, 484-489 |
| 2233615 | CIF HKL Paper | Eu1.5 Li3.5 Mo4 O16 | P -1 | 5.2182; 6.7008; 10.3167 100.09; 100.341; 111.891 | 317.49 | Zhao, Dan; Zhu, Jing; Liang, Peng; Chang, Huan; He, Rong Lithium europium(III) molybdate(VI), Li~3.5~Eu~1.5~(MoO~4~)~4~ Acta Crystallographica Section E, 2012, 68, i14 |
| 9015524 | CIF | O4 Pb S | P b n m | 6.95802; 8.48024; 5.39754 90; 90; 90 | 318.486 | Antao, S. M. Structural trends for celestite (SrSO4), anglesite (PbSO4), and barite (BaSO4): confirmation of expected variations within SO4 groups American Mineralogist, 2012, 97, 661-665 |
| 7208241 | CIF | C3 H6 Li O6 S | P -1 | 6.3752; 7.1912; 8.2477 73.61; 68.38; 66.73 | 318.76 | Wan, Wang; Zhu, Zhi-Biao; Huo, Li-Hua; Deng, Zhao-Peng; Zhao, Hui; Gao, Shan Syntheses, structures and luminescent properties of lithium(i)-sulfonate complexes constructed from ortho-hydroxyl arenedisulfonic acids: structural evolution tuned by the pH, coordination geometry and modes CrystEngComm, 2012, 14, 5274 |
| 4327896 | CIF | Ge2 Li Sm | P n m a | 7.7638; 3.9014; 10.5243 90; 90; 90 | 318.78 | Svilen Bobev; Tae-Soo You; Nian-Tzu Suen; Shanta Saha; Richard Greene; Johnpierre Paglione Synthesis, Structure, Chemical Bonding, and Magnetism of the Series ReLiGe2 (RE= La-Nd, Sm, Eu) Inorganic Chemistry, 2012, 51, 620-628 |
| 2105140 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 12.582; 8.965; 2.9572 90; 107.05; 90 | 318.905 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 4330454 | CIF | Ag2.88 Mn2 O4 Se4 Sr4 | I 4/m m m | 4.08821; 4.08821; 19.1179 90; 90; 90 | 319.526 | Shifeng Jin; Xiaolong Chen; Jiangang Guo; Ming Lei; Jingjing Lin; Jianguo Xi; Wenjun Wang; Wanyan Wang Sr2Mn3Sb2O2 Type Oxyselenides: Structures, Magnetism, and Electronic Properties of Sr2AO2M2Se2 (A = Co, Mn; M = Cu, Ag) Inorganic Chemistry, 2012, 51, 10185-10192 |
| 4328659 | CIF HKL | Cu1.885 S4 Sn Zn1.058 | I -4 | 5.4344; 5.4344; 10.8337 90; 90; 90 | 319.948 | L. Choubrac; A. Lafond; C. Guillot-Deudon; Y. Moëlo; S. Jobic Structure Flexibility of the Cu2ZnSnS4 Absorber in Low-Cost Photovoltaic Cells: From the Stoichiometric to the Copper-Poor Compounds Inorganic Chemistry, 2012, 51, 3346-3348 |
| 9015880 | CIF | Fe3 H14 O16 P2 | P -1 | 7.989; 9.321; 4.629 97.34; 95.96; 108.59 | 320.184 | Chukanov, N. V.; Scholz, R.; Aksenov, S. M.; Rastsvetaeva, R. K.; Pekov, I. V.; Belakovskiy, D. I.; Krambrock, K.; Paniago, R. M.; Righi, A.; Martins, R. F.; Belotti, F. M.; Bermanec, V. Metavivianite, Fe2+Fe3+2(PO4)2(OH)2*6H2O: new data and formula revision Mineralogical Magazine, 2012, 76, 725-741 |
| 4328658 | CIF HKL | Cu2 S4 Sn Zn | I -4 | 5.4342; 5.4342; 10.8496 90; 90; 90 | 320.394 | L. Choubrac; A. Lafond; C. Guillot-Deudon; Y. Moëlo; S. Jobic Structure Flexibility of the Cu2ZnSnS4 Absorber in Low-Cost Photovoltaic Cells: From the Stoichiometric to the Copper-Poor Compounds Inorganic Chemistry, 2012, 51, 3346-3348 |
| 4330309 | CIF | C8 H12 Cr N2 O2 S2 | P -1 | 5.734; 7.769; 7.82 107.905; 99.027; 98.315 | 320.4 | Endrit Shurdha; Saul H. Lapidus; Peter W. Stephens; Curtis E. Moore; Arnold L. Rheingold; Joel S. Miller Extended Network Thiocyanate- and Tetracyanoethanide-Based First-Row Transition Metal Complexes Inorganic Chemistry, 2012, 51, 9655-9665 |
| 1563075 | CIF | O2 Se3 U Yb2 | I 4/m m m | 3.8534; 3.8534; 21.61 90; 90; 90 | 320.88 | Raw, Adam D.; Ibers, James A. Syntheses and crystal structures of the quaternary uranium lanthanide oxyselenides UYb2O2Se3 and U2Ln2O4Se3 (Ln=Pr, Sm, Gd) Journal of Solid State Chemistry, 2012, 186, 177-181 |
| 7107435 | CIF | C12 H10 Br2 Cd N2 | P -1 | 3.91426; 8.8696; 9.4343 79.568; 86.28; 86.248 | 320.97 | Mangayarkarasi Nagarathinam; Anjana Chanthapally; Saul Lapidus; Peter W. Stephens; Jagadese J. Vittal Mechanochemical Reactions of Coordination Polymers by Grinding with KBr Chem.Commun., 2012, 48, 2585 |
| 4506726 | CIF | C5 H6 N2 O2 S | P -1 | 4.9893; 7.0628; 9.7308 108.25; 94.716; 96.499 | 321.03 | Akiri, Kalyanachakravarthi; Cherukuvada, Suryanarayan; Rana, Soumendra; Nangia, Ashwini Crystal Structures of Pyridine Sulfonamides and Sulfonic Acids Crystal Growth & Design, 2012, 12, 4567 |
| 2105139 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 12.6235; 8.9926; 2.9704 90; 107.076; 90 | 322.33 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 4330682 | CIF HKL | Na0.5 O2 V | C 1 2/c 1 | 13.2991; 5.7104; 4.9713 90; 120.824; 90 | 324.21 | Christophe Didier; Marie Guignard; Jacques Darriet; Claude Delmas O'3-NaxVO2 System: A Superstructure for Na1/2VO2 Inorganic Chemistry, 2012, 51, 11007-11016 |
| 7214735 | CIF | C5 H8 O3 S | P -1 | 5.679; 5.8215; 10.7072 103.502; 93.207; 107.717 | 324.78 | Shishkin, Oleg V.; Medvediev, Volodymyr V.; Zubatyuk, Roman I.; Shyshkina, Olena O.; Kovalenko, Nataliya V.; Volovenko, Julian M. Role of different molecular fragments in formation of the supramolecular architecture of the crystal of 1,1-dioxo-tetrahydro-1λ6-thiopyran-3-one CrystEngComm, 2012, 14, 8698 |
| 4506959 | CIF | As2 O3 | P 1 21/n 1 | 8.0013; 4.5675; 9.0794 90; 101.639; 90 | 324.99 | Guńka, Piotr A.; Dranka, Maciej; Piechota, Jacek; Żukowska, Grażyna Z.; Zalewska, Aldona; Zachara, Janusz As2O3Polymorphs: Theoretical Insight into Their Stability and Ammonia Templated Claudetite II Crystallization Crystal Growth & Design, 2012, 12, 5663 |
| 7017761 | CIF | C12 H14 Cl2 N2 Pd | P -1 | 5.7438; 7.288; 8.4654 69.081; 79.744; 83.763 | 325.33 | Krogul, Agnieszka; Cedrowski, Jakub; Wiktorska, Katarzyna; Ozimiński, Wojciech P; Skupińska, Jadwiga; Litwinienko, Grzegorz Crystal structure, electronic properties and cytotoxic activity of palladium chloride complexes with monosubstituted pyridines. Dalton transactions (Cambridge, England : 2003), 2012, 41, 658-666 |
| 2105138 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 12.6665; 9.0153; 2.9827 90; 107.13; 90 | 325.492 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 4327895 | CIF | Ge2 Li Nd | P n m a | 7.773; 3.9361; 10.644 90; 90; 90 | 325.7 | Svilen Bobev; Tae-Soo You; Nian-Tzu Suen; Shanta Saha; Richard Greene; Johnpierre Paglione Synthesis, Structure, Chemical Bonding, and Magnetism of the Series ReLiGe2 (RE= La-Nd, Sm, Eu) Inorganic Chemistry, 2012, 51, 620-628 |
| 4330456 | CIF | Ag3.93 Co2 O4 Se4 Sr4 | I 4/m m m | 4.098; 4.098; 19.4316 90; 90; 90 | 326.327 | Shifeng Jin; Xiaolong Chen; Jiangang Guo; Ming Lei; Jingjing Lin; Jianguo Xi; Wenjun Wang; Wanyan Wang Sr2Mn3Sb2O2 Type Oxyselenides: Structures, Magnetism, and Electronic Properties of Sr2AO2M2Se2 (A = Co, Mn; M = Cu, Ag) Inorganic Chemistry, 2012, 51, 10185-10192 |
| 4506960 | CIF | As2 O3 | P 1 21/n 1 | 8.0131; 4.5717; 9.1154 90; 101.831; 90 | 326.84 | Guńka, Piotr A.; Dranka, Maciej; Piechota, Jacek; Żukowska, Grażyna Z.; Zalewska, Aldona; Zachara, Janusz As2O3Polymorphs: Theoretical Insight into Their Stability and Ammonia Templated Claudetite II Crystallization Crystal Growth & Design, 2012, 12, 5663 |
| 7208456 | CIF | C4 H8 N O4 S | P -1 | 5.2521; 6.5844; 10.3311 87.44; 77.032; 70.505 | 328.02 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 2233071 | CIF HKL Paper | C6 H5 N5 | P -1 | 5.6929; 7.7355; 8.6102 67.233; 80.755; 69.837 | 328.04 | Wang, Qian; Wang, Sheng; Wang, Yuan Yuan; Wang, Ying 2-(4<i>H</i>-1,2,4-Triazol-4-yl)pyrimidine Acta Crystallographica Section E, 2012, 68, o53 |
| 9014712 | CIF | Cu3 H8 Mo O8 | P 1 21/m 1 | 9.9904; 5.9934; 5.5255 90; 97.428; 90 | 328.071 | Yang, H.; Jenkins, R. A.; Thompson, R. M.; Downs, R. T.; Evans, S. H.; Bloch, E. M. Markascherite, Cu3(MoO4)(OH)4, a new mineral species polymorphic with szenicsite, from Copper Creek, Pinal County, Arizona, U.S.A. American Mineralogist, 2012, 97, 197-202 |
| 9017470 | CIF | Ca Mg O6 Si2 | P 1 21/c 1 | 9.053; 7.677; 4.751 90; 96.34; 90 | 328.175 | Plonka, A. M.; Dera, P.; Irmen, P.; Rivers, M. L.; Ehm, L.; Parise, J. B. Beta-diopside, a new ultrahigh-pressure polymorph of CaMgSi2O6 with six-coordinated silicon Note: P = 56.1 GPa Geophysical Research Letters, 2012, 39, L24307-4 |
| 7208640 | CIF | C14 H10 Cu N2 O8 | P -1 | 3.6687; 9.932; 10.204 114.093; 98.647; 97.244 | 328.2 | Chen, Xiaocui; Han, Shumin; Wang, Ruiyao Crystal engineering through charge-assisted hydrogen bonds, multiple C‒H⋯O bonds and π‒π stacking: from (H2bipy)[Cu(ox)2] to (H2bipy)[NaH(ox)2] and (H2bipy)[H2(ox)2] (H2bipy = 4,4′-bipyridin-1,1′-dium; ox = oxalate) CrystEngComm, 2012, 14, 6400 |
| 2105137 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 12.699; 9.039; 2.9943 90; 107.18; 90 | 328.369 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 4117532 | CIF HKL | Fe0.33 O Sc0.33 | R 3 c :H | 5.202475; 5.202475; 14.01449 90; 90; 120 | 328.494 | Man-Rong Li; Umut Adem; Sean R. C. McMitchell; Zhongling Xu; Chris I. Thomas; John E. Warren; Duong V. Giap; Hongjun Niu; Xinming Wan; Robert G. Palgrave; Florian Schiffmann; Furio Cora; Ben Slater; Tim L. Burnett; Markys G. Cain; Artem M. Abakumov; Gustaaf van Tendeloo; Michael F. Thomas; Matthew J. Rosseinsky; John B. Claridge A Polar Corundum Oxide Displaying Weak Ferromagnetism at Room Temperature Journal of the American Chemical Society, 2012, 134, 3737-3747 |
| 4117533 | CIF HKL | Fe6 | P 1 | 5.202432; 5.202446; 14.0145 90; 90; 119.999 | 328.494 | Man-Rong Li; Umut Adem; Sean R. C. McMitchell; Zhongling Xu; Chris I. Thomas; John E. Warren; Duong V. Giap; Hongjun Niu; Xinming Wan; Robert G. Palgrave; Florian Schiffmann; Furio Cora; Ben Slater; Tim L. Burnett; Markys G. Cain; Artem M. Abakumov; Gustaaf van Tendeloo; Michael F. Thomas; Matthew J. Rosseinsky; John B. Claridge A Polar Corundum Oxide Displaying Weak Ferromagnetism at Room Temperature Journal of the American Chemical Society, 2012, 134, 3737-3747 |
| 4327894 | CIF | Ge2 Li Pr | P n m a | 7.7846; 3.9509; 10.687 90; 90; 90 | 328.69 | Svilen Bobev; Tae-Soo You; Nian-Tzu Suen; Shanta Saha; Richard Greene; Johnpierre Paglione Synthesis, Structure, Chemical Bonding, and Magnetism of the Series ReLiGe2 (RE= La-Nd, Sm, Eu) Inorganic Chemistry, 2012, 51, 620-628 |
| 7208455 | CIF | C4 H8 N O4 S | P -1 | 5.254; 6.5904; 10.3425 87.327; 77.009; 70.477 | 328.73 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 4331380 | CIF | B Cl H5 N | C m c 21 | 6.7034; 5.9235; 8.292 90; 90; 90 | 329.26 | Hima K. Lingam; Cong Wang; Judith C. Gallucci; Xuenian Chen; Sheldon G. Shore New Syntheses and Structural Characterization of NH3BH2Cl and (BH2NH2)3 and Thermal Decomposition Behavior of NH3BH2Cl Inorganic Chemistry, 2012, 51, 13430-13436 |
| 7208454 | CIF | C4 H8 N O4 S | P -1 | 5.2563; 6.598; 10.3562 87.226; 76.973; 70.438 | 329.58 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 7208453 | CIF | C4 H8 N O4 S | P -1 | 5.2589; 6.6056; 10.3687 87.155; 76.947; 70.385 | 330.39 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 7208452 | CIF | C4 H8 N O4 S | P -1 | 5.2615; 6.6145; 10.3827 87.08; 76.924; 70.335 | 331.32 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 4330311 | CIF | C8 H12 Mn N2 O2 S2 | P -1 | 5.801; 7.874; 8.036 110.69; 99.104; 97.89 | 331.6 | Endrit Shurdha; Saul H. Lapidus; Peter W. Stephens; Curtis E. Moore; Arnold L. Rheingold; Joel S. Miller Extended Network Thiocyanate- and Tetracyanoethanide-Based First-Row Transition Metal Complexes Inorganic Chemistry, 2012, 51, 9655-9665 |
| 9014961 | CIF | As Cl2 H O3 Pb2 | P 1 21/m 1 | 6.4235; 5.5399; 9.321 90; 90.767; 90 | 331.663 | Siidra, O. I.; Chukanov, N. V.; Pekov, I. V.; Krivovichev, S. V.; Magganas, A.; Katerinopoulos, A.; Voudouris, P. Pb2(AsO2OH)Cl2, a new phase from the Lavrion ancient slags, Greece: occurrence and characterization Mineralogical Magazine, 2012, 76, 597-602 |
| 4329293 | CIF | Ca1.033 Ga3 La0.967 O7 | P -4 21 m | 7.9386; 7.9386; 5.2641 90; 90; 90 | 331.75 | Fengxia Wei; Tom Baikie; Tao An; Christian Kloc; Jun Wei; Tim J. White Crystal Chemistry of Melilite [CaLa]2[Ga]2[Ga2O7]2: a Five Dimensional Solid Electrolyte Inorganic Chemistry, 2012, 51, 5941-5949 |
| 4331458 | CIF | Ca1.033 Ga3 La0.967 O7 | P-42_1m(a,a,0)00s(-a,a,0)000 | 7.9386; 7.9386; 5.2641 90; 90; 90 | 331.75 | Fengxia Wei; Tom Baikie; Tao An; Christian Kloc; Jun Wei; Tim J. White Crystal Chemistry of Melilite [CaLa]2[Ga]2[Ga2O7]2: a Five Dimensional Solid Electrolyte Inorganic Chemistry, 2012, 51, 5941-5949 |
| 4117624 | CIF | C6 Ag3 K Mn N6 | P 3 1 2 | 6.8214; 6.8214; 8.2353 90; 90; 120 | 331.86 | Andrew B. Cairns; Amber L. Thompson; Matthew G. Tucker; Julien Haines; Andrew L. Goodwin Rational Design of Materials with Extreme Negative Compressibility: Selective Soft-Mode Frustration in KMn[Ag(CN)2]3 Journal of the American Chemical Society, 2012, 134, 4454-4456 |
| 7208451 | CIF | C4 H8 N O4 S | P -1 | 5.2644; 6.6233; 10.3965 87.021; 76.908; 70.282 | 332.26 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 7017957 | CIF | Ag F O3 S | P 1 21/m 1 | 5.4128; 8.1739; 7.5436 90; 94.599; 90 | 332.68 | Grochala, Wojciech; Cyrański, Michał Ksawery; Derzsi, Mariana; Michałowski, Tomasz; Malinowski, Przemysław J; Mazej, Zoran; Kurzydłowski, Dominik; Koźmiński, Wiktor; Budzianowski, Armand; Leszczyński, Piotr J Crystal and electronic structure, lattice dynamics and thermal properties of Ag(i)(SO(3))R (R = F, CF(3)) Lewis acids in the solid state. Dalton transactions (Cambridge, England : 2003), 2012, 41, 2034-2047 |
| 7019641 | CIF | H I O4 Zn | C 1 c 1 | 4.6767; 11.2392; 6.3308 90; 90.019; 90 | 332.762 | Lee, Dong Woo; Kim, Saet Byeol; Ok, Kang Min ZnIO(3)(OH): a new layered noncentrosymmetric polar iodate - hydrothermal synthesis, crystal structure, and second-harmonic generating (SHG) properties. Dalton transactions (Cambridge, England : 2003), 2012, 41, 8348-8353 |
| 4117623 | CIF | C6 Ag3 K Mn N6 | P 3 1 2 | 6.8431; 6.8431; 8.2137 90; 90; 120 | 333.1 | Andrew B. Cairns; Amber L. Thompson; Matthew G. Tucker; Julien Haines; Andrew L. Goodwin Rational Design of Materials with Extreme Negative Compressibility: Selective Soft-Mode Frustration in KMn[Ag(CN)2]3 Journal of the American Chemical Society, 2012, 134, 4454-4456 |
| 7208642 | CIF | C14 H12 N2 O8 | P -1 | 3.7117; 9.871; 10.44 116.081; 97.186; 97.626 | 333.2 | Chen, Xiaocui; Han, Shumin; Wang, Ruiyao Crystal engineering through charge-assisted hydrogen bonds, multiple C‒H⋯O bonds and π‒π stacking: from (H2bipy)[Cu(ox)2] to (H2bipy)[NaH(ox)2] and (H2bipy)[H2(ox)2] (H2bipy = 4,4′-bipyridin-1,1′-dium; ox = oxalate) CrystEngComm, 2012, 14, 6400 |
| 7208450 | CIF | C4 H8 N O4 S | P -1 | 5.2672; 6.6328; 10.4111 86.956; 76.887; 70.227 | 333.24 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 7019864 | CIF | Hf Se3 Tl2 | P 1 21/m 1 | 8.1544; 3.8812; 10.6224 90; 97.435; 90 | 333.36 | Sankar, Cheriyedath Raj; Kuropatwa, Bryan A.; Assoud, Abdeljalil; Kleinke, Holger Structures and properties of the ternary thallium chalcogenides Tl(2)MQ(3) (M = Zr, Hf; Q = S, Se). Dalton transactions (Cambridge, England : 2003), 2012, 41, 9646-9650 |
| 4507100 | CIF | C7 H7 N O2 | P 1 21 1 | 7.91; 5.274; 8.451 90; 108.78; 90 | 333.78 | Tothadi, Srinu; Desiraju, Gautam R. Synthon Modularity in 4-Hydroxybenzamide‒Dicarboxylic Acid Cocrystals Crystal Growth & Design, 2012, 12, 6188 |
| 7208641 | CIF | C14 H11 N2 Na O8 | P -1 | 3.642; 9.706; 10.459 109.23; 100.133; 99.271 | 333.96 | Chen, Xiaocui; Han, Shumin; Wang, Ruiyao Crystal engineering through charge-assisted hydrogen bonds, multiple C‒H⋯O bonds and π‒π stacking: from (H2bipy)[Cu(ox)2] to (H2bipy)[NaH(ox)2] and (H2bipy)[H2(ox)2] (H2bipy = 4,4′-bipyridin-1,1′-dium; ox = oxalate) CrystEngComm, 2012, 14, 6400 |
| 4327893 | CIF | Ce Ge2 Li | P n m a | 7.816; 3.9721; 10.757 90; 90; 90 | 334 | Svilen Bobev; Tae-Soo You; Nian-Tzu Suen; Shanta Saha; Richard Greene; Johnpierre Paglione Synthesis, Structure, Chemical Bonding, and Magnetism of the Series ReLiGe2 (RE= La-Nd, Sm, Eu) Inorganic Chemistry, 2012, 51, 620-628 |
| 7208449 | CIF | C4 H8 N O4 S | P -1 | 5.2705; 6.6419; 10.4243 86.895; 76.869; 70.16 | 334.17 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 2235623 | CIF HKL Paper | C7 H7 N O3 | P -1 | 6.2216; 7.4096; 7.7833 110.867; 93.667; 90.748 | 334.34 | Císařová, Ivana; Štěpnička, Petr (4-Nitrophenyl)methanol Acta Crystallographica Section E, 2012, 68, o2012 |
| 4117622 | CIF | C6 Ag3 K Mn N6 | P 3 1 2 | 6.866; 6.866; 8.1895 90; 90; 120 | 334.35 | Andrew B. Cairns; Amber L. Thompson; Matthew G. Tucker; Julien Haines; Andrew L. Goodwin Rational Design of Materials with Extreme Negative Compressibility: Selective Soft-Mode Frustration in KMn[Ag(CN)2]3 Journal of the American Chemical Society, 2012, 134, 4454-4456 |
| 2105136 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 9.1142; 12.0534; 3.0574 90; 95.0321; 90 | 334.583 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 1508390 | CIF | C2 H4 Cu N8 O2 | P -1 | 7.4137; 7.489; 7.5391 118.928; 109.295; 92.47 | 335.18 | Joas, Manuel; Klapοtke, Thomas M.; Stierstorfer, Jοrg Preparation and Crystal Structure of Diaqua(?-5,5'-bistetrazolato-?4N1,N2,N5,N6)copper(II) Crystals, 2012, 2, 958-966 |
| 7208448 | CIF | C4 H8 N O4 S | P -1 | 5.2748; 6.6507; 10.4397 86.836; 76.833; 70.093 | 335.2 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 2234141 | CIF HKL Paper | C4 H6 N8 | C 1 2/m 1 | 10.951; 6.678; 5.0329 90; 114.25; 90 | 335.58 | Qiao, Cheng-Fang; Zhou, Chun-Sheng; Wei, Qing; Xia, Zheng-Qiang A new polymorph of 5,5'-(ethane-1,2-diyl)bis(1<i>H</i>-tetrazole) Acta Crystallographica Section E, 2012, 68, o989 |
| 4117621 | CIF | C6 Ag3 K Mn N6 | P 3 1 2 | 6.8904; 6.8904; 8.1649 90; 90; 120 | 335.71 | Andrew B. Cairns; Amber L. Thompson; Matthew G. Tucker; Julien Haines; Andrew L. Goodwin Rational Design of Materials with Extreme Negative Compressibility: Selective Soft-Mode Frustration in KMn[Ag(CN)2]3 Journal of the American Chemical Society, 2012, 134, 4454-4456 |
| 2235339 | CIF HKL Paper | C5 H6 N2 O4 | P -1 | 3.7286; 9.836; 10.487 117.35; 97.01; 93.65 | 335.92 | Yu, Chun-Hua; Zhu, Run-Qiang 1<i>H</i>-Pyrazol-2-ium hydrogen oxalate Acta Crystallographica Section E, 2012, 68, o1911 |
| 2235962 | CIF HKL Paper | C1.99 B12.88 | R -3 m :H | 5.653; 5.653; 12.156 90; 90; 120 | 336.42 | Sologub, Oksana; Michiue, Yuichi; Mori, Takao Boron carbide, B~13-<i>x~</i>C~2-<i>y~</i> (<i>x</i> = 0.12, <i>y</i> = 0.01) Acta Crystallographica Section E, 2012, 68, i67 |
| 2235319 | CIF HKL Paper | C14 H10 N4 O4 | P -1 | 3.6842; 7.5816; 12.4511 78.258; 85.301; 82.547 | 337.08 | Zheng, Wen-Ni Oxalic acid‒pyridine-4-carbonitrile (1/2) Acta Crystallographica Section E, 2012, 68, o1625 |
| 4117620 | CIF | C6 Ag3 K Mn N6 | P 3 1 2 | 6.9154; 6.9154; 8.1399 90; 90; 120 | 337.12 | Andrew B. Cairns; Amber L. Thompson; Matthew G. Tucker; Julien Haines; Andrew L. Goodwin Rational Design of Materials with Extreme Negative Compressibility: Selective Soft-Mode Frustration in KMn[Ag(CN)2]3 Journal of the American Chemical Society, 2012, 134, 4454-4456 |
| 4329100 | CIF | C10 H12 Cd N4 O4 | P -1 | 4.997105; 7.22401; 10.79028 112.954; 97.9; 70.1374 | 337.34 | Claudio Pettinari; Aurel Tăbăcaru; Ishtvan Boldog; Konstantin V. Domasevitch; Simona Galli; Norberto Masciocchi Novel Coordination Frameworks Incorporating the 4,4'-Bipyrazolyl Ditopic Ligand Inorganic Chemistry, 2012, 51, 5235-5245 |
| 4506088 | CIF | C7 H3 Cl F2 O | P -1 | 6.8606; 7.1974; 8.0394 94.604; 104.285; 115.92 | 337.84 | Dikundwar, Amol G.; Row, Tayur N. Guru Evidence for the “Amphoteric” Nature of Fluorine in Halogen Bonds: An Instance of Cl···F Contact Crystal Growth & Design, 2012, 12, 1713 |
| 2105135 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 9.1834; 12.0234; 3.0886 90; 95.7294; 90 | 339.326 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 2105209 | CIF Paper | C5 H12 O5 | P 1 | 7.67982; 9.717; 4.82857 96.0388; 106.806; 96.094 | 339.478 | Derollez, Patrick; Guinet, Yannick; Affouard, Frédéric; Danède, Florence; Carpentier, Laurent; Hédoux, Alain Structure determination of <small>L</small>-arabinitol by powder X-ray diffraction Acta Crystallographica Section B, 2012, 68, 407-411 |
| 4117358 | CIF | C7 H4 F2 N2 | P -1 | 4.0541; 6.6842; 13.04 103.999; 97.334; 91.227 | 339.56 | Yuta Fujiwara; Janice A. Dixon; Rodrigo A. Rodriguez; Ryan D. Baxter; Darryl D. Dixon; Michael R. Collins; Donna G. Blackmond; Phil S. Baran A New Reagent for Direct Difluoromethylation Journal of the American Chemical Society, 2012, 134, 1494-1497 |
| 1563050 | CIF | Cu1.74 Gd0.75 Te2 | P -3 1 m | 7.478; 7.478; 7.015 90; 90; 120 | 339.73 | Gulay, L.D.; Daszkiewicz, M.; Shemet, V.Ya. Crystal structure of ∼RCu3S3 and ∼RCuTe2 (R=Gd‒Lu) compounds Journal of Solid State Chemistry, 2012, 186, 142-148 |
| 4329156 | CIF | Cl3 Tc | C 1 2/m 1 | 5.986; 9.725; 6.194 90; 108.687; 90 | 341.6 | Frederic Poineau; Erik V. Johnstone; Philippe F. Weck; Paul M. Forster; Eunja Kim; Kenneth R. Czerwinski; Alfred P. Sattelberger β-Technetium Trichloride: Formation, Structure, and First-Principles Calculations Inorganic Chemistry, 2012, 51, 4915-4917 |
| 4327892 | CIF | Ge2 La Li | P n m a | 7.8408; 4.0061; 10.8755 90; 90; 90 | 341.61 | Svilen Bobev; Tae-Soo You; Nian-Tzu Suen; Shanta Saha; Richard Greene; Johnpierre Paglione Synthesis, Structure, Chemical Bonding, and Magnetism of the Series ReLiGe2 (RE= La-Nd, Sm, Eu) Inorganic Chemistry, 2012, 51, 620-628 |
| 2105141 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 9.2295; 12.0064; 3.1155 90; 96.3516; 90 | 343.119 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 2105134 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 9.2363; 11.9873; 3.1205 90; 96.1667; 90 | 343.497 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 4328408 | CIF | H Mn0.03 O3 P Sn0.97 | C 1 c 1 | 7.0555; 12.242; 4.6683 90; 121.487; 90 | 343.85 | Hui-Lin Huang; Yei-Chen Lai; Yun-Wei Chiang; Sue-Lein Wang Intrinsic Optical Properties and Divergent Doping Effects of Manganese(II) on Luminescence for Tin(II) Phosphite Grown from a Deep-Eutectic Solvent Inorganic Chemistry, 2012, 51, 1986-1988 |
| 2233270 | CIF HKL Paper | C5 H6 Br N3 | P -1 | 3.99; 9.862; 10.006 61.57; 83.84; 87.45 | 344.24 | Yang, Qi; Xu, Ning; Zhu, Kai; Lv, Xiaoping; Han, Ping-fang 5-Bromo-<i>N</i>-methylpyrimidin-2-amine Acta Crystallographica Section E, 2012, 68, o111 |
| 9014243 | CIF | Fe4 O5 | C m c m | 2.87366; 9.694; 12.4116 90; 90; 90 | 345.753 | Woodland, A. B.; Frost, D. J.; Trots, D. M.; Klimm, K.; Mezouar, M. In situ observation of the breakdown of magnetite (Fe3O4) to Fe4O5 and hematite at high pressures and temperatures American Mineralogist, 2012, 97, 1808-1811 |
| 4330034 | CIF | B Bi Ni2 O10 P2 | P 1 21/m 1 | 5.0682; 11.282; 6.322 90; 106.948; 90 | 345.79 | Wei-Long Zhang; Zhang-Zhen He; Tian-Long Xia; Zhong-Zhen Luo; Hao Zhang; Chen-Sheng Lin; Wen-Dan Cheng Syntheses and Magnetic Properties Study of Isostructural BiM2BP2O10 (M = Co, Ni) Containing a Quasi-1D Linear Chain Structure Inorganic Chemistry, 2012, 51, 8842-8847 |
| 2233434 | CIF HKL Paper | Li0.8 Sn2 Tb Zn0.2 | C m c m | 4.4495; 17.699; 4.3978 90; 90; 90 | 346.33 | Stetskiv, Andrij; Tarasiuk, Ivan; Rozdzynska-Kielbik, Beata; Oshchapovsky, Igor; Pavlyuk, Volodymyr Terbium (lithium zinc) distannide, TbLi~1{‒~<i>x</i>}Zn~<i>x~</i>Sn~2~ (<i>x</i> = 0.2) Acta Crystallographica Section E, 2012, 68, i16 |
| 9014889 | CIF | Ba0.985 Ca0.002 Mg0.002 O4 S Sr0.007 | P b n m | 7.15505; 8.88101; 5.45447 90; 90; 90 | 346.599 | Antao, S. M. Structural trends for celestite (SrSO4), anglesite (PbSO4), and barite (BaSO4): confirmation of expected variations within SO4 groups American Mineralogist, 2012, 97, 661-665 |
| 7208077 | CIF | C2 H5 Cl | P 1 21/n 1 | 5.2815; 9.8152; 6.7653 90; 98.071; 90 | 347.23 | Podsiadło, Marcin; Bujak, Maciej; Katrusiak, Andrzej Chemistry of density: extension and structural origin of Carnelley's rule in chloroethanes CrystEngComm, 2012, 14, 4496 |
| 7238732 | CIF | C14 H10 Br2 N2 O2 | P -1 | 6.4795; 7.343; 7.8656 78.621; 79.482; 73.05 | 347.81 | Safin, Damir A.; Robeyns, Koen; Garcia, Yann Solid-state thermo- and photochromism in N,N′-bis(5-X-salicylidene)diamines (X = H, Br) RSC Advances, 2012, 2, 11379 |
| 9017805 | CIF | Cr Fe0.003 O4 Pb0.997 | P 1 21/n 1 | 7.098; 7.41; 6.779 90; 102.4; 90 | 348.232 | Bandiello, E.; Errandonea, D.; Martinez-Garcia D; Santamaria-Perez D; Manjon, F. J. Effects of high-pressure on the structural, vibrational, and electronic properties of monzanite-type PbCrO4 Physical Review, 2012, 024108-024110 |
| 4330033 | CIF | B Bi Co2 O10 P2 | P 1 21/m 1 | 5.0782; 11.2889; 6.402 90; 107.827; 90 | 349.39 | Wei-Long Zhang; Zhang-Zhen He; Tian-Long Xia; Zhong-Zhen Luo; Hao Zhang; Chen-Sheng Lin; Wen-Dan Cheng Syntheses and Magnetic Properties Study of Isostructural BiM2BP2O10 (M = Co, Ni) Containing a Quasi-1D Linear Chain Structure Inorganic Chemistry, 2012, 51, 8842-8847 |
| 2105133 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 9.3174; 11.9774; 3.1597 90; 97.1782; 90 | 349.853 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 2234403 | CIF HKL Paper | C16 H14 N2 O4 | P -1 | 5.8481; 7.6348; 8.4677 91.837; 92.584; 111.907 | 349.93 | Moon, Suk-Hee; Park, Ki-Min 4,4'-Bipyridine‒<i>trans</i>,<i>trans</i>-hexa-2,4-dienedioic acid (1/1) Acta Crystallographica Section E, 2012, 68, o1201 |
| 4329660 | CIF | C H4 N3 Na | P 1 21/c 1 | 7.9496; 5.0328; 9.3591 90; 110.797; 90 | 350.05 | Peter Klaus Sawinski; Richard Dronskowski Solvothermal Synthesis, Crystal Growth, and Structure Determination of Sodium and Potassium Guanidinate Inorganic Chemistry, 2012, 51, 7425-7430 |
| 4328646 | CIF | Ge2 Mn O7 Sr2 | P -4 21 m | 8.0677; 8.0677; 5.3891 90; 90; 90 | 350.76 | Takashi Endo; Yoshihiro Doi; Yukio Hinatsu; Kenji Ohoyama Magnetic and Neutron Diffraction Study on Melilite-Type Oxides Sr2MGe2O7 (M = Mn, Co) Inorganic Chemistry, 2012, 51, 3572-3578 |
| 4328407 | CIF | H O3 P Sn | C 1 c 1 | 7.0757; 12.3468; 4.6819 90; 120.93; 90 | 350.86 | Hui-Lin Huang; Yei-Chen Lai; Yun-Wei Chiang; Sue-Lein Wang Intrinsic Optical Properties and Divergent Doping Effects of Manganese(II) on Luminescence for Tin(II) Phosphite Grown from a Deep-Eutectic Solvent Inorganic Chemistry, 2012, 51, 1986-1988 |
| 7107634 | CIF | C8.5 H6 Fe N7 Pt S0.5 | P 4/m m m | 7.191; 7.191; 6.802 90; 90; 90 | 351.73 | Francisco J. Munoz Lara; Ana B. Gaspar; Daniel Aravena; Eliseo Ruiz; M. Carmen Munoz; Masaaki Ohba; Ryo Ohtani; Susumu Kitagawa; Jose A. Real Enhanced bistability by guest inclusion in Fe(II) spin crossover porous coordination polymers Chem.Commun., 2012, 48, 4686 |
| 4505869 | CIF | C16 H14 N2 O4 | P -1 | 3.829; 9.128; 10.841 107.16; 99.61; 95.86 | 352.32 | Tsaggeos, Kostas; Masiera, Natalia; Niwicka, Aleksandra; Dokorou, Vassiliki; Siskos, Michael G.; Skoulika, Stavroula; Michaelides, Adonis Crystal Structure, Thermal Behavior, and Photochemical Reactivity of a Series of Co-Crystals oftrans-1,2-Bis(4-pyridyl) Ethylene with Dicarboxylic Acids Crystal Growth & Design, 2012, 12, 2187 |
| 7214999 | CIF | C4 H12 Cl2 N10 O8 | P -1 | 5.3075; 7.5977; 9.161 74.424; 84.547; 83.648 | 352.84 | Matulková, Irena; Cihelka, Jaroslav; Pojarová, Michaela; Fejfarová, Karla; Dušek, Michal; Vaněk, Přemysl; Kroupa, Jan; Krupková, Radmila; Fábry, Jan; Němec, Ivan A new series of 3,5-diamino-1,2,4-triazolium(1+) inorganic salts and their potential in crystal engineering of novel NLO materials CrystEngComm, 2012, 14, 4625 |
| 7107635 | CIF | C8.5 H6 Fe N7 Pd S0.5 | P 4/m m m | 7.207; 7.207; 6.798 90; 90; 90 | 353.09 | Francisco J. Munoz Lara; Ana B. Gaspar; Daniel Aravena; Eliseo Ruiz; M. Carmen Munoz; Masaaki Ohba; Ryo Ohtani; Susumu Kitagawa; Jose A. Real Enhanced bistability by guest inclusion in Fe(II) spin crossover porous coordination polymers Chem.Commun., 2012, 48, 4686 |
| 4327897 | CIF | Eu Ge2 Li | P n m a | 8.0735; 3.973; 11.0099 90; 90; 90 | 353.15 | Svilen Bobev; Tae-Soo You; Nian-Tzu Suen; Shanta Saha; Richard Greene; Johnpierre Paglione Synthesis, Structure, Chemical Bonding, and Magnetism of the Series ReLiGe2 (RE= La-Nd, Sm, Eu) Inorganic Chemistry, 2012, 51, 620-628 |
| 2235298 | CIF HKL Paper | C6 H5 Cl N2 | P -1 | 6.6166; 7.6552; 8.3495 63.957; 69.83; 74.367 | 353.16 | Zheng, Wen-Ni 4-Cyanopyridinium chloride Acta Crystallographica Section E, 2012, 68, o1611 |
| 2235205 | CIF HKL Paper | C8 H9 N O | P -1 | 6.5511; 6.9192; 8.0265 93.73; 102.78; 91.769 | 353.68 | Zhao, Min-Min <i>N</i>-(4-Methylphenyl)formamide Acta Crystallographica Section E, 2012, 68, o1961 |
| 7208076 | CIF | C2 H5 Cl | P 1 21/n 1 | 5.3006; 9.8562; 6.8405 90; 98.173; 90 | 353.74 | Podsiadło, Marcin; Bujak, Maciej; Katrusiak, Andrzej Chemistry of density: extension and structural origin of Carnelley's rule in chloroethanes CrystEngComm, 2012, 14, 4496 |
| 4328649 | CIF | Ge2 O7 Sr2 Zn | P -4 21 m | 8.15281; 8.15281; 5.3267 90; 90; 90 | 354.057 | Takashi Endo; Yoshihiro Doi; Yukio Hinatsu; Kenji Ohoyama Magnetic and Neutron Diffraction Study on Melilite-Type Oxides Sr2MGe2O7 (M = Mn, Co) Inorganic Chemistry, 2012, 51, 3572-3578 |
| 2105155 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.452; 5.516; 5.606 90; 90; 90 | 354.1 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 2234581 | CIF HKL Paper | C12 H4 F4 I2 O2 | P -1 | 5.778; 6.354; 10.013 102.295; 93.861; 97.781 | 354.1 | Liu, Peng; Ruan, Chuansheng; Li, Tiesheng; Ji, Baoming Cyclohexa-2,5-diene-1,4-dione‒1,2,4,5-tetrafluoro-3,6-diiodobenzene (1/1) Acta Crystallographica Section E, 2012, 68, o1431 |
| 4506790 | CIF | C14 H8 N2 O6 U | P -1 | 5.1366; 5.6106; 12.944 95.95; 90.627; 107.037 | 354.41 | Mihalcea, Ionut; Henry, Natacha; Bousquet, Till; Volkringer, Christophe; Loiseau, Thierry Six-Fold Coordinated Uranyl Cations in Extended Coordination Polymers Crystal Growth & Design, 2012, 12, 4641 |
| 4329803 | CIF | As1.12 Cd4 Cu6.88 | F d -3 m :2 | 7.0779; 7.0779; 7.0779 90; 90; 90 | 354.58 | Oliver Osters; Tom Nilges; Michael Schöneich; Peer Schmidt; Jan Rothballer; Florian Pielnhofer; Richard Weihrich Cd4Cu7As, The First Representative of a Fully Ordered, Orthorhombically Distorted MgCu2 Laves Phase Inorganic Chemistry, 2012, 51, 8119-8127 |
| 2236705 | CIF HKL Paper | Al0.91 As F0.73 Fe0.09 H0.27 Li0.05 Na0.95 O4.27 | C 1 2/c 1 | 6.5789; 8.5071; 7.0212 90; 115.447; 90 | 354.83 | Downs, Gordon W.; Yang, Betty N.; Thompson, Richard M.; Wenz, Michelle D.; Andrade, Marcelo B. Redetermination of durangite, NaAl(AsO~4~)F Acta Crystallographica Section E, 2012, 68, i86-i87 |
| 9015025 | CIF | Al Ca0.66 F5 | C 1 2/c 1 | 8.601; 6.2903; 7.219 90; 114.61; 90 | 355.091 | Balic-Zunic T; Garavelli, A.; Mitolo, D.; Acquafredda, P.; Leonardsen, E. Jakobssonite, CaAlF5, a new mineral from fumaroles at the Eldfell and Hekla volcanoes, Iceland Mineralogical Magazine, 2012, 76, 751-760 |
| 9015949 | CIF | Al Ca0.5 O4 Si | P 1 21 1 | 8.22; 8.951; 4.828 90; 90; 90 | 355.231 | Krivovichev, S. V.; Shcherbakova, E. P.; Nishanbaev, T. P. The crystal structure of svyatoslavite and evolution of complexity during crystallization of a CaAl2Si2O8 melt: A structural automata description The Canadian Mineralogist, 2012, 50, 585-592 |
| 4328648 | CIF | Co Ge2 O7 Sr2 | P -4 21 m | 8.16939; 8.16939; 5.32529 90; 90; 90 | 355.404 | Takashi Endo; Yoshihiro Doi; Yukio Hinatsu; Kenji Ohoyama Magnetic and Neutron Diffraction Study on Melilite-Type Oxides Sr2MGe2O7 (M = Mn, Co) Inorganic Chemistry, 2012, 51, 3572-3578 |
| 2105132 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 9.3887; 11.968; 3.196 90; 97.93; 90 | 355.681 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 2235793 | CIF HKL Paper | C4 H12 Cd N6 O2 S4 | P -1 | 5.8533; 7.3527; 8.863 73.413; 76.926; 88.856 | 355.69 | Mietlarek-Kropidłowska, Anna; Chojnacki, Jaroslaw <i>catena</i>-Poly[[[bis(thiourea-κ<i>S</i>)cadmium]-di-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>;κ^2^<i>S</i>:<i>N</i>] dihydrate] Acta Crystallographica Section E, 2012, 68, m1051-m1052 |
| 7208269 | CIF | C7 H5 N O5 | P -1 | 5.1246; 8.7762; 9.2674 62.252; 75.292; 82.654 | 356.76 | Montis, Riccardo; Hursthouse, Michael B. Surprisingly complex supramolecular behaviour in the crystal structures of a family of mono-substituted salicylic acids CrystEngComm, 2012, 14, 5242 |
| 2236195 | CIF HKL Paper | C3 H11 Cl N O P | P -1 | 5.2965; 7.703; 8.8035 84.057; 87.691; 89.016 | 356.92 | Reiss, Guido J.; Jörgens, Stefan (Dimethylphosphoryl)methanaminium chloride Acta Crystallographica Section E, 2012, 68, o2899-o2900 |
| 2105154 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.4915; 5.5249; 5.6262 90; 90; 90 | 357.2 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 2235621 | CIF HKL Paper | C16 H16 N2 O4 | P -1 | 6.7186; 7.6942; 8.2462 65.29; 75.499; 68.207 | 357.28 | Vallejos, Javier; Brito, Iván; Cárdenas, Alejandro; Bolte, Michael Butane-1,4-diyl bis(pyridine-3-carboxylate) Acta Crystallographica Section E, 2012, 68, o2007 |
| 4329802 | CIF | As Cd4 Cu7 | P n n m | 9.8833; 7.1251; 5.0895 90; 90; 90 | 358.4 | Oliver Osters; Tom Nilges; Michael Schöneich; Peer Schmidt; Jan Rothballer; Florian Pielnhofer; Richard Weihrich Cd4Cu7As, The First Representative of a Fully Ordered, Orthorhombically Distorted MgCu2 Laves Phase Inorganic Chemistry, 2012, 51, 8119-8127 |
| 9015194 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.5518; 6.5518; 9.6503 90; 90; 120 | 358.751 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 4.28 GPa American Mineralogist, 2012, 97, 1749-1763 |
| 1508431 | CIF | C4 H9 N5 S | P -1 | 5.9032; 7.4591; 9.2538 113.598; 98.37; 99.017 | 358.88 | Laus, Gerhard; Kahlenberg, Volker; Wurst, Klaus; Schottenberger, Herwig; Fischer, Niko; Stierstorfer, Jοrg; Klapοtke, Thomas M. Synthesis and Crystal Structures of New 5,5'-Azotetrazolates Crystals, 2012, 2, 127-136 |
| 2233535 | CIF HKL Paper | C4 H6 N2 O S2 | P -1 | 6.0308; 8.1171; 8.7616 116.55; 93.7; 106.1 | 359.7 | Kang, Sung Kwon; Cho, Nam Sook; Jang, Siyoung 5-Ethoxy-1,3,4-thiadiazole-2(3<i>H</i>)-thione Acta Crystallographica Section E, 2012, 68, o503 |
| 9016710 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.5605; 6.5605; 9.6574 90; 90; 120 | 359.969 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 4.01 GPa American Mineralogist, 2012, 97, 1749-1763 |
| 4330761 | CIF | C6 H8 O4 Zn | P -1 | 4.8404; 6.6927; 11.6506 105.704; 93.165; 95.322 | 360.5 | Paul J. Saines; Mark Steinmann; Jin-Chong Tan; Hamish H.-M. Yeung; Wei Li; Phillip T. Barton; Anthony K. Cheetham Isomer-Directed Structural Diversity and Its Effect on the Nanosheet Exfoliation and Magnetic Properties of 2,3-Dimethylsuccinate Hybrid Frameworks Inorganic Chemistry, 2012, 51, 11198-11209 |
| 2234471 | CIF HKL Paper | C12 H10 Cl2 Hg N2 O4 | P -1 | 3.8298; 6.5626; 14.5831 98.001; 95.315; 92.963 | 360.62 | Shirvan, Sadif A.; Haydari Dezfuli, Sara <i>catena</i>-Poly[[bis(pyridine-3-carboxylic acid-κ<i>N</i>)mercury(II)]-di-μ-chlorido] Acta Crystallographica Section E, 2012, 68, m516 |
| 4329544 | CIF | C H2 Lu Na O7 P2 | P -1 | 6.7104; 6.7767; 8.631 102.521; 98.375; 105.423 | 360.63 | Juan Diwu; Daniel J. Grant; Shuao Wang; Laura Gagliardi; Thomas E. Albrecht-Schmitt Periodic Trends in Lanthanide and Actinide Phosphonates: Discontinuity between Plutonium and Americium Inorganic Chemistry, 2012, 51, 6906-6915 |
| 4118234 | CIF | C7 H7 Br O2 | P 1 21 1 | 7.2049; 5.3099; 9.434 90; 92.18; 90 | 360.66 | Daniel H. Paull; Chao Fang; James R. Donald; Andrew D. Pansick; Stephen F. Martin Bifunctional Catalyst Promotes Highly Enantioselective Bromolactonizations To Generate Stereogenic C-Br Bonds Journal of the American Chemical Society, 2012, 134, 11128-11131 |
| 9015062 | CIF | Al2 As2 H18 Mg O18 | P -1 | 5.4363; 10.5; 7.075 97.701; 110.295; 102.021 | 360.987 | Meisser, N.; Brugger, J.; Krivovichev, S.; Armbruster, T.; Favreau, G. Description and crystal structure of maghrebite, MgAl2(AsO4)2(OH)2*8H2O, from Aghbar, Anti-Atlas, Morocco: first arsenate in the laueite mineral group European Journal of Mineralogy, 2012, 24, 717-726 |
| 2235247 | CIF HKL Paper | C18 H14 N2 O4 | P -1 | 6.783; 6.895; 8.161 98.34; 95.845; 104.623 | 361.6 | Koteswara Rao, Vandavasi; Zeller, Matthias; Lovelace-Cameron, Sherri R. 4,4'-Bipyridine‒terephthalic acid (1/1) Acta Crystallographica Section E, 2012, 68, o1711 |
| 9016221 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.5689; 6.5689; 9.6804 90; 90; 120 | 361.751 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 3.56 GPa American Mineralogist, 2012, 97, 1749-1763 |
| 2105153 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.537; 5.554; 5.6456 90; 90; 90 | 361.8 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 7020037 | CIF | Cs2 Cu3 F4 O12 P4 | P 1 | 5.4162; 7.9373; 9.3034 84.198; 73.305; 71.229 | 362.7 | Williams, Edward R.; Morris, Samuel A.; Weller, Mark T. Copper(ii) fluorophosphates. Dalton transactions (Cambridge, England : 2003), 2012, 41, 10845-10853 |
| 7112528 | CIF | C2 H9 N O6 P2 | P -1 | 5.578; 5.9177; 11.3992 82.368; 82.198; 78.166 | 362.72 | Chen, Shuo-ping; Hu, Le; Zhang, Yu-qin; Deng, Pu; Li, Cong; Chen, Xi; Yuan, Liang-jie (AEDPH3)·(BtaH): a novel supramolecular plaster with formaldehyde adsorption and formaldehyde/ultraviolet ray-induced luminescence switching performance. Chemical communications (Cambridge, England), 2012, 48, 552-554 |
| 7208260 | CIF | C8 H8 O3 | P -1 | 3.8685; 7.238; 13.2142 100.756; 93.271; 90.788 | 362.8 | Montis, Riccardo; Hursthouse, Michael B. Surprisingly complex supramolecular behaviour in the crystal structures of a family of mono-substituted salicylic acids CrystEngComm, 2012, 14, 5242 |
| 2105131 | CIF HKL Paper | C Cu2 O5 | P 1 21/a 1 | 9.473; 11.977; 3.2377 90; 98.71; 90 | 363.107 | Merlini, Marco; Perchiazzi, Natale; Hanfland, Michael; Bossak, Alexei Phase transition at high pressure in Cu~2~CO~3~(OH)~2~ related to the reduction of the Jahn‒Teller effect Acta Crystallographica Section B, 2012, 68, 266-274 |
| 2235790 | CIF HKL Paper | C10 H10 Fe N4 O10 | P -1 | 4.929; 6.4258; 12.2812 78.161; 85.175; 72.776 | 363.52 | Ohshima, Eriko; Yoshida, Kazuki; Sugiyama, Kazumasa; Uekusa, Hidehiro Triclinic modification of diaquabis(5-carboxy-1<i>H</i>-imidazole-4-carboxylato-κ^2^<i>N</i>^3^,<i>O</i>^4^)iron(II) Acta Crystallographica Section E, 2012, 68, m1093-m1094 |
| 7208264 | CIF | C7 H5 Br O3 | P -1 | 6.9625; 7.1714; 8.016 82.112; 73.835; 71.272 | 363.56 | Montis, Riccardo; Hursthouse, Michael B. Surprisingly complex supramolecular behaviour in the crystal structures of a family of mono-substituted salicylic acids CrystEngComm, 2012, 14, 5242 |
| 9016689 | CIF | Cr Mn2 O9 Pb2 | P -1 | 5.0278; 7.5865; 10.2808 91.968; 99.405; 109.159 | 363.813 | Kampf, A. R.; Mills, S. J.; Housley, R. M.; Bottrill, R. S.; Kolitsch, U. Reynoldsite, Pb2Mn4+2O5(CrO4), a new phyllomanganate-chromate from the Blue Bell claims, California and the Red Lead mine, Tasmania American Mineralogist, 2012, 97, 1187-1192 |
| 1562946 | CIF | Cs I3 Ni | P 63/m m c | 7.9469; 7.9469; 6.6575 90; 90; 120 | 364.114 | Raw, Adam D.; Ibers, James A.; Poeppelmeier, Kenneth R. Syntheses and structure of hydrothermally prepared CsNiX3 (X=Cl, Br, I) Journal of Solid State Chemistry, 2012, 192, 34-37 |
| 7017787 | CIF | C14 H14 N4 O6 | P -1 | 6.4941; 6.5761; 9.3664 85.2; 87.91; 66.005 | 364.15 | Murray, Paul R.; Crawford, Stephen; Dawson, Alice; Delf, Alexander; Findlay, Calum; Jack, Lorna; McInnes, Eric J. L.; Al-Musharafi, Salma; Nichol, Gary S.; Oswald, Iain; Yellowlees, Lesley J. On the electronic structure of nitro-substituted bipyridines and their platinum complexes. Dalton transactions (Cambridge, England : 2003), 2012, 41, 201-207 |
| 4328647 | CIF | Ge2 Mn O7 Sr2 | P -4 21 m | 8.28708; 8.28708; 5.31891 90; 90; 90 | 365.28 | Takashi Endo; Yoshihiro Doi; Yukio Hinatsu; Kenji Ohoyama Magnetic and Neutron Diffraction Study on Melilite-Type Oxides Sr2MGe2O7 (M = Mn, Co) Inorganic Chemistry, 2012, 51, 3572-3578 |
| 2105152 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.572; 5.567; 5.671 90; 90; 90 | 365.3 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 9017469 | CIF | Ca Mg O6 Si2 | C 1 2/c 1 | 9.234; 8.255; 4.959 90; 104.592; 90 | 365.815 | Plonka, A. M.; Dera, P.; Irmen, P.; Rivers, M. L.; Ehm, L.; Parise, J. B. Beta-diopside, a new ultrahigh-pressure polymorph of CaMgSi2O6 with six-coordinated silicon Note: P = 38.6 GPa Geophysical Research Letters, 2012, 39, L24307-4 |
| 4329434 | CIF | Cs H0 O8 P2 U | P 1 21/m 1 | 7.7425; 5.6681; 9.1291 90; 113.944; 90 | 366.16 | Eric M. Villa; Connor J. Marr; Laurent J. Jouffret; Evgeny V. Alekseev; Wulf Depmeier; Thomas E. Albrecht-Schmitt Systematic Evolution from Uranyl(VI) Phosphites to Uranium(IV) Phosphates Inorganic Chemistry, 2012, 51, 6548-6558 |
| 2233580 | CIF HKL Paper | C14 H18 Cl2 N2 O2 | P -1 | 5.105; 6.876; 10.549 97.735; 93.214; 90.512 | 366.3 | Cuzan, Olesea; Shova, Sergiu; Turta, Constantin; Mangalagiu, Ionel I. <i>N</i>,<i>N</i>'-(1,4-Phenylene)bis(4-chlorobutanamide) Acta Crystallographica Section E, 2012, 68, o463 |
| 4330768 | CIF | C6 H8 O4 Zn | P -1 | 4.8543; 6.7522; 11.7208 105.932; 92.578; 95.916 | 366.37 | Paul J. Saines; Mark Steinmann; Jin-Chong Tan; Hamish H.-M. Yeung; Wei Li; Phillip T. Barton; Anthony K. Cheetham Isomer-Directed Structural Diversity and Its Effect on the Nanosheet Exfoliation and Magnetic Properties of 2,3-Dimethylsuccinate Hybrid Frameworks Inorganic Chemistry, 2012, 51, 11198-11209 |
| 4118378 | CIF | C3 H7 N O6 Zn | P 63 2 2 | 7.1937; 7.1937; 8.1788 90; 90; 120 | 366.54 | Wei Li; Michael R. Probert; Monica Kosa; Thomas D. Bennett; A. Thirumurugan; Ryan P. Burwood; Michele Parinello; Judith A. K. Howard; Anthony K. Cheetham Negative Linear Compressibility of a Metal-Organic Framework Journal of the American Chemical Society, 2012, 134, 11940-11943 |
| 9015046 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.6031; 6.6031; 9.71 90; 90; 120 | 366.645 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 2.14 GPa American Mineralogist, 2012, 97, 1749-1763 |
| 7020139 | CIF | C Ca O3 | R -3 c :H | 4.9869; 4.9869; 17.0335 90; 90; 120 | 366.86 | Nielsen, Renie Birkedal; Norby, Poul; Kongshaug, Kjell Ove; Fjellvåg, Helmer Synthesis, crystal structure and thermal properties of Ca6(C12H14O4)4(CO3)(OH)2(H2O)x‒a 3D inorganic hybrid material. Dalton transactions (Cambridge, England : 2003), 2012, 41, 12082-12089 |
| 2236612 | CIF HKL Paper | C10 H14 Co N8 O2 | P -1 | 6.4315; 7.3879; 8.621 105.69; 107.94; 96.19 | 366.93 | Meng, S. C. A triclinic polymorph of <i>catena</i>-poly[[bis(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)cobalt(II)]-di-μ-1,5-dicyanamido-κ^4^<i>N</i>^1^:<i>N</i>^5^] Acta Crystallographica Section E, 2012, 68, m1404 |
| 7214755 | CIF | C8 H4 Cl Cu N2 O | P -1 | 3.8062; 9.0241; 11.0195 76.628; 89.855; 85.583 | 367.09 | Yong, Guo-Ping; Zhang, Yi-Man; Zhang, Bei Hydrothermal syntheses, crystal structures and properties of novel quinone biradical and mixed-valence copper coordination polymer with semiquinone radical ligand generated in situ CrystEngComm, 2012, 14, 8620 |
| 4118168 | CIF | C2 F O2 Pb | I 4/m | 4.1371; 4.1371; 21.477 90; 90; 90 | 367.59 | Honghan Fei; Catherine H. Pham; Scott R. J. Oliver Anion Exchange of the Cationic Layered Material [Pb2F2]2+ Journal of the American Chemical Society, 2012, 134, 10729-10732 |
| 4027307 | CIF | C16 H4 F10 N4 | P -1 | 4.881; 7.116; 10.683 86.323; 83.458; 88.653 | 367.8 | Sonja Geib; Susanne C. Martens; Ute Zschieschang; Florian Lombeck; Hubert Wadepohl; Hagen Klauk; Lutz H. Gade 1,3,6,8-Tetraazapyrenes: Synthesis, Solid-State Structures, and Properties as Redox-Active Materials Journal of Organic Chemistry, 2012, 77, 6107-6116 |
| 9014925 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.6094; 6.6094; 9.7239 90; 90; 120 | 367.871 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 1.12 GPa American Mineralogist, 2012, 97, 1749-1763 |
| 4118377 | CIF | C3 H7 N O6 Zn | P 63 2 2 | 7.2138; 7.2138; 8.1805 90; 90; 120 | 368.67 | Wei Li; Michael R. Probert; Monica Kosa; Thomas D. Bennett; A. Thirumurugan; Ryan P. Burwood; Michele Parinello; Judith A. K. Howard; Anthony K. Cheetham Negative Linear Compressibility of a Metal-Organic Framework Journal of the American Chemical Society, 2012, 134, 11940-11943 |
| 2018380 | CIF HKL Paper | C3 H8 Cl2 O S | P -1 | 6.68; 7.7862; 8.0017 78.019; 80.008; 65.665 | 369.13 | Yufit, Dmitry S.; Howard, Judith A. K. Molecular complexes of dimethyl sulfoxide with tri- and dichloromethane Acta Crystallographica Section C, 2012, 68, o37-o40 |
| 4329710 | CIF | Au4 Ga4 Na1.11 | I 4/m c m | 8.718; 8.718; 4.857 90; 90; 90 | 369.15 | Volodymyr Smetana; Gordon J. Miller; John D. Corbett Three Alkali-Metal-Gold-Gallium Systems. Ternary Tunnel Structures and Some Problems with Poorly Ordered Cations Inorganic Chemistry, 2012, 51, 7711-7721 |
| 9015677 | CIF | Ca0.32 Ce0.01 Dy0.03 Er0.03 F0.17 Fe0.01 Gd0.01 Ho0.01 Mn0.01 Na0.39 Nb0.02 Nd0.01 O4.83 Si Sn0.01 Ti0.94 Tm0.01 V0.01 Y0.15 Yb0.03 | C 1 2/c 1 | 6.5691; 8.6869; 7.0924 90; 114.127; 90 | 369.372 | Stepanov, A. V.; Bekenova, G. K.; Levin, V. L.; Hawthorne, F. C. Natrotitanite, ideally (Na0.5Y0.5)Ti(SiO4)O, a new mineral from the Verkhnee Espe deposit, Akjailyautas mountains, Eastern Kazakhstan district, Kazakhstan: description and crystal structure Mineralogical Magazine, 2012, 76, 37-44 |
| 2233652 | CIF HKL Paper | C6 H8 N O3 P | P 1 21 1 | 7.0967; 6.2911; 8.429 90; 100.606; 90 | 369.89 | Thiele, Kerstin; Wagner, Christoph; Merzweiler, Kurt Hydrogen 4-ammoniophenylphosphonate Acta Crystallographica Section E, 2012, 68, o263 |
| 4118376 | CIF | C3 H7 N O6 Zn | P 63 2 2 | 7.2282; 7.2282; 8.1778 90; 90; 120 | 370.02 | Wei Li; Michael R. Probert; Monica Kosa; Thomas D. Bennett; A. Thirumurugan; Ryan P. Burwood; Michele Parinello; Judith A. K. Howard; Anthony K. Cheetham Negative Linear Compressibility of a Metal-Organic Framework Journal of the American Chemical Society, 2012, 134, 11940-11943 |
| 4330358 | CIF | C6 H4 Ag2 N4 | P 1 21/c 1 | 9.12096; 6.14552; 6.62943 90; 95.2296; 90 | 370.05 | Aurel Tăbăcaru; Claudio Pettinari; Fabio Marchetti; Corrado di Nicola; Konstantin V. Domasevitch; Simona Galli; Norberto Masciocchi; Stefania Scuri; Iolanda Grappasonni; Mario Cocchioni Antibacterial Action of 4,4'-Bipyrazolyl-Based Silver(I) Coordination Polymers Embedded in PE Disks Inorganic Chemistry, 2012, 51, 9775-9788 |
| 2105151 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.5877; 5.617; 5.6894 90; 90; 90 | 370.3 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 4118375 | CIF | C3 H7 N O6 Zn | P 63 2 2 | 7.2411; 7.2411; 8.1789 90; 90; 120 | 371.39 | Wei Li; Michael R. Probert; Monica Kosa; Thomas D. Bennett; A. Thirumurugan; Ryan P. Burwood; Michele Parinello; Judith A. K. Howard; Anthony K. Cheetham Negative Linear Compressibility of a Metal-Organic Framework Journal of the American Chemical Society, 2012, 134, 11940-11943 |
| 1512648 | CIF | C6 H6 N2 O2 S | P -1 | 4.9593; 5.8203; 12.9937 84.979; 86.753; 84.647 | 371.54 | Kusai Alomar; Vincent Gaumet; Magali Allain; Pascal Richomme; Gilles Bouet Complexes of thiophene-2,3-dicarboxaldehyde bis(oxime) (2,3BTCOH2) with nickel(II) and copper(II): Synthesis, characterization, crystal structure of 2,3BTCOH2. Rearrangement reaction with nickel(II) bromide Inorganica Chimica Acta, 2012, 392, 433-439 |
| 2233821 | CIF HKL Paper | C7 H11 N O4 | P 1 21 1 | 4.6983; 14.5424; 5.5271 90; 99.663; 90 | 372.28 | Oliveira, F. L.; Freire, K. R. L.; Aparicio, R.; Coelho, F. (1<i>S</i>,2<i>R</i>,6<i>R</i>,7a<i>S</i>)-1,2,6-Trihydroxyhexahydro-1<i>H</i>-pyrrolizin-3-one Acta Crystallographica Section E, 2012, 68, o586 |
| 2105150 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.617; 5.611; 5.7156 90; 90; 90 | 372.6 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 2235343 | CIF HKL Paper | C6 H7 Br Cl N | P -1 | 4.3989; 6.2553; 13.8907 91.4; 93.58; 101.967 | 372.91 | Zhao, Min-Min 4-Chloroanilinium bromide Acta Crystallographica Section E, 2012, 68, o2022 |
| 8103336 | CIF | C10 H14 Co N4 O12 | P -1 | 5.0091; 8.1296; 9.55 74.444; 84.718; 88.887 | 373.05 | Bo Xiao Crystal structure of diaquabis(2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato-k2O,O')cobalt(II) dihydrate, Co(C5H3N2O4)2(H2O)2 · 2H2O Zeitschrift für Kristallographie - New Crystal Structures, 2012, 227, 161 |
| 2233890 | CIF HKL Paper | C4 O S5 | P 1 n 1 | 3.9638; 11.0211; 8.711 90; 101.344; 90 | 373.11 | Wen, Hua-Wen; Fan, Li-Xia; Liu, Li; Li, Ao; Fang, Qi 5-Sulfanylidene-2<i>H</i>,5<i>H</i>-1,3-dithiolo[4,5-<i>d</i>][1,3]dithiol-2-one Acta Crystallographica Section E, 2012, 68, o721 |
| 9014388 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.643; 6.643; 9.766 90; 90; 120 | 373.229 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 0.0001 GPa American Mineralogist, 2012, 97, 1749-1763 |
| 4118374 | CIF | C3 H7 N O6 Zn | P 63 2 2 | 7.2649; 7.2649; 8.1683 90; 90; 120 | 373.35 | Wei Li; Michael R. Probert; Monica Kosa; Thomas D. Bennett; A. Thirumurugan; Ryan P. Burwood; Michele Parinello; Judith A. K. Howard; Anthony K. Cheetham Negative Linear Compressibility of a Metal-Organic Framework Journal of the American Chemical Society, 2012, 134, 11940-11943 |
| 2236406 | CIF HKL Paper | C7 H7 Br N2 | P -1 | 4.3102; 6.1076; 14.51 91.719; 93.29; 101.428 | 373.45 | Vumbaco, David J.; Kammer, Michael N.; Koplitz, Lynn V.; Mague, Joel T. 4-Cyanoanilinium bromide Acta Crystallographica Section E, 2012, 68, o2884 |
| 2233154 | CIF HKL Paper | C7 H6 Cl N O2 | P -1 | 3.8721; 5.8068; 17.3721 95.563; 94.918; 104.657 | 373.64 | Xu, Yong; Yang, Ling-Ling; Yang, Sheng-Yong; Liu, Jie Methyl 6-chloronicotinate Acta Crystallographica Section E, 2012, 68, o162 |
| 4118373 | CIF | C3 H7 N O6 Zn | P 63 2 2 | 7.272; 7.272; 8.1678 90; 90; 120 | 374.06 | Wei Li; Michael R. Probert; Monica Kosa; Thomas D. Bennett; A. Thirumurugan; Ryan P. Burwood; Michele Parinello; Judith A. K. Howard; Anthony K. Cheetham Negative Linear Compressibility of a Metal-Organic Framework Journal of the American Chemical Society, 2012, 134, 11940-11943 |
| 1562917 | CIF | Ba F2 O7 Si2 Y2 | P -1 | 5.1576; 6.8389; 11.786 93.02; 102.05; 111.55 | 374.3 | McMillen, Colin D.; Emirdag-Eanes, Mehtap; Stritzinger, Jared T.; Kolis, Joseph W. Hydrothermal synthesis of new rare earth silicate fluorides: A novel class of polar materials Journal of Solid State Chemistry, 2012, 195, 155-160 |
| 7208520 | CIF | C14 H23 N3 O4 | P -1 | 5.7935; 7.509; 8.7271 92.984; 91.952; 98.57 | 374.57 | Aakeröy, Christer B.; Chopade, Prashant D.; Ganser, Claudia; Rajbanshi, Arbin; Desper, John Exploring the structural landscape of 2-aminopyrazines via co-crystallizations CrystEngComm, 2012, 14, 5845 |
| 2105112 | CIF Paper | C3 H7 N O3 | P 21 21 21 | 5.631; 6.921; 9.619 90; 90; 90 | 374.9 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 4118372 | CIF | C3 H7 N O6 Zn | P 63 2 2 | 7.2829; 7.2829; 8.1691 90; 90; 120 | 375.24 | Wei Li; Michael R. Probert; Monica Kosa; Thomas D. Bennett; A. Thirumurugan; Ryan P. Burwood; Michele Parinello; Judith A. K. Howard; Anthony K. Cheetham Negative Linear Compressibility of a Metal-Organic Framework Journal of the American Chemical Society, 2012, 134, 11940-11943 |
| 2233266 | CIF HKL Paper | As2 Ca H3 Mn0.976 O10 Zn1.024 | C 1 2/m 1 | 9.0727; 6.253; 7.415 90; 116.739; 90 | 375.68 | Yang, Yongbo W.; Evans, Stanley H.; Downs, Robert T.; Yang, Hexiong Lotharmeyerite, Ca(Zn,Mn)~2~(AsO~4~)~2~(H~2~O,OH)~2~ Acta Crystallographica Section E, 2012, 68, i9-i10 |
| 4328275 | CIF | H3 Na Ni2 O10 Se2 | C 1 2/m 1 | 8.8476; 6.2451; 7.4883 90; 114.531; 90 | 376.41 | Wassim Maalej; Serge Vilminot; Gilles André; Zakaria Elaoud; Tahar Mhiri; Mohamedally Kurmoo Crystal and Magnetic Structures and Magnetic Properties of Selenate Containing Natrochalcite, AIMII2(H3O2)(SeO4)2 Where A = Na or K and M = Mn, Co, or Ni Inorganic Chemistry, 2012, 51, 1953-1962 |
| 2236519 | CIF HKL Paper | C6 H3 B F5 Na | P 1 21 1 | 4.6813; 6.1986; 12.993 90; 92.995; 90 | 376.51 | Vitze, Hannes; Lerner, Hans-Wolfram; Bolte, Michael Sodium pentafluorophenylborate Acta Crystallographica Section E, 2012, 68, m1371 |
| 4118371 | CIF | C3 H7 N O6 Zn | P 63 2 2 | 7.3041; 7.3041; 8.164 90; 90; 120 | 377.2 | Wei Li; Michael R. Probert; Monica Kosa; Thomas D. Bennett; A. Thirumurugan; Ryan P. Burwood; Michele Parinello; Judith A. K. Howard; Anthony K. Cheetham Negative Linear Compressibility of a Metal-Organic Framework Journal of the American Chemical Society, 2012, 134, 11940-11943 |
| 2234203 | CIF HKL Paper | C5 H9 N O2 Pb S | P 1 21 1 | 6.251; 6.179; 10.259 90; 107.72; 90 | 377.5 | Schell, Adam C.; Parvez, Masood; Jalilehvand, Farideh Redetermination of (<small>D</small>-penicillaminato)lead(II) Acta Crystallographica Section E, 2012, 68, m489-m490 |
| 4330943 | CIF | C8 H7 N S | P 1 21 1 | 6.0033; 7.4485; 8.5108 90; 96.739; 90 | 377.94 | William T. Eckenhoff; Ashley B. Biernesser; Tomislav Pintauer Kinetic and Mechanistic Aspects of Atom Transfer Radical Addition (ATRA) Catalyzed by Copper Complexes with Tris(2-pyridylmethyl)amine Inorganic Chemistry, 2012, 51, 11917-11929 |
| 7215088 | CIF | C2 H6 N8 O4 | C 1 2/m 1 | 7.7443; 6.2459; 8.7 90; 116.052; 90 | 378.06 | Fischer, Niko; Fischer, Dennis; Klapötke, Thomas M.; Piercey, Davin G.; Stierstorfer, Jörg Pushing the limits of energetic materials ‒ the synthesis and characterization of dihydroxylammonium 5,5′-bistetrazole-1,1′-diolate Journal of Materials Chemistry, 2012, 22, 20418 |
| 2105149 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.6535; 5.681; 5.7217 90; 90; 90 | 378.8 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 7018889 | CIF | F Li Na Ni O4 P | P 1 21/c 1 | 6.772; 11.154; 5.021 90; 90; 90 | 379.3 | Ben Yahia, Hamdi; Shikano, Masahiro; Koike, Shinji; Tatsumi, Kuniaki; Kobayashi, Hironori Single crystal X-ray structure study of the Li2−xNaxNi[PO4]F system Dalton Transactions, 2012, 41, 5838 |
| 4328185 | CIF | Au4 Ga4 K1.11 | I 4/m c m | 8.861; 8.861; 4.8339 90; 90; 90 | 379.5 | Volodymyr Smetana; John D. Corbett; Gordon J. Miller Four Polyanionic Compounds in the K-Au-Ga System: A Case Study in Exploratory Synthesis and of the Art of Structural Analysis Inorganic Chemistry, 2012, 51, 1695-1702 |
| 2233778 | CIF HKL Paper | C18 H12 N4 | P -1 | 6.389; 7.608; 8.311 103.96; 91.67; 102.97 | 380.6 | Akerman, Matthew P.; Maher, Sarah J. (<i>E</i>)-2,3-Bis[(<i>E</i>)-benzylideneamino]but-2-enedinitrile Acta Crystallographica Section E, 2012, 68, o688 |
| 2234188 | CIF HKL Paper | C4 H5 Cl2 Hg N3 | P 1 21/m 1 | 3.8317; 14.1366; 7.0773 90; 96.814; 90 | 380.65 | Eshtiagh-Hosseini, Hossein; Yousefi, Zakieh; Janiak, Agnieszka Poly[(μ~2~-2-aminopyrimidine-κ^2^<i>N</i>^1^:<i>N</i>^3^)di-μ~2~-chlorido-mercury(II)] Acta Crystallographica Section E, 2012, 68, m385-m386 |
| 4027314 | CIF | C14 Cl4 F6 N4 | P -1 | 5.101; 7.908; 9.882 80.425; 82.339; 76.7 | 380.7 | Sonja Geib; Susanne C. Martens; Ute Zschieschang; Florian Lombeck; Hubert Wadepohl; Hagen Klauk; Lutz H. Gade 1,3,6,8-Tetraazapyrenes: Synthesis, Solid-State Structures, and Properties as Redox-Active Materials Journal of Organic Chemistry, 2012, 77, 6107-6116 |
| 2234831 | CIF Paper | Co2 H4 O10 P2 Pb | P 1 21/m 1 | 7.4299; 6.2949; 8.9057 90; 113.936; 90 | 380.702 | Assani, Abderrazzak; Saadi, Mohamed; Zriouil, Mohammed; El Ammari, Lahcen Dicobalt(II) lead(II) hydrogenphosphate(V) phosphate(V) hydroxide monohydrate Acta Crystallographica Section E, 2012, 68, i30 |
| 7152640 | CIF | C7 H12 N2 O2 | P -1 | 5.65; 7.884; 9.777 110.051; 90.33; 109.728 | 381.45 | Ha, Khanh; Monbaliu, Jean-Christophe M; Williams, Byron C.; Pillai, Girinath G.; Ocampo, Charles E.; Zeller, Matthias; Stevens, Christian V.; Katritzky, Alan R. A convenient synthesis of difficult medium-sized cyclic peptides by Staudinger mediated ring-closure. Organic & biomolecular chemistry, 2012, 10, 8055-8058 |
| 2018565 | CIF Paper | Ge4 La2 Li Si2 | C m m m | 4.1462; 21.0674; 4.3704 90; 90; 90 | 381.753 | Stetskiv, Andrij; Misztal, Renata; Pavlyuk, Volodymyr Crystal and electronic structures of La~2~LiGe~6{-~<i>x</i>} (<i>x</i> = 0.21) and La~2~LiGe~4~Si~2~ Acta Crystallographica Section C, 2012, 68, i60-i64 |
| 2105148 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.677; 5.705; 5.7311 90; 90; 90 | 381.79 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 2236604 | CIF HKL Paper | C16 H14 Cl N O3 S | P 1 | 4.0656; 7.7855; 12.242 96.263; 91.38; 97.228 | 381.84 | Yousuf, Sammer; Shah, Shazia; Ambreen, Nida; Khan, Khalid M.; Ahmad, Shakil 5-Chloro-2-(3,4,5-trimethoxyphenyl)-1,3-benzothiazole Acta Crystallographica Section E, 2012, 68, o3057 |
| 2235810 | CIF HKL Paper | C18 H16 O6 | P -1 | 4.6607; 8.4769; 9.811 94.859; 91.41; 97.278 | 382.87 | Ohta, Akira; Hattori, Kazuki; Kawase, Takeshi; Kobayashi, Takashi; Naito, Hiroyoshi; Kitamura, Chitoshi 2,3,6,7-Tetramethoxy-9,10-anthraquinone Acta Crystallographica Section E, 2012, 68, o2587 |
| 2105256 | CIF Paper | C8 H8 N2 O2 | P -1 | 3.9506; 8.264; 12.045 78.842; 83.18; 86.99 | 382.9 | Britton, Doyle; Young, Jr, Victor G.; Noland, Wayland E.; Pinnow, Matthew J.; Clark, Christopher M. Four polymorphs (polytypes) of 5,6-dimethylbenzofurazan 1-oxide Acta Crystallographica Section B, 2012, 68, 536-542 |
| 2236039 | CIF HKL Paper | C18 H24 I2 | P -1 | 6.8912; 6.9725; 8.9927 67.964; 74.368; 78.258 | 383.16 | Ioannou, Savvas; Moushi, Eleni 2,9-Diiodohexacyclo[9.3.1.1^2,6^.1^4,8^.1^9,13^.0^1,8^]octadecane Acta Crystallographica Section E, 2012, 68, o2340-o2341 |
| 7030284 | CIF | C2 H4 Ba O6 S2 | P m n 21 | 6.259; 8.266; 7.411 90; 90; 90 | 383.42 | Abdollahian, Yashar; Hauser, Jesse L.; Rogow, David L.; Oliver, Allen G.; Oliver, Scott R. J. Solvothermal synthesis and characterization of two inorganic-organic hybrid materials based on barium. Dalton transactions (Cambridge, England : 2003), 2012, 41, 12630-12634 |
| 4118670 | CIF | Cr H8 N2 O8 Rb | I -4 2 m | 6.9862; 6.9862; 7.9044 90; 90; 90 | 385.79 | Raghabendra Samantaray; Ronald J. Clark; Eun S. Choi; Naresh S. Dalal Elucidating the Mechanism of Multiferroicity in (NH4)3Cr(O2)4 and Its Tailoring by Alkali Metal Substitution Journal of the American Chemical Society, 2012, 134, 15953-15962 |
| 4329711 | CIF | Au4 Ga4 Rb1.12 | I 4/m c m | 8.9496; 8.9496; 4.8293 90; 90; 90 | 386.8 | Volodymyr Smetana; Gordon J. Miller; John D. Corbett Three Alkali-Metal-Gold-Gallium Systems. Ternary Tunnel Structures and Some Problems with Poorly Ordered Cations Inorganic Chemistry, 2012, 51, 7711-7721 |
| 2235554 | CIF HKL Paper | C6 H6 N2 O5 | P -1 | 6.753; 7.5024; 8.4439 81.895; 82.215; 66.769 | 387.69 | Al-Farhan, Khalid; Khair, Miftahul; Ghazzali, Mohamed 3-Carboxypyridinium nitrate Acta Crystallographica Section E, 2012, 68, o2246 |
| 4027223 | CIF | C10 H8 O2 | P 1 21 1 | 4.05; 16.162; 5.946 90; 94.298; 90 | 388.1 | Veerababurao Kavala; Cheng-Chuan Wang; Deepak Kumar Barange; Chun-Wei Kuo; Po-Min Lei; Ching-Fa Yao Synthesis of Isocoumarin Derivatives via the Copper-Catalyzed Tandem Sequential Cyclization of 2- Halo-N-phenyl Benzamides and Acyclic 1,3-Diketones Journal of Organic Chemistry, 2012, 77, 5022-5029 |
| 2018564 | CIF Paper | Ge11.58 La4 Li2 | C m m m | 4.1871; 21.1132; 4.3912 90; 90; 90 | 388.196 | Stetskiv, Andrij; Misztal, Renata; Pavlyuk, Volodymyr Crystal and electronic structures of La~2~LiGe~6{-~<i>x</i>} (<i>x</i> = 0.21) and La~2~LiGe~4~Si~2~ Acta Crystallographica Section C, 2012, 68, i60-i64 |
| 2235620 | CIF HKL Paper | C20 H16 N2 O2 | P -1 | 4.57; 9.4947; 9.892 67.986; 77.487; 84.132 | 388.37 | Al-Mehana, Wisam Naji Atiyah; Yahya, Rosiyah; Sonsudin, Faridah; Lo, Kong Mun (<i>E</i>,<i>E</i>)-1,2-Bis[3-(prop-2-yn-1-yloxy)benzylidene]hydrazine Acta Crystallographica Section E, 2012, 68, o2087 |
| 4506172 | CIF | C7 H4 N3 O Tl | P -1 | 3.7364; 9.365; 12.156 68.14; 86.965; 79.763 | 388.45 | Marcano, Daniela; Gerasimchuk, Nikolay; Nemykin, Victor; Silchenko, Svitlana Synthesis, Characterization, and Studies of Coordination-Polymeres With Isomeric Pyridylcyanoximes: Route to Metal Ribbons With Very Short Tl···Tl Separations Crystal Growth & Design, 2012, 12, 2877 |
| 7020295 | CIF | Co2 F2 O3 Se | P n m a | 7.2655; 10.0013; 5.3564 90; 90; 90 | 389.22 | Hu, Shichao; Johnsson, Mats Synthesis and crystal structure of two synthetic oxofluoride framework compounds - Co(2)TeO(3)F(2) and Co(2)SeO(3)F(2). Dalton transactions (Cambridge, England : 2003), 2012, 41, 12786-12789 |
| 7019205 | CIF | C3 H6 Mo N2 O6 | P 1 21/m 1 | 7.3757; 6.7764; 8.5456 90; 114.26; 90 | 389.4 | Herbert, Matthew; Montilla, Francisco; Alvarez, Eleuterio; Galindo, Agustín New insights into the mechanism of oxodiperoxomolybdenum catalysed olefin epoxidation and the crystal structures of several oxo-peroxo molybdenum complexes. Dalton transactions (Cambridge, England : 2003), 2012, 41, 6942-6956 |
| 2105147 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.77; 5.751; 5.7748 90; 90; 90 | 390.9 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 2105103 | CIF HKL Paper | C3 H7 N O3 | P 1 21/n 1 | 4.7505; 8.6644; 9.725 90; 102.35; 90 | 391 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 2105085 | CIF HKL Paper | C18 H12 N4 O4 | P -1 | 4.53125; 5.99235; 14.7567 88.2562; 81.6029; 81.2337 | 391.747 | Vella-Zarb, Liana; Dinnebier, Robert E. Form, function and functionality of two dimeric toluene-2,4-diisocyanate polymorphs Acta Crystallographica Section B, 2012, 68, 204-208 |
| 4118667 | CIF | Cr H12 N3 O8 | I -4 2 m | 6.9951; 6.9951; 8.028 90; 90; 90 | 392.82 | Raghabendra Samantaray; Ronald J. Clark; Eun S. Choi; Naresh S. Dalal Elucidating the Mechanism of Multiferroicity in (NH4)3Cr(O2)4 and Its Tailoring by Alkali Metal Substitution Journal of the American Chemical Society, 2012, 134, 15953-15962 |
| 7052926 | CIF | C2 H4 N12 | P 1 21/n 1 | 6.485; 5.583; 10.854 90; 90.786; 90 | 392.9 | Li, Fang; Cong, Xiaomin; Du, Zhiming; He, Chunlin; Zhao, Linshuang; Meng, Lingqiao 1,1′-Diamino-5,5′-azotetrazole: a nitrogen rich compound New Journal of Chemistry, 2012, 36, 1953 |
| 7208271 | CIF | C7 H7 Cl O4 | P -1 | 3.7289; 8.243; 13.0565 80.768; 87.719; 83.755 | 393.67 | Montis, Riccardo; Hursthouse, Michael B. Surprisingly complex supramolecular behaviour in the crystal structures of a family of mono-substituted salicylic acids CrystEngComm, 2012, 14, 5242 |
| 1508496 | CIF | C3 H4 N2 O | P 21 21 21 | 5.1024; 8.2922; 9.3064 90; 90; 90 | 393.75 | Laus, Gerhard; Kahlenberg, Volker Crystal Structures of 1-Hydroxyimidazole and Its Salts Crystals, 2012, 2, 1492-1501 |
| 7222429 | CIF | Mn5 Si3 | C c m m | 6.90396; 11.89561; 4.7959 90; 90; 90 | 393.872 | Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material Journal of Materials Chemistry, 2012, 22, 15275 |
| 7222430 | CIF | Mn5 Si3 | C c m m | 6.90198; 11.90062; 4.7964 90; 90; 90 | 393.966 | Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material Journal of Materials Chemistry, 2012, 22, 15275 |
| 7222431 | CIF | Mn5 Si3 | C c m m | 6.899; 11.90799; 4.7973 90; 90; 90 | 394.114 | Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material Journal of Materials Chemistry, 2012, 22, 15275 |
| 2233786 | CIF HKL Paper | C6 H12 Nd2 O18 | P -1 | 6.036; 7.603; 8.906 98.386; 99.742; 96.802 | 394.2 | Cao, Gao-Juan; Rong, Cheng; Li, Qing-lu; Jiang, Wen-Jing Poly[[tetraaquadi-μ~4~-oxalato-μ~2~-oxalato-dineodymium(III)] dihydrate] Acta Crystallographica Section E, 2012, 68, m289 |
| 7208528 | CIF | C6 H7 Br Cl N | P -1 | 4.498; 6.1858; 14.4538 90.9386; 94.9448; 100.039 | 394.33 | Cao, Lili; Liu, Zhi; Wang, Tao; Dai, Hongxia; Zhang, Liangmin; Tao, Xutang; Cui, Deliang Investigation of a new organic/inorganic hybrid crystal tri(p-chloro-anilium) pentabromocadmate(II) by in situ PXRD and FTIR methods: Thermal stability and the route to suppress its decomposition CrystEngComm, 2012, 14, 5795 |
| 7222428 | CIF | Mn5 Si3 | ? | 6.8924; 11.9164; 4.80483 90; 90; 90.2 | 394.63 | Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material Journal of Materials Chemistry, 2012, 22, 15275 |
| 7222426 | CIF | Mn5 Si3 | ? | 6.8929; 11.9152; 4.8061 90; 90; 90.222 | 394.72 | Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material Journal of Materials Chemistry, 2012, 22, 15275 |
| 7222425 | CIF | Mn5 Si3 | ? | 6.8939; 11.9135; 4.80731 90; 90; 90.262 | 394.82 | Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material Journal of Materials Chemistry, 2012, 22, 15275 |
| 7222424 | CIF | Mn5 Si3 | ? | 6.8943; 11.9131; 4.80742 90; 90; 90.268 | 394.84 | Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material Journal of Materials Chemistry, 2012, 22, 15275 |
| 2105111 | CIF HKL Paper | C3 H7 N O3 | P 21 21 21 | 5.489; 8.339; 8.632 90; 90; 90 | 395.1 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 2105146 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.7991; 5.7917; 5.79 90; 90; 90 | 395.67 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 2105102 | CIF HKL Paper | C3 H7 N O3 | P 1 21/n 1 | 4.7576; 8.7046; 9.785 90; 102.25; 90 | 396 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 4027546 | CIF | C6 H6 B I O2 | P -1 | 4.9134; 7.2588; 11.1904 93.4364; 92.2282; 95.7291 | 396 | Nicolas Gernigon; Raed M. Al-Zoubi; Dennis G. Hall Direct Amidation of Carboxylic Acids Catalyzed byortho-Iodo Arylboronic Acids: Catalyst Optimization, Scope, and Preliminary Mechanistic Study Supporting a Peculiar Halogen Acceleration Effect Journal of Organic Chemistry, 2012, 77, 8386-8400 |
| 9016498 | CIF | Al H Na2 O9 Si3 | P -1 | 7.2474; 7.6813; 8.6432 90.835; 99.771; 122.581 | 396.295 | Williams, E. R.; Weller, M. T. A variable-temperature neutron diffraction study of ussingite; a strong asymmetric hydrogen bond in an aluminosilicate framework Note: T = 4 K Physics and Chemistry of Minerals, 2012, 39, 471-478 |
| 4505867 | CIF | C18 H16 N2 O4 | P -1 | 5.741; 8.219; 8.838 83.59; 75.06; 80.87 | 396.73 | Tsaggeos, Kostas; Masiera, Natalia; Niwicka, Aleksandra; Dokorou, Vassiliki; Siskos, Michael G.; Skoulika, Stavroula; Michaelides, Adonis Crystal Structure, Thermal Behavior, and Photochemical Reactivity of a Series of Co-Crystals oftrans-1,2-Bis(4-pyridyl) Ethylene with Dicarboxylic Acids Crystal Growth & Design, 2012, 12, 2187 |
| 4329712 | CIF | Au4 Cs1.08 Ga4 | I 4/m c m | 9.0773; 9.0773; 4.8154 90; 90; 90 | 396.78 | Volodymyr Smetana; Gordon J. Miller; John D. Corbett Three Alkali-Metal-Gold-Gallium Systems. Ternary Tunnel Structures and Some Problems with Poorly Ordered Cations Inorganic Chemistry, 2012, 51, 7711-7721 |
| 7208789 | CIF | C8 H8 N4 | P 1 21 1 | 7.6843; 5.5794; 9.4459 90; 100.949; 90 | 397.61 | Spencer, John; Patel, Hiren; Deadman, John J.; Palmer, Rex A.; Male, Louise; Coles, Simon J.; Uzoh, Ogaga G.; Price, Sarah L. The unexpected but predictable tetrazole packing in flexible 1-benzyl-1H-tetrazole CrystEngComm, 2012, 14, 6441 |
| 9015207 | CIF | Fe Ge3 H4 O10 Pb | P 1 21/m 1 | 5.8279; 13.615; 6.3097 90; 127.314; 90 | 398.184 | Origlieri, M. J.; Yang, H.; Downs, R. T.; Posner, E. S.; Domanik, K. J.; Pinch, W. W. The crystal structure of bartelkeite, with a revised chemical formula, PbFeGeVI(GeIV2O7)(OH)2*H2O, isotypic with high-pressure P21/m lawsonite American Mineralogist, 2012, 97, 1812-1815 |
| 1514065 | CIF | Li2 Mn O3 | C 1 2/c 1 | 4.927; 8.511; 9.624 90; 99.08; 90 | 398.5 | Song, Bohang; Lai, Man On; Lu, Li Influence of Ru substitution on Li-rich 0.55(Li2 Mn O3) * 0.45(Li Ni1/3 Co1/3 Mn1/3 O2) cathode for Li-ion batteries Electrochimica Acta, 2012, 80, 187-195 |
| 7020296 | CIF | Co2 F2 O3 Te | P n m a | 7.381; 10.1936; 5.3013 90; 90; 90 | 398.86 | Hu, Shichao; Johnsson, Mats Synthesis and crystal structure of two synthetic oxofluoride framework compounds - Co(2)TeO(3)F(2) and Co(2)SeO(3)F(2). Dalton transactions (Cambridge, England : 2003), 2012, 41, 12786-12789 |
| 1515095 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 6.828; 5.4298; 10.8209 90; 96.076; 90 | 398.93 | Ogborn, Joseph M.; Collings, Ines E.; Moggach, Stephen A.; Thompson, Amber L.; Goodwin, Andrew L. Supramolecular mechanics in a metal‒organic framework Chemical Science, 2012, 3, 3011 |
| 2018489 | CIF HKL Paper | La Zn4 | C m c m | 6.34; 10.312; 6.122 90; 90; 90 | 400.2 | Oshchapovsky, Igor; Pavlyuk, Volodymyr; Dmytriv, Grygoriy; Griffin, Alexandra Lanthanum tetrazinc, LaZn~4~ Acta Crystallographica Section C, 2012, 68, i37-i40 |
| 2234363 | CIF HKL Paper | C3 H7 N5 O6 | P -1 | 4.9934; 6.7454; 12.446 97.572; 100.524; 98.933 | 401.59 | Berrah, Fadila; Bouchene, Rafika; Bouacida, Sofiane; Roisnel, Thierry 5-Amino-3-carboxy-1<i>H</i>-1,2,4-triazol-4-ium nitrate monohydrate Acta Crystallographica Section E, 2012, 68, o1116 |
| 2236498 | CIF HKL Paper | C8 H9 N O3 | P 1 21 1 | 4.8159; 10.2482; 8.3573 90; 102.842; 90 | 402.15 | Guedem, Alphonsine N.; Sandjo, Louis P.; Opatz, Till; Schollmeyer, Dieter; Ngadjui, Bonaventure T. (2<i>E</i>,4<i>R</i>,5<i>R</i>,6<i>S</i>)-2-(4,5,6-Trihydroxycyclohex-2-en-1-ylidene)acetonitrile Acta Crystallographica Section E, 2012, 68, o2737 |
| 2105101 | CIF HKL Paper | C3 H7 N O3 | P 1 21/n 1 | 4.7708; 8.7429; 9.864 90; 102.14; 90 | 402.2 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 1563013 | CIF | As0.1 Co2 H O5 P0.9 | P n n m | 8.0509; 8.3946; 5.9533 90; 90; 90 | 402.35 | de Pedro, I.; Rojo, J.M.; Rodríguez Fernández, J.; Sanchez Marcos, J.; Fernández-Díaz, M.T.; Rojo, T. Heat capacity and neutron diffraction studies on the frustrated magnetic Co2(OH)(PO4)1−x(AsO4)x [0≤x≤1] solid solution Journal of Solid State Chemistry, 2012, 188, 1-10 |
| 1562924 | CIF | Al8.24 Gd Mn3.76 | I 4/m m m | 8.878; 8.878; 5.119 90; 90; 90 | 403.47 | Fulfer, Bradford W.; Haldolaarachchige, Neel; Young, David P.; Chan, Julia Y. Crystal growth and magnetic properties of Ln-Mn-Al (Ln=Gd, Yb) compounds of the CaCr2Al10 and ThMn12 structure types Journal of Solid State Chemistry, 2012, 194, 143-150 |
| 7208532 | CIF | C7 H9 N O3 | P -1 | 7.619; 7.888; 8.147 65.33; 66.81; 72.58 | 403.6 | Prohens, Rafel; Portell, Anna; Puigjaner, Cristina; Barbas, Rafael; Alcobé, Xavier; Font-Bardia, Mercè; Tomàs, Salvador Cooperative induction in double H-bonding donor/acceptor compounds: Chains vs. ribbons CrystEngComm, 2012, 14, 5745 |
| 2105145 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.852; 5.8715; 5.8057 90; 90; 90 | 404.01 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 7107636 | CIF | C8.5 H6 Fe N7 Pt S0.5 | P 4/m m m | 7.4564; 7.4564; 7.2671 90; 90; 90 | 404.04 | Francisco J. Munoz Lara; Ana B. Gaspar; Daniel Aravena; Eliseo Ruiz; M. Carmen Munoz; Masaaki Ohba; Ryo Ohtani; Susumu Kitagawa; Jose A. Real Enhanced bistability by guest inclusion in Fe(II) spin crossover porous coordination polymers Chem.Commun., 2012, 48, 4686 |
| 4328355 | CIF HKL | F4 La Rb | P n m a | 6.462812; 3.864979; 16.17629 90; 90; 90 | 404.062 | Anne-Laure Rollet; Mathieu Allix; Emmanuel Veron; Michael Deschamps; Valérie Montouillout; Matthew R. Suchomel; Emmanuelle Suard; Maud Barre; Manuel Ocaña; Aymeric Sadoc; Florent Boucher; Catherine Bessada; Dominique Massiot; Franck Fayon Synthesis and Structure Resolution of RbLaF4 Inorganic Chemistry, 2012, 51, 2272-2282 |
| 4118671 | CIF | Cr Cs H8 N2 O8 | I -4 2 m | 7.0386; 7.0386; 8.1748 90; 90; 90 | 405 | Raghabendra Samantaray; Ronald J. Clark; Eun S. Choi; Naresh S. Dalal Elucidating the Mechanism of Multiferroicity in (NH4)3Cr(O2)4 and Its Tailoring by Alkali Metal Substitution Journal of the American Chemical Society, 2012, 134, 15953-15962 |
| 1515094 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 6.871; 5.467; 10.8393 90; 95.878; 90 | 405.02 | Ogborn, Joseph M.; Collings, Ines E.; Moggach, Stephen A.; Thompson, Amber L.; Goodwin, Andrew L. Supramolecular mechanics in a metal‒organic framework Chemical Science, 2012, 3, 3011 |
| 2234129 | CIF HKL Paper | C9 H7 N3 | P -1 | 3.8754; 8.7795; 12.1773 97.517; 90.962; 98.689 | 405.76 | Asiri, Abdullah M.; Faidallah, Hassan M.; Al-Thabaiti, Shaeel A.; Ng, Seik Weng; Tiekink, Edward R. T. 2-[(1-Methyl-1<i>H</i>-pyrrol-2-yl)methylidene]propanedinitrile Acta Crystallographica Section E, 2012, 68, o1170 |
| 2236230 | CIF HKL Paper | C7 H10 N2 O2 | P -1 | 7.1102; 7.817; 8.2454 97.27; 93.431; 115.68 | 406.31 | Kant, Rajni; Gupta, Vivek K.; Kapoor, Kamini; Patil, D. R.; Salunkhe, D. K.; Deshmukh, Madhukar B. Methyl (2<i>E</i>)-2-cyano-3-(dimethylamino)prop-2-enoate Acta Crystallographica Section E, 2012, 68, o3121 |
| 4118169 | CIF | C5 H6 F2 O4 Pb2 | I 4/m | 4.116; 4.116; 24.003 90; 90; 90 | 406.6 | Honghan Fei; Catherine H. Pham; Scott R. J. Oliver Anion Exchange of the Cationic Layered Material [Pb2F2]2+ Journal of the American Chemical Society, 2012, 134, 10729-10732 |
| 2018708 | CIF HKL Paper | Fe6.23 H1.55 O24 P6 | P -1 | 6.3445; 7.9353; 9.2829 105.303; 108.176; 101.7 | 407.03 | Dal Bo, Fabrice; Hatert, Frédéric Fe~6.67~(PO~4~)~5.35~(HPO~4~)~0.65~ and Fe~6.23~(PO~4~)~4.45~(HPO~4~)~1.55~: two new mixed-valence iron phosphates Acta Crystallographica Section C, 2012, 68, i83-i85 |
| 1563012 | CIF | As0.25 Co2 H O5 P0.75 | P n n m | 8.0979; 8.4325; 5.9661 90; 90; 90 | 407.4 | de Pedro, I.; Rojo, J.M.; Rodríguez Fernández, J.; Sanchez Marcos, J.; Fernández-Díaz, M.T.; Rojo, T. Heat capacity and neutron diffraction studies on the frustrated magnetic Co2(OH)(PO4)1−x(AsO4)x [0≤x≤1] solid solution Journal of Solid State Chemistry, 2012, 188, 1-10 |
| 2105110 | CIF HKL Paper | C3 H7 N O3 | P 21 21 21 | 5.5267; 8.366; 8.812 90; 90; 90 | 407.4 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 1562929 | CIF | Al9.1 Mn2.9 Yb | I 4/m m m | 8.94; 8.94; 5.102 90; 90; 90 | 407.77 | Fulfer, Bradford W.; Haldolaarachchige, Neel; Young, David P.; Chan, Julia Y. Crystal growth and magnetic properties of Ln-Mn-Al (Ln=Gd, Yb) compounds of the CaCr2Al10 and ThMn12 structure types Journal of Solid State Chemistry, 2012, 194, 143-150 |
| 2233440 | CIF HKL Paper | Fe0.17 Mg0.46 Na0.97 O6 Si2.4 | P 1 2/n 1 | 9.4432; 8.6457; 5.254 90; 108.003; 90 | 407.95 | Posner, Esther S.; Konzett, Jürgen; Frost, Daniel J.; Downs, Robert T.; Yang, Hexiong High-pressure synthetic (Na~0.97~Mg~0.03~)(Mg~0.43~Fe~0.17~^3+^Si~0.40~)Si~2~O~6~, with six-coordinated silicon, isostructural with <i>P</i>2/<i>n</i> omphacite Acta Crystallographica Section E, 2012, 68, i18 |
| 7207333 | CIF | C12 H12 Cd I2 N6 | P -1 | 4.1197; 8.0163; 12.4386 91.739; 94.104; 94.716 | 408.07 | Bai, Yan; Wang, Jun-Li; Dang, Dong-Bin; Li, Meng-Meng; Niu, Jing-Yang Assembly of four d10-metal inorganic‒organic hybrid coordination polymers based on bipyrazine imine-based ligand: Synthesis, crystal structures and luminescent properties CrystEngComm, 2012, 14, 1575 |
| 2105100 | CIF HKL Paper | C3 H7 N O3 | P 1 21/n 1 | 4.7926; 8.7932; 9.907 90; 102.14; 90 | 408.2 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 4330063 | CIF | Cu6 Eu2 P5 | I 4/m m m | 4.0745; 4.0745; 24.6132 90; 90; 90 | 408.617 | Dmitri O. Charkin; Arthur V. Urmanov; Sergey M. Kazakov; Dmitri Batuk; Artem M. Abakumov; Stephan Knöner; Elena Gati; Bernd Wolf; Michael Lang; Andrey V. Shevelkov; Gustaaf Van Tendeloo; Evgeni V. Antipov Synthesis, Crystal Structure, Transport, and Magnetic Properties of Novel Ternary Copper Phosphides, A2Cu6P5 (A = Sr, Eu) and EuCu4P3 Inorganic Chemistry, 2012, 51, 8948-8955 |
| 7215084 | CIF | C2 H8 N10 O4 | P 1 21/c 1 | 5.4872; 11.5472; 6.4833 90; 95.402; 90 | 408.97 | Fischer, Niko; Fischer, Dennis; Klapötke, Thomas M.; Piercey, Davin G.; Stierstorfer, Jörg Pushing the limits of energetic materials ‒ the synthesis and characterization of dihydroxylammonium 5,5′-bistetrazole-1,1′-diolate Journal of Materials Chemistry, 2012, 22, 20418 |
| 4119048 | CIF | C2 H6 N8 O5 | P -1 | 5.6251; 7.8446; 9.7402 76.794; 89.114; 77.979 | 409.03 | Thomas M. Klapötke; Christian Petermayer; Davin G. Piercey; Jörg Stierstorfer 1,3-Bis(nitroimido)-1,2,3-triazolate Anion, the N-Nitroimide Moiety, and the Strategy of Alternating Positive and Negative Charges in the Design of Energetic Materials Journal of the American Chemical Society, 2012, 134, 20827-20836 |
| 7208663 | CIF | C4 H10 O | P 21 21 21 | 5.0122; 5.0885; 16.044 90; 90; 90 | 409.2 | Podsiadło, Marcin; Patyk, Ewa; Katrusiak, Andrzej Chiral aggregation hierarchy in high-pressure resolved 2-butanol and 2,3-butanediol CrystEngComm, 2012, 14, 6419 |
| 7215083 | CIF | C2 H8 N10 O4 | P 1 21/c 1 | 5.426; 11.6597; 6.5013 90; 95.256; 90 | 409.58 | Fischer, Niko; Fischer, Dennis; Klapötke, Thomas M.; Piercey, Davin G.; Stierstorfer, Jörg Pushing the limits of energetic materials ‒ the synthesis and characterization of dihydroxylammonium 5,5′-bistetrazole-1,1′-diolate Journal of Materials Chemistry, 2012, 22, 20418 |
| 1563072 | CIF | Gd2 O4 Se3 U2 | P b a m | 6.9724; 14.8052; 3.9678 90; 90; 90 | 409.59 | Raw, Adam D.; Ibers, James A. Syntheses and crystal structures of the quaternary uranium lanthanide oxyselenides UYb2O2Se3 and U2Ln2O4Se3 (Ln=Pr, Sm, Gd) Journal of Solid State Chemistry, 2012, 186, 177-181 |
| 7238570 | CIF | C3 H10 Cl2 N2 O4 | P -1 | 5.9899; 7.4765; 9.347 93.62; 101.1; 91.12 | 409.73 | Miró Sabaté, Carles; Delalu, Henri; Forquet, Valérian; Jeanneau, Erwann Salts of 1-(chloromethyl)-1,1-dimethylhydrazine and ionic liquids RSC Advances, 2012, 2, 3691 |
| 2236579 | CIF HKL Paper | C7 H7 I N2 | P 4/n m m :2 | 4.993; 4.993; 16.445 90; 90; 90 | 409.97 | Mague, Joel T.; Vumbaco, David J.; Kammer, Michael N.; Koplitz, Lynn V. 4-Cyanoanilinium iodide Acta Crystallographica Section E, 2012, 68, o2623 |
| 2236592 | CIF HKL Paper | Ge S3 Ti | P n m a | 8.9263; 3.4673; 13.2596 90; 90; 90 | 410.39 | Kim, Pilsoo; Yun, Hoseop TiGeS~3~ Acta Crystallographica Section E, 2012, 68, i72 |
| 4506806 | CIF | C9 H7 N3 O2 | P 1 n 1 | 3.9626; 6.2888; 16.5205 90; 94.462; 90 | 410.44 | Wang, Yu-Ling; Fu, Jiang-Hong; Wei, Jia-Jia; Xu, Xiang; Li, Xin-Fa; Liu, Qing-Yan Noncentrosymmetric Organic Solid and Its Zinc Coordination Polymer with Diamonded Network Prepared from an Ionothermal Reaction: Syntheses, Crystal Structures, and Second-Order Nonlinear Optics Properties Crystal Growth & Design, 2012, 12, 4663 |
| 2105109 | CIF HKL Paper | C3 H7 N O3 | P 21 21 21 | 5.514; 8.396; 8.868 90; 90; 90 | 410.5 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 2018707 | CIF HKL Paper | Fe6.67 H0.65 O24 P6 | P -1 | 6.3609; 7.975; 9.322 105.278; 108.055; 101.993 | 411.55 | Dal Bo, Fabrice; Hatert, Frédéric Fe~6.67~(PO~4~)~5.35~(HPO~4~)~0.65~ and Fe~6.23~(PO~4~)~4.45~(HPO~4~)~1.55~: two new mixed-valence iron phosphates Acta Crystallographica Section C, 2012, 68, i83-i85 |
| 4328274 | CIF | H3 K Ni2 O10 Se2 | C 1 2/m 1 | 8.9687; 6.5305; 7.6587 90; 113.382; 90 | 411.73 | Wassim Maalej; Serge Vilminot; Gilles André; Zakaria Elaoud; Tahar Mhiri; Mohamedally Kurmoo Crystal and Magnetic Structures and Magnetic Properties of Selenate Containing Natrochalcite, AIMII2(H3O2)(SeO4)2 Where A = Na or K and M = Mn, Co, or Ni Inorganic Chemistry, 2012, 51, 1953-1962 |
| 1562928 | CIF | Al9.45 Mn2.55 Yb | I 4/m m m | 8.976; 8.976; 5.111 90; 90; 90 | 411.79 | Fulfer, Bradford W.; Haldolaarachchige, Neel; Young, David P.; Chan, Julia Y. Crystal growth and magnetic properties of Ln-Mn-Al (Ln=Gd, Yb) compounds of the CaCr2Al10 and ThMn12 structure types Journal of Solid State Chemistry, 2012, 194, 143-150 |
| 1563074 | CIF | O4 Se3 Sm2 U2 | P b a m | 6.9873; 14.7923; 3.9854 90; 90; 90 | 411.924 | Raw, Adam D.; Ibers, James A. Syntheses and crystal structures of the quaternary uranium lanthanide oxyselenides UYb2O2Se3 and U2Ln2O4Se3 (Ln=Pr, Sm, Gd) Journal of Solid State Chemistry, 2012, 186, 177-181 |
| 1515093 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 6.9259; 5.5072; 10.8549 90; 95.667; 90 | 412.01 | Ogborn, Joseph M.; Collings, Ines E.; Moggach, Stephen A.; Thompson, Amber L.; Goodwin, Andrew L. Supramolecular mechanics in a metal‒organic framework Chemical Science, 2012, 3, 3011 |
| 4506381 | CIF | C6 H4 B2 F4 O4 | P 1 21/n 1 | 8.4258; 5.0244; 10.1656 90; 106.254; 90 | 413.16 | Durka, Krzysztof; Jarzembska, Katarzyna N.; Kamiński, Radosław; Luliński, Sergiusz; Serwatowski, Janusz; Woźniak, Krzysztof Structural and Energetic Landscape of Fluorinated 1,4-Phenylenediboronic Acids Crystal Growth & Design, 2012, 12, 3720 |
| 2105144 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.938; 5.9485; 5.8266 90; 90; 90 | 413.77 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 9014068 | CIF | Al0.03 Ba0.6 Fe0.98 H0.4 Mg0.02 O11.4 Si0.86 V5.305 Zn0.11 | P -3 m 1 | 5.75; 5.75; 14.459 90; 90; 120 | 414.004 | Bartholomew, P. R.; Mancini, F.; Harlow, G. E.; Deifel, N.; Cahill, C.; Bernhardt, H. J. Greenwoodite, a new nesosilicate from British Columbia with a Ba-VOH coupled substitution and tetrahedral Fe: description and structure The Canadian Mineralogist, 2012, 50, 1233-1242 |
| 2235878 | CIF HKL Paper | C7 H7 Cl N2 S | P -1 | 5.4406; 8.5715; 9.2392 104.221; 91.776; 96.362 | 414.33 | Fun, Hoong-Kun; Quah, Ching Kheng; Nayak, Prakash S.; Narayana, B.; Sarojini, B. K. 1-(3-Chlorophenyl)thiourea Acta Crystallographica Section E, 2012, 68, o2423 |
| 2105099 | CIF HKL Paper | C3 H7 N O3 | P 1 21/n 1 | 4.8098; 8.8377; 9.971 90; 101.94; 90 | 414.7 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 7208556 | CIF | C6 F4 I2 | P 1 21/c 1 | 6.2187; 11.6168; 5.7876 90; 93.61; 90 | 417.27 | Oh, Se Ye; Nickels, Christopher W.; Garcia, Felipe; Jones, William; Friščić, Tomislav Switching between halogen- and hydrogen-bonding in stoichiometric variations of a cocrystal of a phosphine oxide CrystEngComm, 2012, 14, 6110 |
| 7107111 | CIF | Ba2 H4 Ni6 O20 V4 | C 1 2/m 1 | 10.213; 5.816; 7.888 90; 117.01; 90 | 417.4 | Danna E. Freedman; Robin Chisnell; Tyrel M. McQueen; Young S. Lee; Christophe Payen; Daniel G. Nocera Frustrated magnetism in the S=1 kagome lattice BaNi3(OH)2(VO4)2 Chem.Commun., 2012, 48, 64 |
| 4330062 | CIF | Cu6 P5 Sr2 | I 4/m m m | 4.116; 4.116; 24.6486 90; 90; 90 | 417.583 | Dmitri O. Charkin; Arthur V. Urmanov; Sergey M. Kazakov; Dmitri Batuk; Artem M. Abakumov; Stephan Knöner; Elena Gati; Bernd Wolf; Michael Lang; Andrey V. Shevelkov; Gustaaf Van Tendeloo; Evgeni V. Antipov Synthesis, Crystal Structure, Transport, and Magnetic Properties of Novel Ternary Copper Phosphides, A2Cu6P5 (A = Sr, Eu) and EuCu4P3 Inorganic Chemistry, 2012, 51, 8948-8955 |
| 7215085 | CIF | C2 H8 N10 O4 | P 1 21/c 1 | 5.4408; 11.7514; 6.5612 90; 95.071; 90 | 417.86 | Fischer, Niko; Fischer, Dennis; Klapötke, Thomas M.; Piercey, Davin G.; Stierstorfer, Jörg Pushing the limits of energetic materials ‒ the synthesis and characterization of dihydroxylammonium 5,5′-bistetrazole-1,1′-diolate Journal of Materials Chemistry, 2012, 22, 20418 |
| 1562953 | CIF | B3 Ir1.94 Rh2.38 Ti1.68 | P b a m | 8.62; 14.9947; 3.2337 90; 90; 90 | 417.97 | Goerens, Christian; Fokwa, Boniface P.T. The complex metal-rich boride Ti1+xRh2−x+yIr3−yB3 (x=0.68, y=1.06) with a new structure type containing B4 zigzag fragments: Synthesis, crystal chemistry and theoretical calculations Journal of Solid State Chemistry, 2012, 192, 113-119 |
| 2235292 | CIF HKL Paper | C14 H20 N2 O10 | P -1 | 5.1446; 8.4165; 9.953 76.656; 88.177; 85.715 | 418.11 | Yan, Juanzhi; Ma, Ling; Zhu, Miaoli; Zhang, Xiangdong; Ge, Chunhua 2,2',2'',2'''-(1,4-Phenylenedinitrilo)tetraacetic acid dihydrate Acta Crystallographica Section E, 2012, 68, o1623 |
| 4506645 | CIF | C18 H8 F4 I2 O | P -1 | 5.4259; 5.7691; 13.919 90.582; 101.061; 101.593 | 418.35 | Gao, Hai Yue; Zhao, Xiao Ran; Wang, Hui; Pang, Xue; Jin, Wei Jun Phosphorescent Cocrystals Assembled by 1,4-Diiodotetrafluorobenzene and Fluorene and Its Heterocyclic Analogues Based on C‒I···π Halogen Bonding Crystal Growth & Design, 2012, 12, 4377 |
| 7020502 | CIF | Ba Co F O4 P | P 21 21 21 | 4.7869; 9.0674; 9.655 90; 90; 90 | 419.07 | Armstrong, Jennifer A.; Williams, Edward R.; Weller, Mark T. Cobalt(ii) fluorophosphate frameworks. Dalton transactions (Cambridge, England : 2003), 2012, 41, 14180-14187 |
| 9016270 | CIF | Al Ge2 Li O6 | P 1 21/n 1 | 9.8976; 8.3985; 5.402 90; 110.64; 90 | 420.219 | Redhammer, G. J.; Nestola, F.; Miletich, R. Synthetic LiAlGe2O6: The first pyroxene with P2_1/n symmetry Note: Sample #LAF_L_tr American Mineralogist, 2012, 97, 1213-1218 |
| 9016110 | CIF | Al Ge2 Li O6 | P 1 21/n 1 | 9.8986; 8.4008; 5.4016 90; 110.648; 90 | 420.323 | Redhammer, G. J.; Nestola, F.; Miletich, R. Synthetic LiAlGe2O6: The first pyroxene with P2_1/n symmetry Note: Sample #LA2n_L_tr American Mineralogist, 2012, 97, 1213-1218 |
| 2235439 | CIF HKL Paper | C4 H6 O2 S4 | P -1 | 5.33; 8.6935; 9.9166 109.875; 92.154; 101.481 | 420.71 | Ford, David K.; Young Jr, Victor G.; Barany, George Bis[(methylsulfanyl)carbonyl]disulfane Acta Crystallographica Section E, 2012, 68, o2102 |
| 2105071 | CIF HKL Paper | C5 H6 Cl Cr N O3 | C 1 m 1 | 7.7193; 8.6842; 6.3139 90; 96.25; 90 | 420.74 | Małuszyńska, Hanna; Czarnecki, Piotr; Czarnecka, Anna; Pajak, Zdzisław Structures and phase transitions in a new ferroelectric ‒ pyridinium chlorochromate ‒ studied by X-ray diffraction, DSC and dielectric methods Acta Crystallographica Section B, 2012, 68, 128-136 |
| 9016596 | CIF | Al Ge2 Li O6 | P 1 21/n 1 | 9.9015; 8.4047; 5.4036 90; 110.637; 90 | 420.828 | Redhammer, G. J.; Nestola, F.; Miletich, R. Synthetic LiAlGe2O6: The first pyroxene with P2_1/n symmetry Note: Sample #LAG American Mineralogist, 2012, 97, 1213-1218 |
| 1515092 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 6.992; 5.559; 10.875 90; 95.344; 90 | 420.86 | Ogborn, Joseph M.; Collings, Ines E.; Moggach, Stephen A.; Thompson, Amber L.; Goodwin, Andrew L. Supramolecular mechanics in a metal‒organic framework Chemical Science, 2012, 3, 3011 |
| 2105143 | CIF Paper | C3 H7 N O2 | P n a 21 | 11.994; 6.0103; 5.8421 90; 90; 90 | 421.14 | Tumanov, Nikolay A.; Boldyreva, Elena V. X-ray diffraction and Raman study of <small>DL</small>-alanine at high pressure: revision of phase transitions Acta Crystallographica Section B, 2012, 68, 412-423 |
| 1563011 | CIF | As0.75 Co2 H O5 P0.25 | P n n m | 8.2119; 8.5341; 6.0123 90; 90; 90 | 421.35 | de Pedro, I.; Rojo, J.M.; Rodríguez Fernández, J.; Sanchez Marcos, J.; Fernández-Díaz, M.T.; Rojo, T. Heat capacity and neutron diffraction studies on the frustrated magnetic Co2(OH)(PO4)1−x(AsO4)x [0≤x≤1] solid solution Journal of Solid State Chemistry, 2012, 188, 1-10 |
| 4330140 | CIF | Co3 Fe3 O18 Pr2 Sr6 | I 4/m m m | 3.86137; 3.86137; 28.262 90; 90; 90 | 421.39 | Laurent Jantsky; Hiroshi Okamoto; Antoine Demont; Helmer Fjellvåg Tuning of Water and Hydroxide Content of Intercalated Ruddlesden-Popper-type Oxides in the PrSr3Co1.5Fe1.5O10-δSystem Inorganic Chemistry, 2012, 51, 9181-9191 |
| 7208075 | CIF | C2 H5 Cl | P 63/m | 8.8116; 8.8116; 6.2705 90; 90; 120 | 421.64 | Podsiadło, Marcin; Bujak, Maciej; Katrusiak, Andrzej Chemistry of density: extension and structural origin of Carnelley's rule in chloroethanes CrystEngComm, 2012, 14, 4496 |
| 2233708 | CIF HKL Paper | C3 H9 Li2 N O7 S | P -1 | 5.1093; 9.2367; 9.6769 68.725; 82.576; 89.045 | 421.77 | Sweetlin, M. Daniel; Eapen, Shibu M.; Perumal, S.; Ramalingom, S. Poly[μ~3~-β-alanine-aqua-μ~4~-sulfato-dilithium] Acta Crystallographica Section E, 2012, 68, m206-m207 |
| 1562969 | CIF | Ag4 As2 Eu | R -3 m :H | 4.5352; 4.5352; 23.7221 90; 90; 120 | 422.55 | Stoyko, Stanislav S.; Khatun, Mansura; Scott Mullen, C.; Mar, Arthur Ternary CaCu4P2-type pnictides AAg4Pn2 (A=Sr, Eu; Pn=As, Sb) Journal of Solid State Chemistry, 2012, 192, 325-330 |
| 1563073 | CIF | O4 Pr2 Se3 U2 | P b a m | 7.0466; 14.9241; 4.0235 90; 90; 90 | 423.13 | Raw, Adam D.; Ibers, James A. Syntheses and crystal structures of the quaternary uranium lanthanide oxyselenides UYb2O2Se3 and U2Ln2O4Se3 (Ln=Pr, Sm, Gd) Journal of Solid State Chemistry, 2012, 186, 177-181 |
| 4027312 | CIF | C16 H2 Br2 F10 N4 | P -1 | 4.959; 8.559; 10.259 90.869; 94.021; 102.739 | 423.5 | Sonja Geib; Susanne C. Martens; Ute Zschieschang; Florian Lombeck; Hubert Wadepohl; Hagen Klauk; Lutz H. Gade 1,3,6,8-Tetraazapyrenes: Synthesis, Solid-State Structures, and Properties as Redox-Active Materials Journal of Organic Chemistry, 2012, 77, 6107-6116 |
| 2105098 | CIF HKL Paper | C3 H7 N O3 | P 1 21/n 1 | 4.8235; 8.8863; 10.094 90; 101.69; 90 | 423.7 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 7208619 | CIF | B3 Cd4 Lu O10 | C 1 m 1 | 7.937; 15.778; 3.436 90; 99.972; 90 | 423.8 | Zou, Guohong; Ma, Zuju; Wu, Kechen; Ye, Ning Cadmium-rare earth oxyborates Cd4ReO(BO3)3 (Re = Y, Gd, Lu): congruently melting compounds with large SHG responses Journal of Materials Chemistry, 2012, 22, 19911 |
| 7208662 | CIF | C4 H10 O | P 21 21 21 | 5.058; 5.2221; 16.054 90; 90; 90 | 424.04 | Podsiadło, Marcin; Patyk, Ewa; Katrusiak, Andrzej Chiral aggregation hierarchy in high-pressure resolved 2-butanol and 2,3-butanediol CrystEngComm, 2012, 14, 6419 |
| 2236837 | CIF HKL Paper | C21 H21 N O | P 1 | 5.7806; 7.9407; 9.6089 82.579; 76.793; 83.51 | 424.21 | Madeley, Lee G.; Morgans, Garreth L.; Lemmerer, Andreas; Michael, Joseph P. (2<i>E</i>)-1-Phenyl-2-[1-(2-phenylprop-2-en-1-yl)pyrrolidin-2-ylidene]ethanone Acta Crystallographica Section E, 2012, 68, o3281 |
| 9017403 | CIF | H2 Mg3 O12 Si4 | C -1 | 5.1848; 8.923; 9.19 90.69; 90.9; 90 | 425.083 | Drits, V. A.; Guggenheim, S.; Zviagina, B. B.; Kogure, T. Structures of the 2:1 layers of pyrophyllite and talc Note: structure is averaged to remove stacking disorder effects Clays and Clay Minerals, 2012, 60, 574-587 |
| 2105097 | CIF HKL Paper | C3 H7 N O3 | P 1 21/n 1 | 4.8329; 8.9119; 10.088 90; 101.58; 90 | 425.6 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 1563010 | CIF | As0.9 Co2 H O5 P0.1 | P n n m | 8.2447; 8.5667; 6.0313 90; 90; 90 | 425.99 | de Pedro, I.; Rojo, J.M.; Rodríguez Fernández, J.; Sanchez Marcos, J.; Fernández-Díaz, M.T.; Rojo, T. Heat capacity and neutron diffraction studies on the frustrated magnetic Co2(OH)(PO4)1−x(AsO4)x [0≤x≤1] solid solution Journal of Solid State Chemistry, 2012, 188, 1-10 |
| 9017578 | CIF | Fe Ge H6 O6 | P 42/n :2 | 7.552; 7.552; 7.4694 90; 90; 90 | 426 | Kleppe, A. K.; Welch, M. D.; Crichton, W. A.; Jephcoat, A. P. Phase transitions in hydroxide perovskites: a Raman spectroscopic study of stottite, FeGe(OH)6, to 21 GPa Mineralogical Magazine, 2012, 76, 949-962 |
| 9017579 | CIF | Fe Ge H6 O6 | P 1 2/n 1 | 7.5509; 7.4695; 7.5531 90; 90.005; 90 | 426.006 | Kleppe, A. K.; Welch, M. D.; Crichton, W. A.; Jephcoat, A. P. Phase transitions in hydroxide perovskites: a Raman spectroscopic study of stottite, FeGe(OH)6, to 21 GPa Note: this is the preferred structure Mineralogical Magazine, 2012, 76, 949-962 |
| 7017608 | CIF | C4 H6 Cd Cl N2 O4 P | P -1 | 5.6914; 7.0423; 11.57 79.5; 77.9; 71.68 | 427.05 | Ma, Yun-Sheng; Tang, Xiao-Yan; Yin, Wen-Yu; Wu, Bin; Xue, Feng-Feng; Yuan, Rong-Xin; Roy, Soumyajit Zinc and cadmium 2-pyrazinephosphonates: Syntheses, structures and luminescent properties. Dalton transactions (Cambridge, England : 2003), 2012, 41, 2340-2345 |
| 2237018 | CIF HKL Paper | C9 H12 N2 O | P 1 21 1 | 9.833; 5.011; 9.841 90; 118.27; 90 | 427.1 | Mei, Xiang-dong; Liang, Yan-hui; Li, Ke-Bin 2-Amino-<i>N</i>,3-dimethylbenzamide Acta Crystallographica Section E, 2012, 68, o3474 |
| 2233355 | CIF HKL Paper | C8 H5 N O6 | P -1 | 7.0261; 7.438; 8.5775 80.09; 86.22; 75.37 | 427.14 | Luo, Yang-Hui; Pan, Mei-Ling 4-Nitroisophthalic acid Acta Crystallographica Section E, 2012, 68, o206 |
| 2105107 | CIF HKL Paper | C3 H7 N O3 | P 21 21 21 | 5.5741; 8.436; 9.088 90; 90; 90 | 427.3 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 2105108 | CIF HKL Paper | C3 H7 N O3 | P 21 21 21 | 5.5668; 8.463; 9.072 90; 90; 90 | 427.4 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 7017731 | CIF | C12 H28 N6 Ni O6 | P -1 | 7.172; 7.988; 8.33 94.306; 112.642; 100.496 | 427.5 | Brayshaw, Simon K.; Easun, Timothy L.; George, Michael W.; Griffin, Alexandra M. E.; Johnson, Andrew L.; Raithby, Paul R.; Savarese, Teresa L.; Schiffers, Stefanie; Warren, John E.; Warren, Mark R.; Teat, Simon J. Photocrystallographic identification of metastable nitrito linkage isomers in a series of nickel(II) complexes. Dalton transactions (Cambridge, England : 2003), 2012, 41, 90-97 |
| 2105096 | CIF HKL Paper | C3 H7 N O3 | P 1 21/n 1 | 4.8361; 8.9202; 10.123 90; 101.49; 90 | 427.9 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 4328533 | CIF | Mo7.68 Ni5.58 Re16.74 | P 42/m n m | 9.3393; 9.3393; 4.90719 90; 90; 90 | 428.017 | Khurram Yaqoob; Jean-Claude Crivello; Jean-Marc Joubert Comparison of the Site Occupancies Determined by Combined Rietveld Refinement and Density Functional Theory Calculations: Example of the Ternary Mo-Ni-Re σ Phase Inorganic Chemistry, 2012, 51, 3071-3078 |
| 2235845 | CIF HKL Paper | C7 H7 Br N2 S | P -1 | 5.5308; 8.5316; 9.4249 103.5; 90.878; 97.232 | 428.54 | Fun, Hoong-Kun; Quah, Ching Kheng; Nayak, Prakash S.; Narayana, B.; Sarojini, B. K. 1-(3-Bromophenyl)thiourea Acta Crystallographica Section E, 2012, 68, o2462 |
| 1515091 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.0544; 5.6024; 10.8873 90; 95.062; 90 | 428.61 | Ogborn, Joseph M.; Collings, Ines E.; Moggach, Stephen A.; Thompson, Amber L.; Goodwin, Andrew L. Supramolecular mechanics in a metal‒organic framework Chemical Science, 2012, 3, 3011 |
| 2236791 | CIF HKL Paper | C8 H5 N5 | P -1 | 6.4831; 6.7538; 10.404 77.865; 84.297; 74.499 | 428.71 | Yu, Hong; Lei, Ke-Wei 1-(2-Cyanoethyl)-1<i>H</i>-imidazole-4,5-dicarbonitrile Acta Crystallographica Section E, 2012, 68, o2765 |
| 1512695 | CIF | C18 H16 Cl2 N4 Pd | P -1 | 7.0872; 7.8015; 9.473 106.659; 99.131; 115.376 | 428.72 | Manoj Trivedi; Gurmeet Singh; R. Nagarajan; Nigam P. Rath Imidazole containing palladium(II) complexes as efficient pre-catalyst systems for Heck and Suzuki coupling reaction: Synthesis, structural characterization and catalytic properties Inorganica Chimica Acta, 2012, 393, 107-116 |
| 4328555 | CIF | Ge4 Li4 Sm3 | I m m m | 4.3674; 6.7721; 14.5129 90; 90; 90 | 429.24 | Sheng-Ping Guo; Tae-Soo You; Svilen Bobev Closely Related Rare-Earth Metal Germanides RE2Li2Ge3andRE3Li4Ge4 (RE = La-Nd, Sm): Synthesis, Crystal Chemistry, and Magnetic Properties Inorganic Chemistry, 2012, 51, 3119-3129 |
| 4117336 | CIF | H12 N8 Ni O6 | P -3 c 1 | 8.117; 8.117; 7.531 90; 90; 120 | 429.7 | Oleksandr S. Bushuyev; Preston Brown; Amitesh Maiti; Richard H. Gee; Geneva R. Peterson; Brandon L. Weeks; Louisa J. Hope-Weeks Ionic Polymers as a New Structural Motif for High-Energy-Density Materials Journal of the American Chemical Society, 2012, 134, 1422-1425 |
| 7208620 | CIF | B3 Cd4 O10 Y | C 1 m 1 | 7.9627; 15.793; 3.4706 90; 100.088; 90 | 429.7 | Zou, Guohong; Ma, Zuju; Wu, Kechen; Ye, Ning Cadmium-rare earth oxyborates Cd4ReO(BO3)3 (Re = Y, Gd, Lu): congruently melting compounds with large SHG responses Journal of Materials Chemistry, 2012, 22, 19911 |
| 7207145 | CIF | C16 H16 N2 O10 Zn | P 1 | 7.0505; 7.7448; 8.4534 107.543; 95.451; 98.716 | 430.17 | Kong, Guo-Qiang; Wu, Chuan-De Five coordination networks based on zwitterionic ligands: synthesis, crystal structures and optical properties CrystEngComm, 2012, 14, 847 |
| 4331188 | CIF | C2 F5 La N4 Sr3 | I -4 2 m | 8.086; 8.086; 6.58 90; 90; 90 | 430.2 | Leonid Unverfehrt; Markus Ströbele; H.-Jürgen Meyer LaSr3F5(CN2)2: A Prototype Structure for Mixed-Valent Eu4F5(CN2)2 Inorganic Chemistry, 2012, 51, 12925-12928 |
| 7208676 | CIF | C5 H8 Br Cu F2 N O2 | P 1 21/m 1 | 7.7096; 6.7687; 8.5459 90; 105.241; 90 | 430.27 | Awwadi, Firas F.; Haddad, Salim F.; Twamley, Brendan; Willett, Roger D. Effect of intermolecular interactions on the molecular structure; theoretical study and crystal structures of 4-bromopyridinium tetrafluoroborate and diaqua(3-bromopyridine)difluorocopper(ii) CrystEngComm, 2012, 14, 6761 |
| 2234221 | CIF HKL Paper | C7 H6 Cl N3 O3 | P -1 | 4.891; 6.363; 14.61 83.54; 82.37; 73.64 | 431.1 | Wardell, James L.; Tiekink, Edward R. T. 2-Amino-3-chloro-5-nitrobenzamide Acta Crystallographica Section E, 2012, 68, o991 |
| 7017732 | CIF | C12 H28 N6 Ni O6 | P -1 | 7.2136; 7.9994; 8.3 94.581; 111.364; 101.278 | 431.39 | Brayshaw, Simon K.; Easun, Timothy L.; George, Michael W.; Griffin, Alexandra M. E.; Johnson, Andrew L.; Raithby, Paul R.; Savarese, Teresa L.; Schiffers, Stefanie; Warren, John E.; Warren, Mark R.; Teat, Simon J. Photocrystallographic identification of metastable nitrito linkage isomers in a series of nickel(II) complexes. Dalton transactions (Cambridge, England : 2003), 2012, 41, 90-97 |
| 2105095 | CIF HKL Paper | C3 H7 N O3 | P 1 21/n 1 | 4.8307; 8.956; 10.175 90; 101.33; 90 | 431.6 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 7208447 | CIF | C5 H9 N O6 S | P -1 | 5.65476; 8.8702; 9.7344 110.377; 102.167; 99.621 | 431.74 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 1562968 | CIF | Ag4 As2 Sr | R -3 m :H | 4.5555; 4.5555; 24.041 90; 90; 120 | 432.07 | Stoyko, Stanislav S.; Khatun, Mansura; Scott Mullen, C.; Mar, Arthur Ternary CaCu4P2-type pnictides AAg4Pn2 (A=Sr, Eu; Pn=As, Sb) Journal of Solid State Chemistry, 2012, 192, 325-330 |
| 4331379 | CIF | C6 H17 B Cl N | P 1 21 1 | 6.1671; 10.707; 7.1427 90; 113.24; 90 | 433.37 | Hima K. Lingam; Cong Wang; Judith C. Gallucci; Xuenian Chen; Sheldon G. Shore New Syntheses and Structural Characterization of NH3BH2Cl and (BH2NH2)3 and Thermal Decomposition Behavior of NH3BH2Cl Inorganic Chemistry, 2012, 51, 13430-13436 |
| 7208618 | CIF | B3 Cd4 Gd O10 | C 1 m 1 | 7.992; 15.777; 3.494 90; 100.22; 90 | 433.6 | Zou, Guohong; Ma, Zuju; Wu, Kechen; Ye, Ning Cadmium-rare earth oxyborates Cd4ReO(BO3)3 (Re = Y, Gd, Lu): congruently melting compounds with large SHG responses Journal of Materials Chemistry, 2012, 22, 19911 |
| 7208074 | CIF | C2 H5 Cl | P 63/m | 8.8941; 8.8941; 6.3353 90; 90; 120 | 434.01 | Podsiadło, Marcin; Bujak, Maciej; Katrusiak, Andrzej Chemistry of density: extension and structural origin of Carnelley's rule in chloroethanes CrystEngComm, 2012, 14, 4496 |
| 4328534 | CIF | Mo15.6 Ni5.7 Re8.7 | P 42/m n m | 9.4018; 9.4018; 4.91336 90; 90; 90 | 434.31 | Khurram Yaqoob; Jean-Claude Crivello; Jean-Marc Joubert Comparison of the Site Occupancies Determined by Combined Rietveld Refinement and Density Functional Theory Calculations: Example of the Ternary Mo-Ni-Re σ Phase Inorganic Chemistry, 2012, 51, 3071-3078 |
| 7208446 | CIF | C5 H9 N O6 S | P -1 | 5.65706; 8.9064; 9.7446 110.208; 102.193; 99.702 | 434.47 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 2235867 | CIF HKL Paper | C14 H12 O8 S4 | P -1 | 6.8666; 7.8783; 8.4335 100.221; 99.255; 99.328 | 434.53 | Katzsch, Felix; Weber, Edwin Redetermination of tetramethyl tetrathiafulvalene-2,3,6,7-tetracarboxylate Acta Crystallographica Section E, 2012, 68, o2354-o2355 |
| 4502898 | CIF | C16 H12 Ag2 N2 O7 | P -1 | 3.6084; 9.9374; 12.728 73.315; 87.944; 84.004 | 434.79 | Kole, Goutam Kumar; Tan, Geok Kheng; Vittal, Jagadese J. Photoreactivity of Ag(I) Complexes and Coordination Polymers of Pyridyl Acrylic Acids Crystal Growth & Design, 2012, 12, 326 |
| 4330392 | CIF | C3 H9 Cd Cl2 O4 P | P 1 21/m 1 | 6.957; 7.3639; 8.8093 90; 105.518; 90 | 434.85 | Alexander V. Anyushin; Dmitry A. Mainichev; Nikolay K. Moroz; Pavel A. Abramov; Dmitry Yu. Naumov; Maxim N. Sokolov; Vladimir P. Fedin Cd2+ Complexation with P(CH2OH)3, OP(CH2OH)3, and (HOCH2)2PO2-: Coordination in Solution and Coordination Polymers Inorganic Chemistry, 2012, 51, 9995-10003 |
| 7208445 | CIF | C5 H9 N O6 S | P -1 | 5.65949; 8.9271; 9.7495 110.093; 102.22; 99.769 | 436.06 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 2236598 | CIF HKL Paper | C11 H8 O3 | P -1 | 6.6945; 7.1079; 10.3032 71.593; 84.962; 69.843 | 436.57 | Yousuf, Sammer; Mukhtar, Asma; Ambreen, Nida; Saad, Syed Muhammad; Khan, Khalid M. 6-Methyl-4-oxo-4<i>H</i>-chromene-3-carbaldehyde Acta Crystallographica Section E, 2012, 68, o2920 |
| 2105106 | CIF HKL Paper | C3 H7 N O3 | P 21 21 21 | 5.5885; 8.542; 9.146 90; 90; 90 | 436.6 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 7208444 | CIF | C5 H9 N O6 S | P -1 | 5.66062; 8.9394; 9.7525 109.967; 102.224; 99.833 | 437.16 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 2234646 | CIF HKL Paper | C8 H7 Br O3 | P 1 21 1 | 3.9829; 9.095; 12.122 90; 95.162; 90 | 437.33 | Mustafa, Ghulam; Khan, Islam Ullah; Ashiq, Muhammad Zar; Akkurt, Mehmet Methyl 5-bromo-2-hydroxybenzoate Acta Crystallographica Section E, 2012, 68, o1467 |
| 2105094 | CIF HKL Paper | C3 H7 N O3 | P 1 21/n 1 | 4.8424; 8.9832; 10.25 90; 101.03; 90 | 437.6 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 2235999 | CIF HKL Paper | C20 H18 N4 O4 | P -1 | 6.904; 8.494; 8.643 67.191; 70.36; 87.172 | 438.1 | Guo, Huai-Ling; Liu, Jia-Cheng; Xiao, Chao-Hu; Pang, Ting; Cao, Ping Dimethyl 2,2'-[2,2'-bi(1<i>H</i>-1,3-benzimidazole)-1,1'-diyl]diacetate Acta Crystallographica Section E, 2012, 68, o2512 |
| 7208443 | CIF | C5 H9 N O6 S | P -1 | 5.66107; 8.9574; 9.7578 109.831; 102.228; 99.913 | 438.59 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 7208190 | CIF | C8 H10 N2 O4 | P 1 21/n 1 | 8.5311; 5.1286; 10.2947 90; 103.012; 90 | 438.85 | Arhangelskis, Mihails; Lloyd, Gareth O.; Jones, William Mechanochemical synthesis of pyrazine:dicarboxylic acid cocrystals and a study of dissociation by quantitative phase analysis CrystEngComm, 2012, 14, 5203 |
| 7207603 | CIF | C16 H20 N4 O7 | P -1 | 4.8122; 8.8128; 11.0772 75.874; 80.095; 76.225 | 439.22 | Aakeröy, Christer B.; Forbes, Safiyyah; Desper, John The effect of water molecules in stabilizing co-crystals of active pharmaceutical ingredients CrystEngComm, 2012, 14, 2435 |
| 4328551 | CIF | Ge4 Li4 Nd3 | I m m m | 4.4118; 6.8; 14.649 90; 90; 90 | 439.5 | Sheng-Ping Guo; Tae-Soo You; Svilen Bobev Closely Related Rare-Earth Metal Germanides RE2Li2Ge3andRE3Li4Ge4 (RE = La-Nd, Sm): Synthesis, Crystal Chemistry, and Magnetic Properties Inorganic Chemistry, 2012, 51, 3119-3129 |
| 7018842 | CIF | C6 H8 N6 O4 | P -1 | 6.3469; 6.6534; 10.9527 88.543; 89.933; 72.034 | 439.81 | Kozma, Ágnes; Ibáñez, Susana; Silaghi-Dumitrescu, Radu; Sanz Miguel, Pablo J.; Gupta, Deepali; Lippert, Bernhard 7-Methylguanine: protonation, formation of linkage isomers with trans-(NH3)2PtII, and base pairing properties Dalton Transactions, 2012, 41, 6094 |
| 2234776 | CIF HKL Paper | C10 H4 O2 S2 | P 1 21/n 1 | 5.6402; 5.7745; 13.6223 90; 97.371; 90 | 440 | Ramirez, Amanda L.; Chan, Benny C.; de Lill, Daniel T. Benzo[1,2-<i>b</i>:4,5-<i>b</i>']dithiophene-4,8-dione Acta Crystallographica Section E, 2012, 68, o1428 |
| 7208442 | CIF | C5 H9 N O6 S | P -1 | 5.66264; 8.9788; 9.7642 109.682; 102.236; 100.002 | 440.33 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 2236935 | CIF HKL Paper | C8 H9 N3 O3 | P 1 21 1 | 6.6962; 4.9388; 13.3593 90; 92.361; 90 | 441.43 | Praveen, A. S.; Jasinski, Jerry P.; Keeley, Amanda C.; Yathirajan, H. S.; Narayana, B. 2-(2-Nitrophenyl)acetohydrazide Acta Crystallographica Section E, 2012, 68, o3436 |
| 2235619 | CIF HKL Paper | C8 H9 Br N2 O | P 1 21 1 | 6.0798; 4.8565; 15.1126 90; 98.003; 90 | 441.88 | Ahmad, Shakeel; Jabbar, Abdul; Hussain, Muhammad Tahir; Tahir, M. Nawaz 2-(4-Bromophenyl)acetohydrazide Acta Crystallographica Section E, 2012, 68, o2269 |
| 7208441 | CIF | C5 H9 N O6 S | P -1 | 5.66521; 8.9987; 9.7696 109.516; 102.251; 100.096 | 442.06 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 7207305 | CIF | C24 H16 N2 | P -1 | 6.737; 8.541; 8.965 79.742; 68.025; 67.714 | 442.2 | Xu, Yuanxiang; Zhang, Houyu; Li, Feng; Shen, Fangzhong; Wang, Huan; Li, Xianjie; Yu, Yang; Ma, Yuguang Supramolecular interaction-induced self-assembly of organic molecules into ultra-long tubular crystals with wave guiding and amplified spontaneous emission Journal of Materials Chemistry, 2012, 22, 1592 |
| 2105104 | CIF HKL Paper | C3 H7 N O3 | P 21 21 21 | 5.59; 8.569; 9.233 90; 90; 90 | 442.3 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 2235570 | CIF HKL Paper | Co2 O11 Se2 V2 | P 1 21/m 1 | 4.7913; 8.868; 10.6156 90; 101.115; 90 | 442.59 | Rabbani, Faiz; Zimmermann, Iwan; Johnsson, Mats The synthetic cobalt vanadium selenite, Co~2~V~2~Se~2~O~11~ Acta Crystallographica Section E, 2012, 68, i61 |
| 2105093 | CIF HKL Paper | C3 H7 N O3 | P 1 21/n 1 | 4.8431; 9.0258; 10.319 90; 100.86; 90 | 443 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 7018415 | CIF | C4 H8 Cu N5 O5 | P -1 | 7.639; 8.088; 8.169 67.86; 71.56; 84.827 | 443.25 | Wriedt, Mario; Zhou, Hong-Cai Joe Systematic investigations on magneto-structural correlations of copper(ii) coordination polymers based on organic ligands with mixed carboxylic and nitrogen-based moieties. Dalton transactions (Cambridge, England : 2003), 2012, 41, 4207-4216 |
| 7208440 | CIF | C5 H9 N O6 S | P -1 | 5.66513; 9.0127; 9.7723 109.318; 102.263; 100.163 | 443.35 | Minkov, Vasily S.; Boldyreva, Elena V.; Drebushchak, Tatiana N.; Görbitz, Carl Henrik Stabilizing structures of cysteine-containing crystals with respect to variations of temperature and pressure by immobilizing amino acid side chains CrystEngComm, 2012, 14, 5943 |
| 4118469 | CIF | As4 Ba2 Fe2 O Ti2 | I 4/m m m | 4.0276; 4.02761; 27.3441 90; 90; 90 | 443.565 | Yun-Lei Sun; Hao Jiang; Hui-Fei Zhai; Jin-Ke Bao; Wen-He Jiao; Qian Tao; Chen-Yi Shen; Yue-Wu Zeng; Zhu-An Xu; Guang-Han Cao Ba2Ti2Fe2As4O: A New Superconductor Containing Fe2As2 Layers and Ti2O Sheets Journal of the American Chemical Society, 2012, 134, 12893-12896 |
| 2105105 | CIF HKL Paper | C3 H7 N O3 | P 21 21 21 | 5.603; 8.577; 9.231 90; 90; 90 | 443.6 | Zakharov, Boris A.; Kolesov, Boris A.; Boldyreva, Elena V. Effect of pressure on crystalline <small>L</small>- and <small>DL</small>-serine: revisited by a combined single-crystal X-ray diffraction at a laboratory source and polarized Raman spectroscopy study Acta Crystallographica Section B, 2012, 68, 275-286 |
| 1512696 | CIF | C18 H16 Cl2 N4 Pd | P -1 | 7.1661; 7.9158; 9.5294 106.744; 98.84; 115.135 | 444.23 | Manoj Trivedi; Gurmeet Singh; R. Nagarajan; Nigam P. Rath Imidazole containing palladium(II) complexes as efficient pre-catalyst systems for Heck and Suzuki coupling reaction: Synthesis, structural characterization and catalytic properties Inorganica Chimica Acta, 2012, 393, 107-116 |
| 7208383 | CIF | C2 H10 Ca O9 P2 | P -1 | 6.943; 7.581; 9.662 92.734; 106.176; 112.524 | 444.3 | Stavgianoudaki, Nikoleta; Papathanasiou, Konstantinos E.; Colodrero, Rosario M. P.; Choquesillo-Lazarte, Duane; Garcia-Ruiz, Juan M.; Cabeza, Aurelio; Aranda, Miguel A. G.; Demadis, Konstantinos D. Crystal engineering in confined spaces. A novel method to grow crystalline metal phosphonates in alginate gel systems CrystEngComm, 2012, 14, 5385 |
| 7207332 | CIF | C14 H12 Cd N8 S2 | P -1 | 5.8963; 7.1928; 10.9481 73.61; 86.576; 87.068 | 444.37 | Bai, Yan; Wang, Jun-Li; Dang, Dong-Bin; Li, Meng-Meng; Niu, Jing-Yang Assembly of four d10-metal inorganic‒organic hybrid coordination polymers based on bipyrazine imine-based ligand: Synthesis, crystal structures and luminescent properties CrystEngComm, 2012, 14, 1575 |
| 2018706 | CIF HKL Paper | C9 H7 Cl2 N O | P -1 | 7.398; 7.6612; 8.4536 72.4; 76.797; 84.615 | 444.47 | Vranec, Peter; Potočňák, Ivan; Repovský, Peter Low-dimensional compounds containing bioactive ligands. IV. Unusual ionic forms of 5-chloroquinolin-8-ol Acta Crystallographica Section C, 2012, 68, m370-m376 |
| 7020163 | CIF | C11 H29 Cl2 Co N4 O4 | P 1 | 7.779; 7.864; 8.045 100.627; 106.855; 102.071 | 444.5 | Bonnitcha, Paul D.; Kim, Byung J.; Hocking, Rosalie K.; Clegg, Jack K.; Turner, Peter; Neville, Suzanne M.; Hambley, Trevor W. Cobalt complexes with tripodal ligands: implications for the design of drug chaperones. Dalton transactions (Cambridge, England : 2003), 2012, 41, 11293-11304 |
| 2233251 | CIF HKL Paper | C6 H12 N4 O S | P -1 | 5.5205; 8.6077; 9.565 79.75; 89.509; 85.083 | 445.607 | Abduelftah, Halema Shaban; Ali, Amna Qasem; Eltayeb, Naser Eltaher; Teoh, Siang Guan; Fun, Hoong-Kun (<i>E</i>)-2-[(<i>E</i>)-3-(Hydroxyimino)butan-2-ylidene]-<i>N</i>-methylhydrazinecarbothioamide Acta Crystallographica Section E, 2012, 68, o184 |
| 1515090 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.2027; 5.6926; 10.9057 90; 94.504; 90 | 445.78 | Ogborn, Joseph M.; Collings, Ines E.; Moggach, Stephen A.; Thompson, Amber L.; Goodwin, Andrew L. Supramolecular mechanics in a metal‒organic framework Chemical Science, 2012, 3, 3011 |
| 1562973 | CIF HKL | K3 Na O9 Os2 | P 63/m m c | 5.9998; 5.9998; 14.3053 90; 90; 120 | 445.97 | Mogare, Kailash M.; Klein, Wilhelm; Jansen, Martin K2NaOsO5.5 and K3NaOs2O9: The first osmium perovskites containing alkali cations at the “A” site Journal of Solid State Chemistry, 2012, 191, 153-157 |
| 2233805 | CIF HKL Paper | C6 H12 N2 O5 S | P -1 | 5.2804; 6.9458; 12.4262 81.392; 82.874; 85.193 | 446.147 | Schutte, M.; Visser, H. G.; Roodt, A. 2-(Ammoniomethyl)pyridinium sulfate monohydrate Acta Crystallographica Section E, 2012, 68, o914 |
| 1529334 | CIF HKL | Cs2 Dy F6 Rb | P 1 21/n 1 | 6.8072; 6.8012; 9.6379 90; 90.356; 90 | 446.2 | S.V. Misjul; M.S. Molokeev; L.V. Osokina; I.N. Saphonov Structural Changes during Phase Transitions, Critical and Noncritical Order Parameters in the Elpasolite Cs2RbDyF6 Journal of Siberian Federal University. Mathematics & Physics, 2012, 5, 566-575 |
| 4506730 | CIF | C12 H10 N2 | P 1 21/c 1 | 7.072; 5.1; 13.13 90; 109.18; 90 | 447.3 | Lee, Tu; Chen, Hsin Rong; Lin, Hong Yu; Lee, Hung Lin Continuous Co-Crystallization As a Separation Technology: The Study of 1:2 Co-Crystals of Phenazine‒Vanillin Crystal Growth & Design, 2012, 12, 5897 |
| 2234506 | CIF HKL Paper | C16 H16 N4 O6 S2 | P -1 | 6.6764; 6.7958; 10.251 93.66; 103.3; 96.77 | 447.48 | Wei, Bin Bis(1<i>H</i>-imidazol-3-ium) naphthalene-1,5-disulfonate Acta Crystallographica Section E, 2012, 68, o1529 |
| 1551699 | CIF | C12 H16 Cl2 Co N2 O8 Pd | P -1 | 5.58; 6.709; 12.846 71.52; 79.41; 83.4 | 447.5 | MIYAZAKI, Yuhei; KATAOKA, Yusuke; KAWAMOTO, Tatsuya; MORI, Wasuke Crystal Structure of Pd(II)-Co(II) Coordination Polymer with Isonicotinic Acid X-ray Structure Analysis Online, 2012, 28, 19 |
| 4027030 | CIF | C8 H16 O4 | P 1 21 1 | 6.0355; 8.5641; 8.9483 90; 104.406; 90 | 447.98 | Ulf Scheffler; Rainer Mahrwald Histidine-Catalyzed Asymmetric Aldol Addition of Enolizable Aldehydes: Insights into its Mechanism Journal of Organic Chemistry, 2012, 77, 2310-2330 |
| 4328553 | CIF | Ge4 Li4 Pr3 | I m m m | 4.442; 6.844; 14.737 90; 90; 90 | 448 | Sheng-Ping Guo; Tae-Soo You; Svilen Bobev Closely Related Rare-Earth Metal Germanides RE2Li2Ge3andRE3Li4Ge4 (RE = La-Nd, Sm): Synthesis, Crystal Chemistry, and Magnetic Properties Inorganic Chemistry, 2012, 51, 3119-3129 |
| 9014116 | CIF | Ca0.25 Ce0.348 Fe0.03 Gd0.01 La0.12 Nb1.14 Nd0.14 O6 Pr0.04 Sm0.02 Sr0.01 Th0.06 Ti0.86 Y0.02 | P n m a | 11.0563; 7.56; 5.3637 90; 90; 90 | 448.328 | Morrison, S. M.; Downs, R. T.; Domanik, K. J.; Yang, H.; Doell, D. Nioboaeschynite-(Ce), Ce(NbTi)O6 Acta Crystallographica, Section E, 2012, 68, i64-i65 |
| 2236008 | CIF HKL Paper | Ca0.25 Ce0.79 Nb1.14 O6 Ti0.86 | P n m a | 11.0563; 7.56; 5.3637 90; 90; 90 | 448.33 | Morrison, Shaunna M.; Downs, Robert T.; Domanik, Kenneth J.; Yang, Hexiong; Doell, Donald Nioboaeschynite-(Ce), Ce(NbTi)O~6~ Acta Crystallographica Section E, 2012, 68, i64-i65 |
| 1562909 | CIF | Cs N O9 P U | P -1 | 7.0153; 7.4413; 9.3931 72.974; 74.261; 79.498 | 448.45 | Wylie, Ernest M.; Dawes, Colleen M.; Burns, Peter C. Synthesis, structure, and spectroscopic characterization of three uranyl phosphates with unique structural units Journal of Solid State Chemistry, 2012, 196, 482-488 |
| 7020460 | CIF | C8 H11 Fe O5 | P 1 21/m 1 | 8.01; 6.8872; 8.569 90; 108.232; 90 | 448.99 | Zheng, Yan-Zhen; Chen, Xiao-Ming Incorporation of spin-5/2 chain into 2D network with conformational pure e,a-cis-cyclohexane-1,4-dicarboxylato linker. Dalton transactions (Cambridge, England : 2003), 2012, 41, 11989-11991 |
| 4327915 | CIF | C4 H4 Cu2 I2 N2 S | P -1 | 7.3069; 8.0037; 8.5871 97.41; 100.887; 111.137 | 449.2 | Almudena Gallego; Oscar Castillo; Carlos J. Gómez-García; Félix Zamora; Salomé Delgado Electrical Conductivity and Luminescence in Coordination Polymers Based on Copper(I)-Halides and Sulfur-Pyrimidine Ligands Inorganic Chemistry, 2012, 51, 718-727 |
| 7018416 | CIF | C6 H4 Cu N6 O2 | P 1 21/m 1 | 5.606; 6.83; 11.891 90; 99.379; 90 | 449.2 | Wriedt, Mario; Zhou, Hong-Cai Joe Systematic investigations on magneto-structural correlations of copper(ii) coordination polymers based on organic ligands with mixed carboxylic and nitrogen-based moieties. Dalton transactions (Cambridge, England : 2003), 2012, 41, 4207-4216 |
| 2233232 | CIF HKL Paper | C4 H4 N2 O2 | P n a 21 | 10.474; 11.676; 3.674 90; 90; 90 | 449.3 | Cao, Qiang; Duan, Bao-Rong; Zhu, Bin; Cao, Zhen 1<i>H</i>-Imidazol-3-ium-4-carboxylate Acta Crystallographica Section E, 2012, 68, o134-o135 |
| 2235430 | CIF HKL Paper | C11 H8 F N O | P -1 | 3.8957; 10.7053; 11.1421 99.167; 95.951; 98.699 | 449.56 | Prakash, V.; Kapoor, Kamini; Shet Prakash, M.; Gupta, Vivek K.; Kant, Rajni (4-Fluorophenyl)(1<i>H</i>-pyrrol-2-yl)methanone Acta Crystallographica Section E, 2012, 68, o2073 |
| 4328532 | CIF | Mo14.7 Ni2.4 Re12.9 | P 42/m n m | 9.5262; 9.5262; 4.9605 90; 90; 90 | 450.158 | Khurram Yaqoob; Jean-Claude Crivello; Jean-Marc Joubert Comparison of the Site Occupancies Determined by Combined Rietveld Refinement and Density Functional Theory Calculations: Example of the Ternary Mo-Ni-Re σ Phase Inorganic Chemistry, 2012, 51, 3071-3078 |
| 2234878 | CIF HKL Paper | C6 H9 N5 O4 | P -1 | 5.6208; 7.9828; 10.857 76.846; 75.882; 75.954 | 450.91 | Narimani, Leila; Yamin, Bohari M. 2,4-Diamino-6-methyl-1,3,5-triazin-1-ium hydrogen oxalate Acta Crystallographica Section E, 2012, 68, o1475 |
| 7207461 | CIF | C22 H18 N2 O4 | P -1 | 3.8288; 10.6688; 12.0072 67.07; 89.415; 87.226 | 451.17 | Bekö, Sándor L.; Schmidt, Martin U.; Bond, Andrew D. An experimental screen for quinoline/fumaric acid salts and co-crystals CrystEngComm, 2012, 14, 1967 |
| 7207811 | CIF | C14 H18 O12 S2 Zn | P -1 | 5.4378; 7.0974; 12.031 90.52; 95.2; 102.28 | 451.64 | Wang, Huang; Huo, Li-Hua; Deng, Zhao-Peng; Zhao, Hui; Gao, Shan Syntheses, crystal structures and luminescent properties of Zn(ii)/Cd(ii) supramolecular complexes incorporating 4-sulfinobenzoate and its in situ oxidized ligand CrystEngComm, 2012, 14, 3501 |
| 9014304 | CIF | Cu3 H6 O11 V2 | C 1 2/m 1 | 10.657; 5.887; 7.228 90; 95.035; 90 | 451.7 | Yoshida, H.; Yamaura, J.; Isobe, M.; Nilsen, G. J.; Hiroi, Z. Orbital Switching in a Frustrated Magnet Nature Communications, 2012, 3, 860-865 |
| 7207518 | CIF | C10 H24 Mn2 O14 | P -1 | 7.6205; 7.9261; 8.0664 85.402; 81.432; 70.018 | 452.55 | Saines, Paul J.; Barton, Phillip T.; Jain, Prashant; Cheetham, Anthony K. Structures and magnetic properties of Mn and Co inorganic‒organic frameworks with mixed linear dicarboxylate ligands CrystEngComm, 2012, 14, 2711 |
| 2236530 | CIF HKL Paper | C5 H10 N3 O4 P | P -1 | 7.4821; 8.111; 8.179 70.811; 74.98; 84.883 | 452.76 | Yu, Gang 2,6-Diaminopyridinium dihydrogen phosphate Acta Crystallographica Section E, 2012, 68, o2751 |
| 2310004 | CIF Paper | C3 H7 N O3 | P 1 21/a 1 | 10.7621; 9.1771; 4.7883 90; 106.76; 90 | 452.83 | Mondal, Swastik; Prathapa, Siriyara Jagannatha; van Smaalen, Sander Experimental dynamic electron densities of multipole models at different temperatures Acta Crystallographica Section A, 2012, 68, 568-581 |
| 2310003 | CIF Paper | C3 H7 N O3 | P 1 21/a 1 | 10.7764; 9.1947; 4.7788 90; 106.87; 90 | 453.13 | Mondal, Swastik; Prathapa, Siriyara Jagannatha; van Smaalen, Sander Experimental dynamic electron densities of multipole models at different temperatures Acta Crystallographica Section A, 2012, 68, 568-581 |
| 7108012 | CIF | C5 H15 Cl P2 | P m n 21 | 9.4581; 6.5601; 7.306 90; 90; 90 | 453.31 | Saurabh S. Chitnis; Elizabeth MacDonald; Neil Burford; Ulrike Werner-Zwanziger; Robert McDonald P-P Menschutkin preparation of prototypical phosphinophosphonium salts Chem.Commun., 2012, 48, 7359 |
| 2018627 | CIF HKL Paper | C9 H7 N7 | P 1 c 1 | 3.7413; 7.8684; 15.4092 90; 91.54; 90 | 453.45 | Lysenko, Andrey B. The heterobifunctional ligand 5-[4-(1,2,4-triazol-4-yl)phenyl]-1<i>H</i>-tetrazole and its role in the construction of a Cd^II^ metal‒organic chain structure Acta Crystallographica Section C, 2012, 68, m291-m294 |
| 2236966 | CIF HKL Paper | C4 H6 Cu N8 | P 1 21/c 1 | 7.131; 9.6301; 7.2162 90; 113.782; 90 | 453.47 | Díaz, Jesús García; Albor, Atzimba García; Jaime, Espino Valencia; Vrábel, Viktor; Kožíšek, Jozef Poly[diamminedi-μ~3~-dicyanamido-copper(II)] Acta Crystallographica Section E, 2012, 68, i89-i90 |
| 9014921 | CIF | Fe Ge O3 | C 1 2/c 1 | 9.785; 9.1324; 5.1924 90; 101.751; 90 | 454.271 | Redhammer, G. J.; Senyshyn, A.; Tippelt, G.; Pietzonka, C.; Treutmann, W.; Roth, G.; Amthauer, G. Magnetic and low-temperature structural behavior of clinopyroxene-type FeGeO3: A neutron diffraction, magnetic susceptibility, and Fe Mossbauer study T = 4 K American Mineralogist, 2012, 97, 694-706 |
| 9016670 | CIF | Fe Ge O3 | C 1 2/c 1 | 9.784; 9.1338; 5.1924 90; 101.753; 90 | 454.291 | Redhammer, G. J.; Senyshyn, A.; Tippelt, G.; Pietzonka, C.; Treutmann, W.; Roth, G.; Amthauer, G. Magnetic and low-temperature structural behavior of clinopyroxene-type FeGeO3: A neutron diffraction, magnetic susceptibility, and Fe Mossbauer study T = 15 K American Mineralogist, 2012, 97, 694-706 |
| 9016574 | CIF | Fe Ge O3 | C 1 2/c 1 | 9.784; 9.1342; 5.1924 90; 101.754; 90 | 454.309 | Redhammer, G. J.; Senyshyn, A.; Tippelt, G.; Pietzonka, C.; Treutmann, W.; Roth, G.; Amthauer, G. Magnetic and low-temperature structural behavior of clinopyroxene-type FeGeO3: A neutron diffraction, magnetic susceptibility, and Fe Mossbauer study T = 30 K American Mineralogist, 2012, 97, 694-706 |
| 9016139 | CIF | Fe Ge O3 | C 1 2/c 1 | 9.7838; 9.1349; 5.1929 90; 101.75; 90 | 454.385 | Redhammer, G. J.; Senyshyn, A.; Tippelt, G.; Pietzonka, C.; Treutmann, W.; Roth, G.; Amthauer, G. Magnetic and low-temperature structural behavior of clinopyroxene-type FeGeO3: A neutron diffraction, magnetic susceptibility, and Fe Mossbauer study T = 50 K American Mineralogist, 2012, 97, 694-706 |
| 4328547 | CIF | Ce3 Ge4 Li4 | I m m m | 4.4625; 6.8713; 14.823 90; 90; 90 | 454.52 | Sheng-Ping Guo; Tae-Soo You; Svilen Bobev Closely Related Rare-Earth Metal Germanides RE2Li2Ge3andRE3Li4Ge4 (RE = La-Nd, Sm): Synthesis, Crystal Chemistry, and Magnetic Properties Inorganic Chemistry, 2012, 51, 3119-3129 |
| 9014672 | CIF | Fe Ge O3 | C 1 2/c 1 | 9.7848; 9.1369; 5.1936 90; 101.764; 90 | 454.569 | Redhammer, G. J.; Senyshyn, A.; Tippelt, G.; Pietzonka, C.; Treutmann, W.; Roth, G.; Amthauer, G. Magnetic and low-temperature structural behavior of clinopyroxene-type FeGeO3: A neutron diffraction, magnetic susceptibility, and Fe Mossbauer study T = 100 K American Mineralogist, 2012, 97, 694-706 |
| 2310005 | CIF Paper | C3 H7 N O3 | P 1 21/a 1 | 10.7355; 9.1456; 4.8304 90; 106.46; 90 | 454.82 | Mondal, Swastik; Prathapa, Siriyara Jagannatha; van Smaalen, Sander Experimental dynamic electron densities of multipole models at different temperatures Acta Crystallographica Section A, 2012, 68, 568-581 |
| 9014684 | CIF | Fe Ge O3 | C 1 2/c 1 | 9.7993; 9.1491; 5.1991 90; 101.891; 90 | 456.122 | Redhammer, G. J.; Senyshyn, A.; Tippelt, G.; Pietzonka, C.; Treutmann, W.; Roth, G.; Amthauer, G. Magnetic and low-temperature structural behavior of clinopyroxene-type FeGeO3: A neutron diffraction, magnetic susceptibility, and Fe Mossbauer study T = 298 K American Mineralogist, 2012, 97, 694-706 |
| 7208661 | CIF | C4 H10 O2 | P 21 21 21 | 4.9467; 9.3791; 9.834 90; 90; 90 | 456.25 | Podsiadło, Marcin; Patyk, Ewa; Katrusiak, Andrzej Chiral aggregation hierarchy in high-pressure resolved 2-butanol and 2,3-butanediol CrystEngComm, 2012, 14, 6419 |
| 4327919 | CIF | C14 H10 Al2 Cl4 O4 | P -1 | 7.1889; 8.6829; 8.9185 113.518; 112.421; 93.641 | 456.33 | Wojciech Bury; Elżbieta Chwojnowska; Iwona Justyniak; Janusz Lewiński; Aneta Affek; Ewa Zygadło-Monikowska; Joanna Bąk; Zbigniew Florjańczyk Investigations on the Interaction of Dichloroaluminum Carboxylates with Lewis Bases and Water: an Efficient Road toward Oxo- and Hydroxoaluminum Carboxylate Complexes Inorganic Chemistry, 2012, 51, 737-745 |
| 4503017 | CIF | C10 H8 O18 U3 | P -1 | 5.5266; 7.6559; 11.3208 100.846; 100.44; 96.94 | 456.66 | Mihalcea, Ionut; Henry, Natacha; Volkringer, Christophe; Loiseau, Thierry Uranyl‒Pyromellitate Coordination Polymers: Toward Three-Dimensional Open Frameworks with Large Channel Systems Crystal Growth & Design, 2012, 12, 526 |
| 7018001 | CIF | C16 H20 N6 O8 Zn | P -1 | 7.6143; 7.7643; 8.7796 84.066; 71.7; 67.977 | 456.78 | Jin, Juan; Bai, Fu-Quan; Jia, Ming-Jun; Peng, Yu; Yu, Jie-Hui; Xu, Ji-Qing New photoluminescence acylhydrazidate-coordinated complexes. Dalton transactions (Cambridge, England : 2003), 2012, 41, 2382-2392 |
| 7206986 | CIF | C16 H16 O14 U | P -1 | 5.5628; 6.5429; 13.8049 99.877; 91.181; 111.977 | 457.06 | Thuéry, Pierre; Masci, Bernardo Uranyl‒organic one- and two-dimensional assemblies with 2,2′-bipyridine-3,3′-dicarboxylic, biphenyl-3,3′,4,4′-tetracarboxylic and bicyclo[2.2.2]oct-7-ene-2,3,5,6-tetracarboxylic acids CrystEngComm, 2012, 14, 131 |
| 1508508 | CIF | C8 H10 D3 N O5 | P 1 1 21 | 4.819; 9.239; 10.384 90; 90; 97.16 | 458.72 | Sawada, Daisuke; Nishiyama, Yoshiharu; Langan, Paul; Forsyth, V. Trevor; Kimura, Satoshi; Wada, Masahisa Direct determination of the hydrogen bonding arrangement in anhydrous β-chitin by neutron fiber diffraction. Biomacromolecules, 2012, 13, 288-291 |
| 4329381 | CIF | Cu6.07 In5.93 Yb | I 4/m m m | 9.22; 9.22; 5.3976 90; 90; 90 | 458.84 | Udumula Subbarao; Sebastian C. Peter Crystal Structure of YbCu6In6 and Mixed Valence Behavior of Yb in YbCu6-xIn6+x (x= 0, 1, and 2) Solid Solution Inorganic Chemistry, 2012, 51, 6326-6332 |
| 7017667 | CIF | Br Hg2 I3 | C m c 21 | 4.698; 7.2246; 13.52 90; 90; 90 | 458.88 | Li, Yanjun; Wang, Meng; Zhu, Tianxiang; Meng, Xianggao; Zhong, Cheng; Chen, Xingguo; Qin, Jingui Synthesis, crystal structure and properties of a new candidate for nonlinear optical material in the IR region: Hg2BrI3. Dalton transactions (Cambridge, England : 2003), 2012, 41, 763-766 |
| 2235287 | CIF HKL Paper | C7 H7 N O6 Sr | P -1 | 7.9098; 8.0028; 8.0864 88.62; 71.27; 72.03 | 459.52 | Li, Dan; Duan, Chaowen Poly[diaqua(μ~5~-pyridine-3,5-dicarboxylato)strontium] Acta Crystallographica Section E, 2012, 68, m835 |
| 8103314 | CIF | C6 H9 Cl Cu N2 O4 | P -1 | 3.8512; 11.4011; 11.5587 111.337; 96.29; 98.626 | 459.9 | Hai-Jun Qiao; Zhi-Gang Tang; Min Yang Crystal structure of catena-aqua(m-chlorido)-(2-carboxylato-5-methylpyrazine-k2N,O)copper(II) monohydrate, CuCl(H2O)(C6H6N2O2) · H2O Zeitschrift für Kristallographie - New Crystal Structures, 2012, 227, 207 |
| 2236644 | CIF HKL Paper | C11 H8 O4 | P -1 | 3.8874; 9.782; 13.078 111.569; 90.83; 95.01 | 460.1 | Saeed, Aamer; Ibrar, Aalia; Arshad, Muhammad; Bolte, Michael Methyl 2-oxo-2<i>H</i>-chromene-3-carboxylate Acta Crystallographica Section E, 2012, 68, o3024 |
| 2236929 | CIF HKL Paper | C14 H18 Cl2 N6 O6 | P -1 | 5.0094; 8.5459; 10.8736 82.337; 88.952; 86.904 | 460.64 | Thanigaimani, Kaliyaperumal; Khalib, Nuridayanti Che; Arshad, Suhana; Razak, Ibrahim Abdul 4-Chloro-6-methoxypyrimidin-2-amine‒succinic acid (2/1) Acta Crystallographica Section E, 2012, 68, o3343 |
| 4331367 | CIF | Ba2 S6 U | P 42/n m c :2 | 5.4145; 5.4145; 15.7322 90; 90; 90 | 461.22 | Adel Mesbah; Emilie Ringe; Sébastien Lebègue; Richard P. Van Duyne; James A. Ibers Ba2An(S2)2S2 (An = U, Th): Syntheses, Structures, Optical, and Electronic Properties Inorganic Chemistry, 2012, 51, 13390-13395 |
| 4329330 | CIF | Al3 O12 P3 | P 1 2/a 1 | 8.7438; 4.85855; 10.8602 90; 90.1276; 90 | 461.364 | Masami Kanzaki; Xianyu Xue Structural Characterization of Moganite-Type AlPO4 by NMR and Powder X-ray Diffraction Inorganic Chemistry, 2012, 51, 6164-6172 |
| 1508434 | CIF | C6 H14 N6 O | P -1 | 5.49; 8.4206; 10.3003 78.564; 85.796; 81.876 | 461.53 | Laus, Gerhard; Kahlenberg, Volker; Wurst, Klaus; Schottenberger, Herwig; Fischer, Niko; Stierstorfer, Jοrg; Klapοtke, Thomas M. Synthesis and Crystal Structures of New 5,5'-Azotetrazolates Crystals, 2012, 2, 127-136 |
| 7018434 | CIF | C10 H10 Cl6 N2 O2 U | P -1 | 7.0718; 7.8003; 9.0483 89.35; 74.71; 73.96 | 461.69 | Andrews, Michael B.; Cahill, Christopher L. Utilizing hydrogen bonds and halogen-halogen interactions in the design of uranyl hybrid materials. Dalton transactions (Cambridge, England : 2003), 2012, 41, 3911-3914 |
| 2233286 | CIF HKL Paper | C12 H22 N10 O8 | P -1 | 6.2344; 7.7725; 9.7071 99.56; 92.49; 92.84 | 462.64 | Chen, Jin-Mei; Zhao, Hong (<i>E</i>)-3,3'-(Diazene-1,2-diyl)bis(1-methyl-1,4,5,6-tetrahydropyrrolo[3,4-<i>c</i>]pyrazol-5-ium) dinitrate dihydrate Acta Crystallographica Section E, 2012, 68, o151 |
| 2235997 | CIF HKL Paper | C10 H4 N2 S2 | P 1 21/c 1 | 3.9084; 9.8832; 12.0091 90; 93.9; 90 | 462.81 | Novina, J. Josephine; Vasuki, G.; Karthik, Durai; Thomas, K. R. Justin 2,2'-Bithiophene-3,3'-dicarbonitrile Acta Crystallographica Section E, 2012, 68, o2542 |
| 7214897 | CIF | C5 H9 Br3 O2 | P 1 21/m 1 | 4.1771; 19.2999; 6.0082 90; 106.732; 90 | 463.86 | Yufit, Dmitry S.; Zubatyuk, Roman; Shishkin, Oleg V.; Howard, Judith A. K. Low-melting molecular complexes. Halogen bonds in molecular complexes of bromoform CrystEngComm, 2012, 14, 8222 |
| 2235643 | CIF HKL Paper | C10 H7 F3 O3 | P -1 | 5.9516; 8.5188; 10.2036 66.985; 80.38; 78.311 | 464.05 | Asiri, Abdullah M.; Faidallah, Hassan M.; Alamry, Khalid A.; Ng, Seik Weng; Tiekink, Edward R. T. 2-Hydroxy-2-trifluoromethyl-3,4-dihydro-2<i>H</i>-1-benzopyran-4-one Acta Crystallographica Section E, 2012, 68, o2299 |
| 4330732 | CIF | C5 H6 Fe0.5 N3 O Pd0.5 S2 | P -1 | 7.5717; 7.7015; 8.5073 86.851; 87.601; 69.575 | 464.06 | Francisco J. Muñoz-Lara; Zulema Arcís-Castillo; M. Carmen Muñoz; J. Alberto Rodríguez-Velamazán; Ana B. Gaspar; José A. Real Heterobimetallic MOFs Containing Tetrathiocyanometallate Building Blocks: Pressure-Induced Spin Crossover in the Porous {FeII(pz)[PdII(SCN)4]} 3D Coordination Polymer Inorganic Chemistry, 2012, 51, 11126-11132 |
| 7208710 | CIF | C12 H22 Cd Cl2 N4 S2 | P -1 | 5.8719; 8.9749; 9.2191 78.23; 78.19; 88.73 | 465.46 | Jia, Hong-Li; Jia, Ming-Jun; Zeng, Guang; Jin, Juan; Yu, Jie-Hui; Xu, Ji-Qing Structural characterization of a series of new organically templated chained thiocyanato(halo)cadmates CrystEngComm, 2012, 14, 6599 |
| 2235566 | CIF HKL Paper | C3 H13 Cl2 N3 O Pt | P -1 | 6.2344; 6.8196; 11.5833 105.285; 96.061; 97.809 | 465.47 | Johnston, Dean H.; Miller, Nathanael A.; Tackett, Cory B. <i>cis</i>-Diamminedichloridoplatinum(II) <i>N</i>,<i>N</i>-dimethylformamide monosolvate Acta Crystallographica Section E, 2012, 68, m863-m864 |
| 9015315 | CIF | Al2.036 Ca1.16 Fe0.964 H Mn0.128 Nd0.712 O13 Si3 | P 1 21/m 1 | 8.8897; 5.7308; 10.101 90; 115.166; 90 | 465.751 | Skoda, R.; Cempirek, J.; Filip, J.; Novak, M.; Veselovsky, F.; Ctvrtlik, R. Allanite-(Nd), CaNdAl2Fe2+(SiO4)(Si2O7)O(OH), a new mineral from Askagen, Sweden American Mineralogist, 2012, 97, 983-988 |
| 4001677 | CIF | Ag3 O4 V | C 1 2/c 1 | 10.1767; 4.9787; 10.2149 90; 115.688; 90 | 466.4 | Cloet, V.; Raw, A.; Poeppelmeier, K. R.; Trimarchi, G.; Peng, H.; Im, J.; Freeman, A.J.; Perry, N. H.; Mason, T. O.; Zakutayev, A.; Ndione, P. F.; Ginley, D. S.; Perkins, J. D. Structural, Optical, and Transport Properties of α- and β-Ag3VO4 Chemistry of Materials, 2012, 24, 3346 |
| 4330815 | CIF | Fe3.95 Sb4.93 Sm2 | I 4/m m m | 4.2723; 4.2723; 25.558 90; 90; 90 | 466.5 | W. Adam Phelan; Giang V. Nguyen; Jiakui K. Wang; Gregory T. McCandless; Emilia Morosan; John F. DiTusa; Julia Y. Chan Discovery of Spin Glass Behavior in Ln2Fe4Sb5 (Ln = La-Nd and Sm) Inorganic Chemistry, 2012, 51, 11412-11421 |
| 2235045 | CIF HKL Paper | C8 H12 N4 | P 1 21/c 1 | 6.3452; 6.6731; 11.077 90; 95.61; 90 | 466.78 | Gao, Wei; Yang, Jing; Wang, Xin-Ling; Zhou, Ning; Wu, Xue-Fen 2,2'-(Piperazine-1,4-diyl)diacetonitrile Acta Crystallographica Section E, 2012, 68, o1798 |
| 4118181 | CIF | C21 H28 O3 | P 1 | 5.5849; 9.4558; 9.9361 116.623; 94.611; 90.704 | 466.88 | Zhanjie Li; Brendan T. Parr; Huw M. L. Davies Highly Stereoselective C-C Bond Formation by Rhodium-Catalyzed Tandem Ylide Formation/[2,3]-Sigmatropic Rearrangement between Donor/Acceptor Carbenoids and Chiral Allylic Alcohols Journal of the American Chemical Society, 2012, 134, 10942-10946 |
| 7207485 | CIF | C7 H12 Cl2 O | P -1 | 6.2893; 7.8029; 10.3006 103.76; 103.15; 98.4 | 467.28 | Yufit, D. S.; Howard, J. A. K. Low melting molecular complexes. The structures of molecular complexes of tri- and di-chloromethanes with small ketones and 1,4-dioxane CrystEngComm, 2012, 14, 2003 |
| 7207812 | CIF | C14 H18 Cd O12 S2 | P -1 | 5.6965; 7.1619; 11.935 93.51; 92.42; 105.53 | 467.39 | Wang, Huang; Huo, Li-Hua; Deng, Zhao-Peng; Zhao, Hui; Gao, Shan Syntheses, crystal structures and luminescent properties of Zn(ii)/Cd(ii) supramolecular complexes incorporating 4-sulfinobenzoate and its in situ oxidized ligand CrystEngComm, 2012, 14, 3501 |
| 7030283 | CIF | C2 H4 Ba2 F2 O6 S2 | P 1 21/c 1 | 10.814; 6.6286; 6.7946 90; 106.293; 90 | 467.5 | Abdollahian, Yashar; Hauser, Jesse L.; Rogow, David L.; Oliver, Allen G.; Oliver, Scott R. J. Solvothermal synthesis and characterization of two inorganic-organic hybrid materials based on barium. Dalton transactions (Cambridge, England : 2003), 2012, 41, 12630-12634 |
| 2234078 | CIF HKL Paper | C10 H11 N O4 | P 1 c 1 | 5.4619; 6.8337; 12.546 90; 92.047; 90 | 467.98 | Tan, Xue-Jie; Li, Chen-Guang; Xing, Dian-Xiang; Liu, Yun <i>exo</i>,<i>exo</i>-4-(2-Hydroxyethyl)-10-oxa-4-azatricyclo[5.2.1.0^2,6^]dec-8-ene-3,5-dione Acta Crystallographica Section E, 2012, 68, o866 |
| 1508730 | CIF | C11 H10 N4 | P -1 | 6.9749; 8.2033; 8.5227 88.458; 73.953; 87.824 | 468.24 | Wu, Wen-Bin; Huang, Jing-Mei Highly Regioselective C-N Bond Formation through C-H Azolation of Indoles Promoted by Iodine in Aqueous Media. Organic letters, 2012, 14, 5832-5835 |
| 4328549 | CIF | Ge4 La3 Li4 | I m m m | 4.5122; 6.933; 15 90; 90; 90 | 469.2 | Sheng-Ping Guo; Tae-Soo You; Svilen Bobev Closely Related Rare-Earth Metal Germanides RE2Li2Ge3andRE3Li4Ge4 (RE = La-Nd, Sm): Synthesis, Crystal Chemistry, and Magnetic Properties Inorganic Chemistry, 2012, 51, 3119-3129 |
| 7214898 | CIF | C5 H9 Br3 O2 | P 1 21/m 1 | 4.2028; 19.3569; 6.0247 90; 106.761; 90 | 469.31 | Yufit, Dmitry S.; Zubatyuk, Roman; Shishkin, Oleg V.; Howard, Judith A. K. Low-melting molecular complexes. Halogen bonds in molecular complexes of bromoform CrystEngComm, 2012, 14, 8222 |
| 7020039 | CIF | Cu3 F3 O9 P3 | P -1 | 6.1709; 9.2647; 9.6755 64.084; 73.977; 73.464 | 469.52 | Williams, Edward R.; Morris, Samuel A.; Weller, Mark T. Copper(ii) fluorophosphates. Dalton transactions (Cambridge, England : 2003), 2012, 41, 10845-10853 |
| 7206911 | CIF | C8 H7 Br O2 Ru | P -1 | 6.1076; 6.8545; 11.658 80.201; 82.342; 79.028 | 469.57 | Fuller, Rebecca O.; Griffith, Christopher S.; Koutsantonis, George A.; Lapere, Kim M.; Skelton, Brian W.; Spackman, Mark A.; White, Allan H.; Wild, Duncan A. Seemingly simple group 8 cyclopentadienyl dicarbonyl metal halides: From little things, interesting things grow CrystEngComm, 2012, 14, 812 |
| 1515089 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.433; 5.8092; 10.9101 90; 93.736; 90 | 470.09 | Ogborn, Joseph M.; Collings, Ines E.; Moggach, Stephen A.; Thompson, Amber L.; Goodwin, Andrew L. Supramolecular mechanics in a metal‒organic framework Chemical Science, 2012, 3, 3011 |
| 4117958 | CIF | Cs I3 Sn | P 4/m b m | 8.7182; 8.7182; 6.1908 90; 90; 90 | 470.54 | In Chung; Jung-Hwan Song; Jino Im; John Androulakis; Christos D. Malliakas; Hao Li; Arthur J. Freeman; John T. Kenney; Mercouri G. Kanatzidis CsSnI3: Semiconductor or Metal? High Electrical Conductivity and Strong Near-Infrared Photoluminescence from a Single Material. High Hole Mobility and Phase-Transitions Journal of the American Chemical Society, 2012, 134, 8579-8587 |
| 1503538 | CIF | C10 H11 Br O2 | P 1 21 1 | 6.3; 8.992; 8.35 90; 94.468; 90 | 471.6 | Ginotra, Sandeep K.; Friest, Jacob A.; Berkowitz, David B. Halocarbocyclization Entry into the Oxabicyclo[4.3.1]decyl Exomethylene-δ-Lactone Cores of Linearifolin and Zaluzanin A: Exploiting Combinatorial Catalysis. Organic letters, 2012, 14, 968-971 |
| 2234338 | CIF HKL Paper | C7 H14 Br N O | P -1 | 7.4115; 7.9727; 8.7948 66.43; 82.14; 85.78 | 471.7 | Han, Meng Ting 4-Allylmorpholin-4-ium bromide Acta Crystallographica Section E, 2012, 68, o1089 |
| 7207761 | CIF | C8 H10 Cl N3 O2 | P -1 | 5.3951; 8.1557; 11.4412 80.447; 84.791; 72.016 | 471.77 | Wu, An-Kai; Lee, Kwang-Ming Self-assembly of seven diamide-containing pyridinium salts via nonconventional C‒H⋯O hydrogen bonding catemers CrystEngComm, 2012, 14, 3424 |
| 2233475 | CIF HKL Paper | C8 H7 Cl N4 S | P -1 | 6.0765; 8.0268; 10.9873 72.501; 87.597; 67.88 | 471.94 | Natarajan, Sampath; Mathews, Rita 4-Amino-3-(4-chlorophenyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione Acta Crystallographica Section E, 2012, 68, o443 |
| 4329124 | CIF | Mo2 O11 Se2 Sr | P -1 | 7.8759; 8.1509; 8.8076 82.943; 65.326; 66.918 | 472.09 | Seung-Jin Oh; Dong Woo Lee; Kang Min Ok Influence of the Cation Size on the Framework Structures and Space Group Centricities in AMo2O5(SeO3)2 (A = Sr, Pb, and Ba) Inorganic Chemistry, 2012, 51, 5393-5399 |
| 2235907 | CIF HKL Paper | C11 H12 O3 | P -1 | 6.2808; 8.63; 9.389 88.603; 83.638; 69.088 | 472.4 | Goswami, Shailesh K.; Hanton, Lyall R.; McAdam, C. John; Moratti, Stephen C.; Simpson, Jim 6-Hydroxy-7,8-dimethylchroman-2-one Acta Crystallographica Section E, 2012, 68, o2332-o2333 |
| 4027404 | CIF | C19 H31 Cl N2 O | P 1 | 7.2921; 7.3234; 9.7967 102.695; 94.987; 109.832 | 472.62 | Stephen G. Davies; James A. Lee; Paul M. Roberts; Jeffrey P. Stonehouse; James E. Thomson Asymmetric Syntheses of the Homalium Alkaloids (-)-(S,S)-Homaline and (-)-(R,R)-Hopromine Journal of Organic Chemistry, 2012, 77, 7028-7045 |
| 2234886 | CIF HKL Paper | C10 H8 N6 | P 1 21 1 | 3.7219; 16.429; 7.791 90; 97.167; 90 | 472.7 | Tong, Shao-Wei; Song, Wen-Dong; Li, Shi-Jie; Miao, Dong-Liang; An, Jing-Bo 5-[4-(1<i>H</i>-Imidazol-1-yl)phenyl]-1<i>H</i>-tetrazole Acta Crystallographica Section E, 2012, 68, o1274 |
| 2235134 | CIF HKL Paper | C8 H8 Cl2 N4 | P -1 | 7.0146; 8.2862; 8.9686 70.499; 83.82; 74.204 | 472.75 | Hloušková, Nikola; Rouchal, Michal; Nečas, Marek; Vícha, Robert 2,6-Dichloro-7-isopropyl-7<i>H</i>-purine Acta Crystallographica Section E, 2012, 68, o1585 |
| 2235774 | CIF HKL Paper | C6 H10 N6 O4 | P -1 | 5.1996; 7.499; 13.119 100.206; 98.014; 106.534 | 472.8 | Froschauer, Barbara; Weil, Matthias Melaminium hydrogen malonate Acta Crystallographica Section E, 2012, 68, o2553-o2554 |
| 7018111 | CIF | C12 H8 Cl2 | P -1 | 7.6529; 8.2912; 8.8382 64.174; 78.781; 69.709 | 472.83 | Aschenbach, Lara K.; Knight, Fergus R.; Randall, Rebecca A. M.; Cordes, David B.; Baggott, Alex; Bühl, Michael; Slawin, Alexandra M. Z.; Woollins, J. Derek Onset of three-centre, four-electron bonding in peri-substituted acenaphthenes: A structural and computational investigation. Dalton transactions (Cambridge, England : 2003), 2012, 41, 3141-3153 |
| 4329125 | CIF | Mo2 O11 Pb Se2 | P -1 | 7.856; 8.2307; 8.8381 82.881; 64.843; 66.419 | 473.34 | Seung-Jin Oh; Dong Woo Lee; Kang Min Ok Influence of the Cation Size on the Framework Structures and Space Group Centricities in AMo2O5(SeO3)2 (A = Sr, Pb, and Ba) Inorganic Chemistry, 2012, 51, 5393-5399 |
| 4329115 | CIF | C4 H10 Cu N12 | P 1 21/c 1 | 6.2643; 9.6889; 7.8137 90; 92.633; 90 | 473.75 | Guo-Hong Tao; Damon A. Parrish; Jean'ne M. Shreeve Nitrogen-Rich 5-(1-Methylhydrazinyl)tetrazole and its Copper and Silver Complexes Inorganic Chemistry, 2012, 51, 5305-5312 |
| 7207216 | CIF | C5 H4 Ag3 N7 | P -1 | 8.651; 8.653; 8.658 61.51; 61.51; 61.51 | 473.8 | Ling, Yun; Zhai, Fu-Peng; Deng, Ming-Li; Wu, Dong; Chen, Zhen-Xia; Liu, Xiao-Feng; Zhou, Ya-Ming; Weng, Lin-Hong Solvothermal in situ synthesis of cyanide-containing ternary silver(I) coordination polymers and their phosphorescent properties CrystEngComm, 2012, 14, 1425 |
| 4077900 | CIF | C12 H8 O10 P2 W2 | P -1 | 6.6181; 8.0445; 9.5458 83.889; 75.274; 75.041 | 474.41 | Duffy, Matthew P.; Ting, Liow Yu; Nicholls, Leo; Li, Yongxin; Ganguly, Rakesh; Mathey, François Reaction of Terminal Phosphinidene Complexes with Dihydrogen Organometallics, 2012, 31, 2936 |
| 2105206 | CIF Paper | Al K O2 | F d -3 m :2 | 7.8033; 7.8033; 7.8033 90; 90; 90 | 475.15 | Voronin, Vladimir I.; Shekhtman, Georgi Sh.; Blatov, Vladislav A. The natural tiling approach to cation conductivity in KAlO~2~ polymorphs Acta Crystallographica Section B, 2012, 68, 356-363 |
| 7214899 | CIF | C5 H9 Br3 O2 | P 1 21/m 1 | 4.2311; 19.421; 6.0413 90; 106.76; 90 | 475.34 | Yufit, Dmitry S.; Zubatyuk, Roman; Shishkin, Oleg V.; Howard, Judith A. K. Low-melting molecular complexes. Halogen bonds in molecular complexes of bromoform CrystEngComm, 2012, 14, 8222 |
| 7019431 | CIF | C16 H30 Al2 N2 O2 | P -1 | 5.836; 8.5491; 10.8312 68.177; 80.886; 71.595 | 475.49 | Aprile, Antonino; Wilson, David D. J.; Richards, Anne F. The synthesis and characterization of mono and dinuclear group 13 complexes derived from a Schiff base. Dalton transactions (Cambridge, England : 2003), 2012, 41, 8550-8555 |
| 7208660 | CIF | C4 H10 O2 | P 21 21 21 | 4.9973; 9.4478; 10.076 90; 90; 90 | 475.72 | Podsiadło, Marcin; Patyk, Ewa; Katrusiak, Andrzej Chiral aggregation hierarchy in high-pressure resolved 2-butanol and 2,3-butanediol CrystEngComm, 2012, 14, 6419 |
| 7108275 | CIF | C6 H15 F4 N S | P -1 | 6.878; 7.761; 9.79 73.126; 80.176; 72.901 | 475.9 | James T. Goettel; Praveen Chaudhary; Paul Hazendonk; Helene P. A. Mercier; Michael Gerken SF4*N(C2H5)3: the first conclusively characterized SF4 adduct with an organic base Chem.Commun., 2012, 48, 9120 |
| 2235153 | CIF HKL Paper | C9 H10 Cl N3 O | P -1 | 5.9864; 7.4724; 11.0235 83.103; 80.04; 80.02 | 476.26 | Kant, Rajni; Gupta, Vivek K.; Kapoor, Kamini; Shripanavar, Chetan S.; Banerjee, Kaushik 1-[(6-Chloropyridin-3-yl)methyl]imidazolidin-2-one Acta Crystallographica Section E, 2012, 68, o1939 |
| 9017781 | CIF | Al1.69 Ca1.3 Fe0.67 H Mn0.67 O13 Pb0.73 Si2.96 | P 1 21/m 1 | 8.936; 5.697; 10.26 90; 114.12; 90 | 476.717 | Chukanov, N. V.; Varlamov, D. A.; Nestola, F.; Belakovskiy, D. I.; Goettlicher, J.; Britvin, S. N.; Lanza, A.; Jancev, S. Piemontite-(Pb), CaPbAl2Mn3+[Si2O7][SiO4]O(OH), a new mineral species of the epidote supergroup Neues Jahrbuch fur Mineralogie, Abhandlungen, 2012, 189, 275-286 |
| 1515178 | CIF | C23 H22 O5 | P 1 | 7.7512; 8.1381; 8.4256 69.558; 79.669; 74.031 | 476.75 | Li, Jun-Long; Zhou, Si-Li; Chen, Peng-Qiao; Dong, Lin; Liu, Tian-Yu; Chen, Ying-Chun Asymmetric Diels‒Alder reaction of β,β-disubstituted enals and chromone-fused dienes: construction of collections with high molecular complexity and skeletal diversity Chemical Science, 2012, 3, 1879 |
| 1562971 | CIF | Ag4 Eu Sb2 | R -3 m :H | 4.7239; 4.7239; 24.689 90; 90; 120 | 477.13 | Stoyko, Stanislav S.; Khatun, Mansura; Scott Mullen, C.; Mar, Arthur Ternary CaCu4P2-type pnictides AAg4Pn2 (A=Sr, Eu; Pn=As, Sb) Journal of Solid State Chemistry, 2012, 192, 325-330 |
| 2105207 | CIF Paper | Al K O2 | F d -3 m :2 | 7.8179; 7.8179; 7.8179 90; 90; 90 | 477.83 | Voronin, Vladimir I.; Shekhtman, Georgi Sh.; Blatov, Vladislav A. The natural tiling approach to cation conductivity in KAlO~2~ polymorphs Acta Crystallographica Section B, 2012, 68, 356-363 |
| 9016680 | CIF | Al1.356 Ca1.09 Ce0.42 Fe1.134 H La0.49 Mg0.05 Mn0.29 O13 Si3 Ti0.17 | P 1 21/m 1 | 8.938; 5.789; 10.153 90; 114.54; 90 | 477.884 | Kolitsch, U.; Mills, S. J.; Miyawaki, R.; Blass, G. Ferriallanite-(La), a new member of the epidote supergroup from the Eifel, Germany European Journal of Mineralogy, 2012, 24, 741-747 |
| 7107508 | CIF | C20 H23 Cl N2 O3.23 | P 1 | 5.614; 8.72; 10.053 78.575; 82.289; 87.57 | 478 | Peng Chen; Ming Gao; De-Xian Wang; Liang Zhao; Mei-Xiang Wang Practical biocatalytic desymmetrization of meso-N-heterocyclic dicarboxamides and their application in the construction of aza-sugar containing nucleoside analogs Chem.Commun., 2012, 48, 3482 |
| 2018632 | CIF HKL Paper | C16 H16 Cl2 N4 O6 | P -1 | 6.857; 8.576; 9.187 63.4; 81.94; 87.47 | 478.19 | Wang, Yi; Stoeckli-Evans, Helen The inner-salt zwitterion, the dihydrochloride dihydrate and the dimethyl sulfoxide disolvate of 3,6-bis(pyridin-2-yl)pyrazine-2,5-dicarboxylic acid Acta Crystallographica Section C, 2012, 68, o431-o435 |
| 7020051 | CIF | C7 H6 Cl2 Cu N4 | P 1 21/m 1 | 9.013; 6.214; 9.527 90; 116.29; 90 | 478.4 | Cañellas, Pablo; Bauzá, Antonio; García-Raso, Angel; Fiol, Juan J.; Deyà, Pere M; Molins, Elies; Mata, Ignasi; Frontera, Antonio Synthesis, X-ray characterization and computational studies of Cu(ii) complexes of N-pyrazolyl pyrimidine. Dalton transactions (Cambridge, England : 2003), 2012, 41, 11161-11169 |
| 2236984 | CIF HKL Paper | C10 H9 N3 O2 | P -1 | 4.363; 8.3245; 13.541 95.647; 98.46; 97.77 | 478.5 | El Brahmi, Nabil; Benchidmi, Mohammed; Essassi, El Mokhtar; Ladeira, Sonia; El Ammari, Lahcen 1-Allyl-6-nitro-1<i>H</i>-indazole Acta Crystallographica Section E, 2012, 68, o3368 |
| 7107237 | CIF | C4 H16 Cl N3 O3 S | P 1 21/m 1 | 4.936; 9.726; 10.03 90; 95.299; 90 | 479.5 | Luke J. Murphy; Alex M. McPherson; Katherine N. Robertson; Jason A. C. Clyburne Ionic Liquids and Acid Gas Capture: Water and Oxygen as Confounding Factors Chem.Commun., 2012, 48, 1227 |
| 2236679 | CIF HKL Paper | C12 H12 Cl6 N4 O2 Re | P -1 | 7.836; 8.051; 8.733 85.44; 73.85; 65.12 | 479.6 | Krawczyk, Monika K.; Krawczyk, Marta S.; Siczek, Miłosz; Lis, Tadeusz 2,2'-[(1<i>E</i>,2<i>E</i>)-1,2-Bis(hydroxyimino)ethane-1,2-diyl]dipyridinium hexachloridorhenate(IV) Acta Crystallographica Section E, 2012, 68, m1174-m1175 |
| 7215128 | CIF | C13 H10 N2 O | P 1 21 1 | 3.7658; 22.03; 5.801 90; 94.516; 90 | 479.8 | Konoshima, Hayato; Nagao, Saori; Kiyota, Issui; Amimoto, Kiichi; Yamamoto, Norifumi; Sekine, Masahiko; Nakata, Munetaka; Furukawa, Kazuki; Sekiya, Hiroshi Excited-state intramolecular proton transfer and charge transfer in 2-(2'-hydroxyphenyl)benzimidazole crystals studied by polymorphs-selected electronic spectroscopy. Physical chemistry chemical physics : PCCP, 2012, 14, 16448-16457 |
| 4330814 | CIF | Fe3.96 Nd2 Sb4.91 | I 4/m m m | 4.3051; 4.3051; 25.908 90; 90; 90 | 480.2 | W. Adam Phelan; Giang V. Nguyen; Jiakui K. Wang; Gregory T. McCandless; Emilia Morosan; John F. DiTusa; Julia Y. Chan Discovery of Spin Glass Behavior in Ln2Fe4Sb5 (Ln = La-Nd and Sm) Inorganic Chemistry, 2012, 51, 11412-11421 |
| 4331366 | CIF | Ba2 S6 Th | P 42/n m c :2 | 5.481; 5.481; 15.986 90; 90; 90 | 480.24 | Adel Mesbah; Emilie Ringe; Sébastien Lebègue; Richard P. Van Duyne; James A. Ibers Ba2An(S2)2S2 (An = U, Th): Syntheses, Structures, Optical, and Electronic Properties Inorganic Chemistry, 2012, 51, 13390-13395 |
| 2105208 | CIF Paper | Al K O2 | F d -3 m :2 | 7.8329; 7.8329; 7.8329 90; 90; 90 | 480.58 | Voronin, Vladimir I.; Shekhtman, Georgi Sh.; Blatov, Vladislav A. The natural tiling approach to cation conductivity in KAlO~2~ polymorphs Acta Crystallographica Section B, 2012, 68, 356-363 |
| 1563043 | CIF | C14 H14 N12 O6 Zn | P -1 | 7.3993; 7.9352; 9.1366 93.16; 97.93; 114.13 | 481.2 | Yang, Jie; Shen, Lei; Yang, Gao-Wen; Li, Qiao-Yun; Shen, Wei; Jin, Jian-Ning; Zhao, Jing-Jing; Dai, Jian A set of new transition metal-based coordination complexes dependent upon Hpztza ligand (Hpztza=2-(5-(pyrazin-2-yl)-2H-tetrazol-2-yl) acetic acid) Journal of Solid State Chemistry, 2012, 186, 124-133 |
| 7208659 | CIF | C4 H10 O2 | P 21 21 21 | 5.0292; 9.3989; 10.186 90; 90; 90 | 481.48 | Podsiadło, Marcin; Patyk, Ewa; Katrusiak, Andrzej Chiral aggregation hierarchy in high-pressure resolved 2-butanol and 2,3-butanediol CrystEngComm, 2012, 14, 6419 |
| 7019735 | CIF | C8 H10 N4 O4 | P -1 | 8.168; 8.2337; 8.5815 109.642; 99.708; 110.471 | 481.69 | Jamadar, Abeda; Duhme-Klair, Anne-K; Vemuri, Kiranmayi; Sritharan, Manjula; Dandawate, Prasad; Padhye, Subhash Synthesis, characterisation and antitubercular activities of a series of pyruvate-containing aroylhydrazones and their Cu-complexes. Dalton transactions (Cambridge, England : 2003), 2012, 41, 9192-9201 |
| 1503539 | CIF | C10 H11 Br O2 | P 1 21 1 | 6.343; 9.068; 8.4 90; 94.432; 90 | 481.7 | Ginotra, Sandeep K.; Friest, Jacob A.; Berkowitz, David B. Halocarbocyclization Entry into the Oxabicyclo[4.3.1]decyl Exomethylene-δ-Lactone Cores of Linearifolin and Zaluzanin A: Exploiting Combinatorial Catalysis. Organic letters, 2012, 14, 968-971 |
| 7018029 | CIF | C6 H8 Ni0.5 O S4 | P -1 | 7.6821; 8.1203; 8.7853 97.483; 114.055; 99.403 | 481.79 | Famengo, Alessia; Pinero, Dalice; Jeannin, Olivier; Guizouarn, Thierry; Fourmigué, Marc Paramagnetic dithiolene complexes as metallo-ligands: ether/thioether coordination. Dalton transactions (Cambridge, England : 2003), 2012, 41, 1441-1443 |
| 4506149 | CIF | C8 H17 Br N2 | P 1 21 1 | 6.7367; 11.1967; 6.7849 90; 109.688; 90 | 481.86 | Lauw, Yansen; Rüther, Thomas; Horne, Michael D.; Wallwork, Kia S.; Skelton, Brian W.; Madsen, Ian C.; Rodopoulos, Theo Structural Studies on the Basic Ionic Liquid 1-Ethyl-1,4-diazabicyclo[2.2.2]octanium Bis(trifluoromethylsulfonyl)imide and Its Bromide Precursor Crystal Growth & Design, 2012, 12, 2803 |
| 7206960 | CIF | C11 H10 N2 | P 21 21 2 | 7.3655; 11.7786; 5.5546 90; 90; 90 | 481.89 | Wallentin, Carl-Johan; Orentas, Edvinas; Johnson, Magnus T.; Báthori, Nikoletta B.; Butkus, Eugenijus; Wendt, Ola F.; Wärnmark, Kenneth; Öhrström, Lars Synthetic and crystallographic studies of bicyclo[3.3.1]nonane derivatives: from strong to weak hydrogen bonds and the stereochemistry of network formation CrystEngComm, 2012, 14, 178 |
| 7019820 | CIF | C H2 N6 O2 | P n a 21 | 9.855; 8.082; 6.059 90; 90; 90 | 482.6 | Klapötke, Thomas M; Piercey, Davin G.; Stierstorfer, Jörg Amination of energetic anions: high-performing energetic materials. Dalton transactions (Cambridge, England : 2003), 2012, 41, 9451-9459 |
| 4330813 | CIF | Fe4.02 Pr2 Sb4.93 | I 4/m m m | 4.3133; 4.3133; 25.976 90; 90; 90 | 483.3 | W. Adam Phelan; Giang V. Nguyen; Jiakui K. Wang; Gregory T. McCandless; Emilia Morosan; John F. DiTusa; Julia Y. Chan Discovery of Spin Glass Behavior in Ln2Fe4Sb5 (Ln = La-Nd and Sm) Inorganic Chemistry, 2012, 51, 11412-11421 |
| 7017724 | CIF | C6 H4 Cd N4 S2 | P 1 21/m 1 | 5.6358; 12.4946; 7.1516 90; 105.634; 90 | 484.96 | Jess, Inke; Boeckmann, Jan; Näther, Christian New cadmium thio- and selenocyanato coordination compounds: structural snapshots on the reaction pathway to more condensed anionic networks. Dalton transactions (Cambridge, England : 2003), 2012, 41, 228-236 |
| 4328974 | CIF | C5 H11 N Ni O7 S | P 1 21 1 | 5.319; 9.5535; 9.7302 90; 101.23; 90 | 484.97 | Yan-Yan Yin; Jian-Gong Ma; Zheng Niu; Xiao-Chang Cao; Wei Shi; Peng Cheng Chiral Ni(II) Coordination Polymers: Structure-Driven Effects of Temperature and Polyvinylpyrrolidone Inorganic Chemistry, 2012, 51, 4784-4790 |
| 9014689 | CIF | As0.154 Cu1.368 Fe2.148 H24 Mg0.222 Ni2.262 O24 Sb1.846 | P -3 | 5.3506; 5.3506; 19.5802 90; 90; 120 | 485.459 | Mills, S. J.; Kampf, A. R.; Housley, R. M.; Favreau, G.; Pasero, M.; Biagioni, C.; Merlino, S.; Berbain, C.; Orlandi, P. Omsite, (Ni,Cu)2Fe3+(OH)6[Sb(OH)6], a new member of the cualstibite group from Oms, France Mineralogical Magazine, 2012, 76, 1347-1354 |
| 4330812 | CIF | Ce2 Fe3.98 Sb4.93 | I 4/m m m | 4.3237; 4.3237; 25.998 90; 90; 90 | 486 | W. Adam Phelan; Giang V. Nguyen; Jiakui K. Wang; Gregory T. McCandless; Emilia Morosan; John F. DiTusa; Julia Y. Chan Discovery of Spin Glass Behavior in Ln2Fe4Sb5 (Ln = La-Nd and Sm) Inorganic Chemistry, 2012, 51, 11412-11421 |
| 4330275 | CIF | Li2 Mo O6 Te | P 1 21/n 1 | 5.383; 13.0027; 6.9814 90; 94.762; 90 | 486.97 | Sau Doan Nguyen; P. Shiv Halasyamani Synthesis, Structure, and Characterization of New Li± d0-Lone-Pair - Oxides: Noncentrosymmetric Polar Li6(Mo2O5)3(SeO3)6and Centrosymmetric Li2(MO3)(TeO3) (M = Mo6+or W6+) Inorganic Chemistry, 2012, 51, 9529-9538 |
| 1562970 | CIF | Ag4 Sb2 Sr | R -3 m :H | 4.7404; 4.7404; 25.029 90; 90; 120 | 487.08 | Stoyko, Stanislav S.; Khatun, Mansura; Scott Mullen, C.; Mar, Arthur Ternary CaCu4P2-type pnictides AAg4Pn2 (A=Sr, Eu; Pn=As, Sb) Journal of Solid State Chemistry, 2012, 192, 325-330 |
| 4506958 | CIF | C18 H6 F18 N2 | P -1 | 5.0202; 5.2709; 18.535 85.068; 85.602; 88.84 | 487.2 | Sun, Haoran; Tottempudi, Usha K.; Mottishaw, Jeffery D.; Basa, Prem N.; Putta, Anjaneyulu; Sykes, Andrew G. Strengthening π‒π Interactions While Suppressing Csp2‒H···π (T-Shaped) Interactions via Perfluoroalkylation: A Crystallographic and Computational Study That Supports the Beneficial Formation of 1-D π‒π Stacked Aromatic Materials Crystal Growth & Design, 2012, 12, 5655 |
| 7208658 | CIF | C4 H10 O2 | P 21 21 21 | 5.0482; 9.422; 10.25 90; 90; 90 | 487.53 | Podsiadło, Marcin; Patyk, Ewa; Katrusiak, Andrzej Chiral aggregation hierarchy in high-pressure resolved 2-butanol and 2,3-butanediol CrystEngComm, 2012, 14, 6419 |
| 4328764 | CIF | B6 F2 O11 Sr3 | P 1 21 1 | 6.4093; 8.2898; 9.3656 90; 101.51; 90 | 487.6 | Colin D. McMillen; Jared T. Stritzinger; Joseph W. Kolis Two Novel Acentric Borate Fluorides: M3B6O11F2 (M = Sr, Ba) Inorganic Chemistry, 2012, 51, 3953-3955 |
| 4330276 | CIF | Li2 O6 Te W | P 1 21/n 1 | 5.395; 12.944; 7.0149 90; 94.251; 90 | 488.52 | Sau Doan Nguyen; P. Shiv Halasyamani Synthesis, Structure, and Characterization of New Li± d0-Lone-Pair - Oxides: Noncentrosymmetric Polar Li6(Mo2O5)3(SeO3)6and Centrosymmetric Li2(MO3)(TeO3) (M = Mo6+or W6+) Inorganic Chemistry, 2012, 51, 9529-9538 |
| 2105156 | CIF Paper | C8 H9 F N6 O | P -1 | 6.2414; 7.2335; 11.546 105.371; 101.944; 91.7 | 489.76 | Tutughamiarso, Maya; Wagner, Guido; Egert, Ernst Cocrystals of 5-fluorocytosine. I. Coformers with fixed hydrogen-bonding sites Acta Crystallographica Section B, 2012, 68, 431-443 |
| 4505481 | CIF | C9 H8 Mn O6 | P 1 21 1 | 5.204; 9.634; 9.777 90; 91.737; 90 | 489.95 | Chen, Zhi; Gao, Dong-Liang; Diao, Chun-Hua; Liu, Yue; Ren, Jia; Chen, Ji; Zhao, Bin; Shi, Wei; Cheng, Peng Syntheses, Structures Tuned by 4,4′-Bipyridine and Magnetic Properties of a Series of Transition Metal Compounds Containingo-Carboxylphenoxyacetate Acid Crystal Growth & Design, 2012, 12, 1201 |
| 7018437 | CIF | C10 H10 Br4 Cl2 N2 O2 U | P -1 | 7.1299; 8.1429; 9.2897 89.208; 73.853; 71.952 | 491.028 | Andrews, Michael B.; Cahill, Christopher L. Utilizing hydrogen bonds and halogen-halogen interactions in the design of uranyl hybrid materials. Dalton transactions (Cambridge, England : 2003), 2012, 41, 3911-3914 |
| 7107188 | CIF | C5 H11 Co N O7 S | P 1 21 1 | 5.3211; 9.6312; 9.764 90; 101.1; 90 | 491.03 | Yan-Yan Yin; Xiao-Yan Chen; Xiao-Chang Cao; Wei Shi; Peng Cheng Temperature-directed structural recurrence in low-symmetric Co(II) complexes and nanocrystals Chem.Commun., 2012, 48, 705 |
| 4505868 | CIF | C24 H20 N2 O4 | P -1 | 6.405; 9.197; 9.482 67.88; 74.09; 75.85 | 491.33 | Tsaggeos, Kostas; Masiera, Natalia; Niwicka, Aleksandra; Dokorou, Vassiliki; Siskos, Michael G.; Skoulika, Stavroula; Michaelides, Adonis Crystal Structure, Thermal Behavior, and Photochemical Reactivity of a Series of Co-Crystals oftrans-1,2-Bis(4-pyridyl) Ethylene with Dicarboxylic Acids Crystal Growth & Design, 2012, 12, 2187 |
| 7206912 | CIF | C8 H7 I O2 Ru | P -1 | 6.9642; 7.4745; 10.068 92.968; 95.936; 108.783 | 491.49 | Fuller, Rebecca O.; Griffith, Christopher S.; Koutsantonis, George A.; Lapere, Kim M.; Skelton, Brian W.; Spackman, Mark A.; White, Allan H.; Wild, Duncan A. Seemingly simple group 8 cyclopentadienyl dicarbonyl metal halides: From little things, interesting things grow CrystEngComm, 2012, 14, 812 |
| 4507097 | CIF | C9 H11 N O5 | P -1 | 7.038; 7.257; 10.452 97.4; 108.96; 97.8 | 491.6 | Tothadi, Srinu; Desiraju, Gautam R. Synthon Modularity in 4-Hydroxybenzamide‒Dicarboxylic Acid Cocrystals Crystal Growth & Design, 2012, 12, 6188 |
| 7107238 | CIF | C4 H17 N3 O4 S | P -1 | 6.746; 8.502; 9.273 110.552; 95.519; 94.516 | 492.1 | Luke J. Murphy; Alex M. McPherson; Katherine N. Robertson; Jason A. C. Clyburne Ionic Liquids and Acid Gas Capture: Water and Oxygen as Confounding Factors Chem.Commun., 2012, 48, 1227 |
| 4329114 | CIF | C2 H6 N6 | P 1 21/c 1 | 3.8713; 12.77; 9.974 90; 93.397; 90 | 492.2 | Guo-Hong Tao; Damon A. Parrish; Jean'ne M. Shreeve Nitrogen-Rich 5-(1-Methylhydrazinyl)tetrazole and its Copper and Silver Complexes Inorganic Chemistry, 2012, 51, 5305-5312 |
| 4329975 | CIF | C6 H11 Cl N O2 Rh | P -1 | 7.2049; 7.4749; 10.7705 79.193; 76.434; 61.2 | 492.23 | Romain J. Adcock; Duc Hanh Nguyen; Sonia Ladeira; Carole Le Berre; Philippe Serp; Philippe Kalck Reactivity of Rhodium(I) Complexes Bearing Nitrogen-Containing Ligands toward CH3I: Synthesis and Full Characterization of Neutral cis-[RhX(CO)2(L)] and Acetyl [RhI(μ-I)(COMe)(CO)(L)]2 Complexes Inorganic Chemistry, 2012, 51, 8670-8685 |
| 4328246 | CIF | B6 Ba2 H4 O13 | P 1 21 1 | 6.828; 8.706; 8.441 90; 100.615; 90 | 493.2 | Li Wang; Shilie Pan; Lixian Chang; Jianyang Hu; Hongwei Yu UV Nonlinear Optical Crystal Ba2[B6O9(OH)4] Featuring Unique Chiral Layers with a New B18O42 Circle Based on BO3 and BO4 Units Inorganic Chemistry, 2012, 51, 1852-1858 |
| 7108059 | CIF | C5 H11 Gd O8 | P 1 21/m 1 | 7.9966; 6.5839; 9.9447 90; 109.425; 90 | 493.77 | Giulia Lorusso; Maria Palacios; Gary Nichol; Euan Brechin; Olivier Roubeau; Marco Evangelisti Increasing the dimensionality of cryogenic molecular coolers: Gd-based polymers and metal-organic frameworks Chem.Commun., 2012, 48, 7592 |
| 1563049 | CIF | Cu3 Er S3 | P -3 1 c | 6.707; 6.707; 12.675 90; 90; 120 | 493.78 | Gulay, L.D.; Daszkiewicz, M.; Shemet, V.Ya. Crystal structure of ∼RCu3S3 and ∼RCuTe2 (R=Gd‒Lu) compounds Journal of Solid State Chemistry, 2012, 186, 142-148 |
| 7207528 | CIF | C16 H10 Cu N8 O8 | P -1 | 6.9985; 8.0047; 9.5314 88.986; 68.71; 84.342 | 495 | Gurskiy, Stanislav I.; Tafeenko, Viktor A. The luminescent properties of structures built from 3-cyano-4-dicyanomethylene-5-oxo-4,5-dihydro-1H-pyrrole-2-olate and copper(I,II) cations CrystEngComm, 2012, 14, 2721 |
| 2233476 | CIF HKL Paper | C6 H16 N2 O6 | P 1 21 1 | 5.7311; 13.136; 6.7373 90; 102.52; 90 | 495.15 | Jin, Yu 2-[(2-Hydroxyethyl)azaniumyl]ethanaminium oxalate monohydrate Acta Crystallographica Section E, 2012, 68, o337 |
| 7052902 | CIF | C4 H7 N7 O6 | P -1 | 5.9153; 9.196; 9.4344 93.949; 90.503; 104.609 | 495.25 | Klapötke, Thomas M.; Nordheider, Andreas; Stierstorfer, Jörg Synthesis and reactivity of an unexpected highly sensitive 1-carboxymethyl-3-diazonio-5-nitrimino-1,2,4-triazole New Journal of Chemistry, 2012, 36, 1463 |
| 4027608 | CIF | C12 H6 O2 S2 | P 1 21/a 1 | 10.68236; 3.83987; 12.9514 90; 111.159; 90 | 495.436 | John T. Henssler; Adam J. Matzger Regiochemical Effects of Furan Substitution on the Electronic Properties and Solid-State Structure of Partial Fused-Ring Oligothiophenes Journal of Organic Chemistry, 2012, 77, 9298-9303 |
| 1515087 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.6885; 5.9097; 10.9351 90; 92.984; 90 | 496.18 | Ogborn, Joseph M.; Collings, Ines E.; Moggach, Stephen A.; Thompson, Amber L.; Goodwin, Andrew L. Supramolecular mechanics in a metal‒organic framework Chemical Science, 2012, 3, 3011 |
| 4330811 | CIF | Fe4.03 La2 Sb4.94 | I 4/m m m | 4.3522; 4.3522; 26.201 90; 90; 90 | 496.3 | W. Adam Phelan; Giang V. Nguyen; Jiakui K. Wang; Gregory T. McCandless; Emilia Morosan; John F. DiTusa; Julia Y. Chan Discovery of Spin Glass Behavior in Ln2Fe4Sb5 (Ln = La-Nd and Sm) Inorganic Chemistry, 2012, 51, 11412-11421 |
| 4328578 | CIF | H2 Na3 Np O11 Se2 | P -1 | 6.9742; 7.9833; 9.6904 90.113; 95.914; 112.149 | 496.57 | Geng Bang Jin; S. Skanthakumar; L. Soderholm Three New Sodium Neptunyl(V) Selenate Hydrates: Structures, Raman Spectroscopy, and Magnetism Inorganic Chemistry, 2012, 51, 3220-3230 |
| 7020308 | CIF | C13 H13 N | P 1 21 1 | 8.583; 6.422; 9.2358 90; 102.46; 90 | 497.09 | Borowski, Andrzej F.; Vendier, Laure; Sabo-Etienne, Sylviane; Rozycka-Sokolowska, Ewa; Gaudyn, Alicja V. Catalyzed hydrogenation of condensed three-ring arenes and their N-heteroaromatic analogues by a bis(dihydrogen) ruthenium complex Dalton transactions (Cambridge, England : 2003), 2012, 41, 14117-14125 |
| 4027251 | CIF | C9 H11 N O3 S | P 1 21 1 | 6.6397; 9.9763; 7.518 90; 92.753; 90 | 497.415 | Hyeon-Kyu Lee; Soyeong Kang; Eun Bok Choi Stereoselective Synthesis of Norephedrine and Norpseudoephedrine by Using Asymmetric Transfer Hydrogenation Accompanied by Dynamic Kinetic Resolution Journal of Organic Chemistry, 2012, 77, 5454-5460 |
| 7207152 | CIF | C22 H16 N2 O12 | P -1 | 7.2785; 7.3763; 10.0274 72.392; 87.792; 76.164 | 497.91 | Shen, Qian Jin; Wei, Hong Qing; Zou, Wen Sheng; Sun, Hao Ling; Jin, Wei Jun Cocrystals assembled by pyrene and 1,2- or 1,4-diiodotetrafluorobenzenes and their phosphorescent behaviors modulated by local molecular environment CrystEngComm, 2012, 14, 1010 |
| 2233167 | CIF HKL Paper | C11 H9 N O4 | P -1 | 5.4573; 9.823; 9.94 73.9; 78.57; 80.4 | 498.3 | Mao, Shulin 3-Carboxymethyl-1<i>H</i>-indole-4-carboxylic acid Acta Crystallographica Section E, 2012, 68, o146 |
| 4330362 | CIF | C6 H6 Ag B F4 N4 | P 1 c 1 | 5.27982; 7.80594; 13.16341 90; 112.865; 90 | 499.89 | Aurel Tăbăcaru; Claudio Pettinari; Fabio Marchetti; Corrado di Nicola; Konstantin V. Domasevitch; Simona Galli; Norberto Masciocchi; Stefania Scuri; Iolanda Grappasonni; Mario Cocchioni Antibacterial Action of 4,4'-Bipyrazolyl-Based Silver(I) Coordination Polymers Embedded in PE Disks Inorganic Chemistry, 2012, 51, 9775-9788 |
| 1515086 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.7378; 5.9245; 10.9232 90; 92.821; 90 | 500.14 | Ogborn, Joseph M.; Collings, Ines E.; Moggach, Stephen A.; Thompson, Amber L.; Goodwin, Andrew L. Supramolecular mechanics in a metal‒organic framework Chemical Science, 2012, 3, 3011 |
| 2233343 | CIF HKL Paper | C11 H11 F N2 O | P 1 21 1 | 7.122; 5.469; 12.981 90; 98.13; 90 | 500.53 | Liu, Dong-liang; Li, Chen; Tian, Xin; Li, Song; Xiao, Tao 1-(4-Fluorophenyl)-2-(1<i>H</i>-imidazol-1-yl)ethanol Acta Crystallographica Section E, 2012, 68, o152 |
| 7207737 | CIF | C14 H8 O4 | P 1 c 1 | 8.1319; 3.7102; 16.8711 90; 100.455; 90 | 500.57 | Cyrański, Michał K.; Jamróz, Michał H.; Rygula, Anna; Dobrowolski, Jan Cz.; Dobrzycki, Łukasz; Baranska, Malgorzata On two alizarin polymorphs CrystEngComm, 2012, 14, 3667 |
| 1508414 | CIF | Cl6 Mo Na3 | P -3 1 c | 6.8712; 6.8712; 12.2531 90; 90; 120 | 501 | Beran, Martin; Meyer, Gerd Crystal Structure of Na3MoCl6 Crystals, 2012, 1, 99-103 |
| 2235417 | CIF HKL Paper | C11 H12 N2 O2 | P -1 | 6.7599; 8.0885; 9.7168 90.35; 106.731; 99.486 | 501.03 | Ibrahim, Halliru; Bala, Muhammad D.; Omondi, Bernard 1-[4-(1<i>H</i>-imidazol-1-yl)phenyl]ethanone monohydrate Acta Crystallographica Section E, 2012, 68, o2305 |
| 4328762 | CIF | B6 H2 O13 Sr3 | P -1 | 6.6275; 6.6706; 11.393 91.06; 94.5; 93.12 | 501.25 | Carla Heyward; Colin McMillen; Joseph Kolis Hydrothermal Synthesis and Crystal Structure of Two New Hydrated Alkaline Earth Metal Borates Sr3B6O11(OH)2 and Ba3B6O11(OH)2 Inorganic Chemistry, 2012, 51, 3956-3962 |
| 2236465 | CIF HKL Paper | C20 H20 N6 O8 Zn | P -1 | 6.2764; 6.9208; 12.781 99.676; 92.638; 112.639 | 501.36 | Sen, Rupam; Mal, Dasarath; Brandao, Paula; Lin, Zhi Tetraaquabis[2-(pyridin-4-yl-κ<i>N</i>)pyrimidine-5-carboxylato]zinc Acta Crystallographica Section E, 2012, 68, m1429 |
| 2018628 | CIF HKL Paper | C18 H16 Cd N14 O2 | P -1 | 7.6554; 7.8589; 9.0762 98.926; 98.066; 108.354 | 501.47 | Lysenko, Andrey B. The heterobifunctional ligand 5-[4-(1,2,4-triazol-4-yl)phenyl]-1<i>H</i>-tetrazole and its role in the construction of a Cd^II^ metal‒organic chain structure Acta Crystallographica Section C, 2012, 68, m291-m294 |
| 1508497 | CIF | C3 H5 Cl N2 O | P 1 21/n 1 | 4.2693; 10.7541; 10.9756 90; 93.535; 90 | 502.96 | Laus, Gerhard; Kahlenberg, Volker Crystal Structures of 1-Hydroxyimidazole and Its Salts Crystals, 2012, 2, 1492-1501 |
| 4330359 | CIF | C6 H8 Ag N5 O4 | P -1 | 5.54196; 8.40976; 11.3237 74.0854; 83.0807; 85.3833 | 503.21 | Aurel Tăbăcaru; Claudio Pettinari; Fabio Marchetti; Corrado di Nicola; Konstantin V. Domasevitch; Simona Galli; Norberto Masciocchi; Stefania Scuri; Iolanda Grappasonni; Mario Cocchioni Antibacterial Action of 4,4'-Bipyrazolyl-Based Silver(I) Coordination Polymers Embedded in PE Disks Inorganic Chemistry, 2012, 51, 9775-9788 |
| 4331462 | CIF HKL | Nd3.626 Pd2.861 Pt1.139 Zn26.89 | Fmmm(\a00)0s0 | 4.2652; 9.1319; 12.928 90; 90; 90 | 503.54 | Partha P. Jana; Sven Lidin Structural Impact of Platinum on the Incommensurably Modulated γ-Brass Related Composite Structure Pd15Zn54 Inorganic Chemistry, 2012, 51, 9893-9901 |
| 4517037 | CIF | C20 H22 N2 O10 | P -1 | 6.0716; 9.41; 10.012 64.52; 78.8; 80.197 | 504.12 | Braga, Dario; d’Agostino, Simone; Grepioni, Fabrizia Co-Crystals and Salts Obtained from Dinitrogen Bases and 1,2,3,4-Cyclobutane Tetracarboxylic Acid and the Use of the Latter As a Template for Solid-State Photocyclization Reactions Crystal Growth & Design, 2012, 12, 4880 |
| 1515085 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.7899; 5.9402; 10.9075 90; 92.67; 90 | 504.18 | Ogborn, Joseph M.; Collings, Ines E.; Moggach, Stephen A.; Thompson, Amber L.; Goodwin, Andrew L. Supramolecular mechanics in a metal‒organic framework Chemical Science, 2012, 3, 3011 |
| 7233556 | CIF | C28 H20 N2 | P -1 | 6.85; 9.23; 9.341 65.88; 69.95; 77.39 | 504.2 | Yujie Dong; Jibo Zhang; Xiao Tan; Lijuan Wang; Jinlong Chen; Bao Li; Ling Ye; Bin Xu; Bo Zou; Wenjing Tian Multi-stimuli responsive fluorescence switching: the reversible piezochromism and protonation effect of a divinylanthracene derivative Journal of Materials Chemistry C, 2012, 1, 7554-7559 |
| 7207764 | CIF | C8 H10 N4 O5 | P -1 | 5.452; 6.1264; 15.5624 99.478; 92.657; 99.407 | 504.38 | Wu, An-Kai; Lee, Kwang-Ming Self-assembly of seven diamide-containing pyridinium salts via nonconventional C‒H⋯O hydrogen bonding catemers CrystEngComm, 2012, 14, 3424 |
| 2105060 | CIF Paper | Cl2 H8 Mg O12 | C 1 2/m 1 | 11.4802; 8.0016; 5.9363 90; 112.317; 90 | 504.46 | Solovyov, Leonid A. Revision of the Mg(ClO~4~)~2~·4H~2~O crystal structure Acta Crystallographica Section B, 2012, 68, 89-90 |
| 4330391 | CIF | C3 H9 Cd1.5 Cl3 O4 P | P -1 | 6.9101; 8.7737; 9.5432 72.226; 87.036; 67.136 | 506.19 | Alexander V. Anyushin; Dmitry A. Mainichev; Nikolay K. Moroz; Pavel A. Abramov; Dmitry Yu. Naumov; Maxim N. Sokolov; Vladimir P. Fedin Cd2+ Complexation with P(CH2OH)3, OP(CH2OH)3, and (HOCH2)2PO2-: Coordination in Solution and Coordination Polymers Inorganic Chemistry, 2012, 51, 9995-10003 |
| 7018438 | CIF | C10 H10 Br6 N2 O2 U | P -1 | 7.257; 7.9855; 9.495 90.438; 104.966; 106.959 | 506.41 | Andrews, Michael B.; Cahill, Christopher L. Utilizing hydrogen bonds and halogen-halogen interactions in the design of uranyl hybrid materials. Dalton transactions (Cambridge, England : 2003), 2012, 41, 3911-3914 |
| 4331461 | CIF HKL | Ho3.736 Pd1.992 Pt2.008 Zn26.772 | Fmmm(\a00)0s0 | 4.2881; 9.14; 12.926 90; 90; 90 | 506.6 | Partha P. Jana; Sven Lidin Structural Impact of Platinum on the Incommensurably Modulated γ-Brass Related Composite Structure Pd15Zn54 Inorganic Chemistry, 2012, 51, 9893-9901 |
| 4330865 | CIF | C5 H11 Cl3 Ga N | P -1 | 6.6198; 8.4213; 9.3591 85.322; 81.826; 79.284 | 506.62 | Alexey Y. Timoshkin; Michael Bodensteiner; Tatiana N. Sevastianova; Anna S. Lisovenko; Elena I. Davydova; Manfred Scheer; Christian Graßl; Alina V. Butlak Do Solid-State Structures Reflect Lewis Acidity Trends of Heavier Group 13 Trihalides? Experimental and Theoretical Case Study Inorganic Chemistry, 2012, 51, 11602-11611 |
| 4330361 | CIF | C6 H6 Ag Cl N4 O4 | P -1 | 6.81989; 7.79667; 10.01358 97.1234; 104.341; 80.5017 | 506.854 | Aurel Tăbăcaru; Claudio Pettinari; Fabio Marchetti; Corrado di Nicola; Konstantin V. Domasevitch; Simona Galli; Norberto Masciocchi; Stefania Scuri; Iolanda Grappasonni; Mario Cocchioni Antibacterial Action of 4,4'-Bipyrazolyl-Based Silver(I) Coordination Polymers Embedded in PE Disks Inorganic Chemistry, 2012, 51, 9775-9788 |
| 4502927 | CIF | C10 H14 N2 O3 | P -1 | 5.391; 9.6335; 10.2582 73.516; 87.835; 82.886 | 506.92 | Kołodziejczak, Jerzy; Adamczyk-Woźniak, Agnieszka; Hachuła, Barbara; Barys, Maciej; Flakus, Henryk T.; Sporzyński, Andrzej; Koll, Aleksander Intermolecular Interactions in the Solid State of Ionic Secondary Mannich Bases Crystal Growth & Design, 2012, 12, 589 |
| 7207649 | CIF | C7 H12 Ag N5 S | P m c 21 | 6.2611; 6.4887; 12.483 90; 90; 90 | 507.14 | Li, Jianghua; Meng, Suci; Zhang, Jinfang; Song, Yinglin; Huang, Zhipeng; Zhao, Huajian; Wei, Hongyang; Huang, Wenjiang; Cifuentes, Marie P.; Humphrey, Mark G.; Zhang, Chi Solvent-induced syntheses of 2D/3D [AgSCN]n-based supramolecular isomers with unusual topologies: structural, theoretical and nonlinear optical studies CrystEngComm, 2012, 14, 2787 |
| 2235433 | CIF HKL Paper | C11 H6 Cl2 F N | P -1 | 3.8889; 11.1006; 12.0542 101.526; 94.93; 92.057 | 507.24 | Elahi, Fazal; Adeel, Muhammad; Tahir, M. Nawaz 5-(2,3-Dichlorophenyl)-2-fluoropyridine Acta Crystallographica Section E, 2012, 68, o2180 |
| 4331463 | CIF HKL | Pd2.496 Pm3.965 Pt1.504 Zn26.546 | Fmmm(\a00)0s0 | 4.2837; 9.151; 12.948 90; 90; 90 | 507.6 | Partha P. Jana; Sven Lidin Structural Impact of Platinum on the Incommensurably Modulated γ-Brass Related Composite Structure Pd15Zn54 Inorganic Chemistry, 2012, 51, 9893-9901 |
| 1515084 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.8401; 5.9549; 10.8935 90; 92.556; 90 | 508.08 | Ogborn, Joseph M.; Collings, Ines E.; Moggach, Stephen A.; Thompson, Amber L.; Goodwin, Andrew L. Supramolecular mechanics in a metal‒organic framework Chemical Science, 2012, 3, 3011 |
| 8103274 | CIF | C14 H22 Co N4 O12 | P -1 | 7.1485; 8.8837; 9.3461 66.036; 88.452; 70.882 | 508.57 | Xin-Yu Yang; Li-Yan Yang; Peng-Peng Lei; Jing Jing Shang Crystal structure of diaquabis(hydrogen 2-ethyl-1H-imidazole-4,5-dicarboxylato-k2N,O)cobalt(II) dihydrate, Co(H2O)2(C7H7N2O4)2 · 2H2O Zeitschrift für Kristallographie - New Crystal Structures, 2012, 227, 59 |
| 1515155 | CIF | C24 H12 Br2 O6 | P -1 | 6.9255; 7.3969; 11.6514 72.785; 78.03; 63.603 | 508.68 | Fallon, Thomas; Willis, Anthony C.; Rae, A. David; Paddon-Row, Michael N.; Sherburn, Michael S. β-Oligofurans Chemical Science, 2012, 3, 2133 |
| 1507617 | CIF | C10 H16 O4 | P 1 21 1 | 5.7129; 14.9506; 6.4594 90; 112.684; 90 | 509.03 | Farcet, Jean-Baptiste; Himmelbauer, Martin; Mulzer, Johann A Non-Photochemical Approach to the Bicyclo[3.2.0]heptane Core of Bielschowskysin. Organic letters, 2012, 14, 2195-2197 |
| 8103299 | CIF | C14 H18 Cl2 N6 O6 Pd | P -1 | 7.4741; 8.3215; 9.1618 73.605; 76.146; 70.823 | 509.51 | Gerhard Laus; Klaus Wurst; Herwig Schottenberger Crystal structure of trans-dichlorobis[(E)-2-(1-methoxyimidazol-2-yl)-2-oxoacetaldehyde O-methyl oxime]palladium(II), PdCl2(C7H9N3O3)2 Zeitschrift für Kristallographie - New Crystal Structures, 2012, 227, 17 |
| 2235927 | CIF HKL Paper | C7 H14 N4 O S | P -1 | 5.7065; 9.0632; 10.7109 71.309; 76.318; 86.42 | 509.8 | Abduelftah, Halema Shaban; Ali, Amna Qasem; Eltayeb, Naser Eltaher; Teoh, Siang Guan; Fun, Hoong-Kun (<i>E</i>)-<i>N</i>-Ethyl-2-[(<i>E</i>)-3-(hydroxyimino)butan-2-ylidene]hydrazinecarbothioamide Acta Crystallographica Section E, 2012, 68, o2552 |
| 4118905 | CIF | C21 H23 N O5 S | P 1 | 5.657; 9.558; 10.914 111.971; 98.331; 104.655 | 510.2 | Mahiuddin Baidya; Kimberly A. Griffin; Hisashi Yamamoto Catalytic Enantioselective O-Nitrosocarbonyl Aldol Reaction of β-Dicarbonyl Compounds Journal of the American Chemical Society, 2012, 134, 18566-18569 |
| 2237029 | CIF HKL Paper | C16 H20 Cl2 Ni O10 | P -1 | 4.894; 5.769; 18.369 97.226; 90.088; 96.796 | 510.8 | Ashurov, Jamshid; Ziyaev, Mavlonbek; Ibragimov, Bakhtiyar; Talipov, Samat <i>trans</i>-Tetraaquabis[2-(4-chlorophenoxy)acetato-κ<i>O</i>^1^]nickel(II) Acta Crystallographica Section E, 2012, 68, m1464 |
| 4328031 | CIF HKL | Ga O5 Sc Sr2 | I c m m | 5.91158; 15.15258; 5.70458 90; 90; 90 | 510.992 | Sergey V. Chernov; Yuri A. Dobrovolsky; Sergey Ya. Istomin; Evgeny V. Antipov; Jekabs Grins; Gunnar Svensson; Nadezhda V. Tarakina; Artem M. Abakumov; Gustaaf Van Tendeloo; Sten G. Eriksson; Seikh M. H. Rahman Sr2GaScO5, Sr10Ga6Sc4O25, and SrGa0.75Sc0.25O2.5: a Play in the Octahedra to Tetrahedra Ratio in Oxygen-Deficient Perovskites Inorganic Chemistry, 2012, 51, 1094-1103 |
| 2234456 | CIF HKL Paper | C14 H24 Co N4 O13 | P -1 | 7.1615; 8.8729; 9.3815 66.06; 88.66; 70.97 | 511 | Miao, Dong-Liang; Li, Shi-Jie; Song, Wen-Dong; Tong, Shao-Wei; Ng, Seik Weng Diaquabis(5-carboxy-2-ethyl-1<i>H</i>-imidazole-4-carboxylato-κ^2^<i>N</i>^3^,<i>O</i>^4^)cobalt(II) trihydrate Acta Crystallographica Section E, 2012, 68, m373-m374 |
| 4517038 | CIF | C20 H22 N2 O10 | P -1 | 7.1154; 7.6589; 10.6261 73.925; 82.258; 66.876 | 511.51 | Braga, Dario; d’Agostino, Simone; Grepioni, Fabrizia Co-Crystals and Salts Obtained from Dinitrogen Bases and 1,2,3,4-Cyclobutane Tetracarboxylic Acid and the Use of the Latter As a Template for Solid-State Photocyclization Reactions Crystal Growth & Design, 2012, 12, 4880 |
| 1515083 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.8946; 5.9692; 10.8812 90; 92.454; 90 | 512.3 | Ogborn, Joseph M.; Collings, Ines E.; Moggach, Stephen A.; Thompson, Amber L.; Goodwin, Andrew L. Supramolecular mechanics in a metal‒organic framework Chemical Science, 2012, 3, 3011 |
| 7020309 | CIF | C14 H14 | P 1 21 1 | 6.2543; 7.8898; 10.5305 90; 99.611; 90 | 512.34 | Borowski, Andrzej F.; Vendier, Laure; Sabo-Etienne, Sylviane; Rozycka-Sokolowska, Ewa; Gaudyn, Alicja V. Catalyzed hydrogenation of condensed three-ring arenes and their N-heteroaromatic analogues by a bis(dihydrogen) ruthenium complex. Dalton transactions (Cambridge, England : 2003), 2012, 41, 14117-14125 |
| 1515088 | CIF | C4 H5 Ag N2 | P 1 21/n 1 | 7.8926; 5.9767; 10.8739 90; 92.47; 90 | 512.46 | Ogborn, Joseph M.; Collings, Ines E.; Moggach, Stephen A.; Thompson, Amber L.; Goodwin, Andrew L. Supramolecular mechanics in a metal‒organic framework Chemical Science, 2012, 3, 3011 |
| 4517035 | CIF | C20 H24 N2 O10 | P -1 | 7.1418; 7.6788; 10.5822 73.72; 81.906; 67.038 | 512.6 | Braga, Dario; d’Agostino, Simone; Grepioni, Fabrizia Co-Crystals and Salts Obtained from Dinitrogen Bases and 1,2,3,4-Cyclobutane Tetracarboxylic Acid and the Use of the Latter As a Template for Solid-State Photocyclization Reactions Crystal Growth & Design, 2012, 12, 4880 |
| 1508623 | CIF | C10 H7 Br Cl N O | P -1 | 5.7402; 7.5688; 12.262 91.074; 99.011; 102.439 | 513.05 | Zhou, Wei; Xie, Chen; Han, Jianlin; Pan, Yi Catalyst-free intramolecular oxidative cyclization of N-allylbenzamides: a new route to 2,5-substituted oxazoles. Organic letters, 2012, 14, 4766-4769 |
| 2234567 | CIF HKL Paper | C6 H13 Cl3 Co N2 | P 1 21 1 | 6.6873; 12.433; 6.9298 90; 116.96; 90 | 513.5 | Zhou, Qinqin; Zhu, Bo-Han (4-Aza-1-azoniabicyclo[2.2.2]octane-κ<i>N</i>^4^)trichloridocobalt(II) Acta Crystallographica Section E, 2012, 68, m675 |
| 2234706 | CIF HKL Paper | C20 H18 Cd N12 O2 | P -1 | 7.607; 8.0621; 9.1509 102.762; 97.495; 106.073 | 514.84 | Tong, Shao-Wei; Li, Shi-Jie; Song, Wen-Dong; Miao, Dong-Liang; An, Jing-Bo <i>catena</i>-Poly[(<i>trans</i>-diaquacadmium)-bis{μ-5-[4-(1<i>H</i>-imidazol-1-yl)phenyl]tetrazol-1-ido}] Acta Crystallographica Section E, 2012, 68, m585-m586 |
| 7208093 | CIF | C7 H6 O2 | P 1 21/c 1 | 5.077; 4.893; 21.1 90; 100.6; 90 | 515 | Cai, Weizhao; Katrusiak, Andrzej Pressure effects on H-ordering in hydrogen bonds and interactions in benzoic acid CrystEngComm, 2012, 14, 4420 |
| 2234499 | CIF HKL Paper | C20 H18 N12 O2 Sr | P -1 | 7.621; 8.0589; 9.1641 102.783; 97.544; 106.036 | 516.29 | Tong, Shao-Wei; Li, Shi-Jie; Song, Wen-Dong; Miao, Dong-Liang; Deng, Qi <i>catena</i>-Poly[(diaquastrontium)-bis{μ-5-[4-(1<i>H</i>-imidazol-1-yl)phenyl]tetrazolido}] Acta Crystallographica Section E, 2012, 68, m523-m524 |
| 9014621 | CIF | Al8 Be Fe0.885 Mg1.73 O16 Sn0.063 Zn0.322 | P 63 m c | 5.6978; 5.6978; 18.373 90; 90; 120 | 516.565 | Yang, Z.; Ding, K.; De Fourestier, J.; Mao, Q.; Li, H. Ferrotaaffeite-2N'2S, a new mineral species, and the crystal structure of Fe2±rich magnesiotaaffeite-2N'2S from the Xianghualing tin-polymetallic ore field, Hunan Province, China The Canadian Mineralogist, 2012, 50, 21-29 |
| 4329517 | CIF | Ba2 Er Ga Se5 | P -1 | 7.2721; 8.6258; 9.3621 103.41; 103.13; 107.39 | 516.6 | Wenlong Yin; Kai Feng; Wendong Wang; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Optical and Magnetic Properties of Ba2MLnSe5 (M = Ga, In; Ln= Y, Nd, Sm, Gd, Dy, Er) Inorganic Chemistry, 2012, 51, 6860-6867 |
| 2235514 | CIF HKL Paper | C10 H12 N2 O4 | P 1 21/c 1 | 12.284; 5.64; 7.881 90; 108.713; 90 | 517.1 | Li, Chuan-Hui; Wu, Wen-Shi; Huang, Yu-Min Diethyl pyrazine-2,5-dicarboxylate Acta Crystallographica Section E, 2012, 68, o2236 |
| 2233773 | CIF HKL Paper | C14 H10 O2 | P -1 | 8.2678; 8.5268; 8.5965 92.65; 116.592; 104.045 | 517.28 | Vinutha, N.; Anthal, Sumati; Ranganatha, V. Lakshmi; Khanum, Shaukath Ara; Revannasiddaiah, D.; Kant, Rajni; Gupta, Vivek K. 2-Methylxanthen-9-one Acta Crystallographica Section E, 2012, 68, o872 |
| 2018520 | CIF HKL Paper | Fe H10 N3 O14 | P -1 | 6.7693; 7.0692; 11.6734 85.568; 80.655; 70.279 | 518.72 | Schmidt, Horst; Asztalos, Annifrid; Bok, Frank; Voigt, Wolfgang New iron(III) nitrate hydrates: Fe(NO~3~)~3~·<i>x</i>H~2~O with <i>x</i> = 4, 5 and 6 Acta Crystallographica Section C, 2012, 68, i29-i33 |
| 4329516 | CIF | Ba2 Dy Ga Se5 | P -1 | 7.2772; 8.6543; 9.3792 103.53; 103.07; 107.43 | 519.2 | Wenlong Yin; Kai Feng; Wendong Wang; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Optical and Magnetic Properties of Ba2MLnSe5 (M = Ga, In; Ln= Y, Nd, Sm, Gd, Dy, Er) Inorganic Chemistry, 2012, 51, 6860-6867 |
| 2018370 | CIF HKL Paper | Fe Li O8 W2 | C 1 2/c 1 | 9.2884; 11.4181; 4.9018 90; 90.597; 90 | 519.84 | Albino, Marjorie; Pechev, Stanislav; Veber, Philippe; Velazquez, Matias; Josse, Michael Cation ordering in the double tungstate LiFe(WO~4~)~2~ Acta Crystallographica Section C, 2012, 68, i7-i8 |
| 2233548 | CIF HKL Paper | C10 H11 N O3 S | P -1 | 8.1899; 8.8361; 8.9045 101.624; 106.694; 114.898 | 519.89 | Khan, Muneeb Hayat; Khan, Islam Ullah; Mughal, Shumaila Younas; Akkurt, Mehmet 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide Acta Crystallographica Section E, 2012, 68, o507 |
| 2234199 | CIF HKL Paper | C8 H6 F3 N3 O3 | P -1 | 7.2745; 9.0962; 9.4502 61.53; 71.18; 82.41 | 520.1 | Liu, Ming-Liang 2-Trifluoromethyl-1<i>H</i>-benzimidazol-3-ium nitrate Acta Crystallographica Section E, 2012, 68, o1012 |
| 7018439 | CIF | C10 H10 Br4 I2 N2 O2 U | P -1 | 7.8092; 8.4706; 8.8452 87.171; 70.308; 71.225 | 520.42 | Andrews, Michael B.; Cahill, Christopher L. Utilizing hydrogen bonds and halogen-halogen interactions in the design of uranyl hybrid materials. Dalton transactions (Cambridge, England : 2003), 2012, 41, 3911-3914 |
| 2236704 | CIF HKL Paper | Dy Ni3 | R -3 m :H | 4.966; 4.966; 24.37 90; 90; 120 | 520.5 | Levytskyy, Volodymyr; Babizhetskyy, Volodymyr; Kotur, Bohdan; Smetana, Volodymyr Redetermination of dysprosium trinickel from single-crystal X-ray data Acta Crystallographica Section E, 2012, 68, i83 |
| 4506048 | CIF | C4 H4 N2 O S | P 1 21/c 1 | 4.2588; 12.419; 9.844 90; 91.289; 90 | 520.5 | Jarzembska, Katarzyna N.; Kubsik, Marcin; Kamiński, Radosław; Woźniak, Krzysztof; Dominiak, Paulina M. From a Single Molecule to Molecular Crystal Architectures: Structural and Energetic Studies of Selected Uracil Derivatives Crystal Growth & Design, 2012, 12, 2508 |
| 7208090 | CIF | C7 H6 O2 | P 1 21/c 1 | 5.1036; 4.8981; 21.176 90; 100.38; 90 | 520.7 | Cai, Weizhao; Katrusiak, Andrzej Pressure effects on H-ordering in hydrogen bonds and interactions in benzoic acid CrystEngComm, 2012, 14, 4420 |
| 4329512 | CIF | Ba2 Ga Se5 Y | P -1 | 7.2876; 8.6597; 9.3876 103.51; 103.04; 107.43 | 520.9 | Wenlong Yin; Kai Feng; Wendong Wang; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Optical and Magnetic Properties of Ba2MLnSe5 (M = Ga, In; Ln= Y, Nd, Sm, Gd, Dy, Er) Inorganic Chemistry, 2012, 51, 6860-6867 |
| 2235397 | CIF HKL Paper | C12 H9 Br N2 | P -1 | 5.639; 7.958; 12.149 73.284; 86.896; 88.36 | 521.3 | Zhang, Gong-Xiao; Li, Ping; Dong, Jian; Chen, Hong-Yu Phenazin-5-ium bromide Acta Crystallographica Section E, 2012, 68, o2204 |
| 9015690 | CIF | Ca4.974 Cl0.06 F0.76 H0.18 Na0.026 O12.18 P2.844 S0.066 Si0.09 | P 63/m | 9.3687; 9.3687; 6.8739 90; 90; 120 | 522.507 | Baikie, T.; Schreyer, M. K.; Wong, C. L.; Pramana, S. S.; Klooster, W. T.; Ferraris, C.; McIntyre, G. J.; White, T. J. A multi-domain gem-grade Brazilian apatite Note: single-crystal X-ray at T = 100 K American Mineralogist, 2012, 97, 1574-1581 |
| 9016317 | CIF | Ca4.974 Cl0.06 F0.76 H0.18 Na0.026 O12.18 P2.844 S0.066 Si0.09 | P 63/m | 9.3687; 9.3687; 6.8739 90; 90; 120 | 522.507 | Baikie, T.; Schreyer, M. K.; Wong, C. L.; Pramana, S. S.; Klooster, W. T.; Ferraris, C.; McIntyre, G. J.; White, T. J. A multi-domain gem-grade Brazilian apatite Note: single-crystal neutron at T = 130 K American Mineralogist, 2012, 97, 1574-1581 |
| 4027002 | CIF | C10 H16 O5 | P 1 21 1 | 7.5846; 5.833; 11.8172 90; 90.213; 90 | 522.8 | Paresh M. Vadhadiya; Vedavati G. Puranik; C. V. Ramana The Total Synthesis and Structural Revision of Stagonolide D Journal of Organic Chemistry, 2012, 77, 2169-2175 |
| 7018213 | CIF | Mo2 O12 Pb2 Se2 | P -1 | 6.8944; 7.2219; 10.8294 99.751; 99.996; 90.041 | 523.09 | Oh, Seung-Jin; Lee, Dong Woo; Ok, Kang Min PbMSeO(6) (M = Mo and W): New quaternary mixed metal selenites with asymmetric cationic coordination environments. Dalton transactions (Cambridge, England : 2003), 2012, 41, 2995-3000 |
| 2233329 | CIF HKL Paper | C12 H6 F2 N2 O2 | P -1 | 7.5726; 7.8114; 8.9785 93.58; 94.65; 97.47 | 523.43 | Meng, Fan-Wei; Hou, Guang-Feng; Yu, Ying-Hui; Gao, Jin-Sheng 4-(2,2-Difluoro-1,3-benzodioxol-4-yl)-1<i>H</i>-pyrrole-3-carbonitrile Acta Crystallographica Section E, 2012, 68, o222 |
| 4328187 | CIF | Au6.16 Ga3.84 K2 | C m c m | 11.078; 8.4864; 5.5686 90; 90; 90 | 523.52 | Volodymyr Smetana; John D. Corbett; Gordon J. Miller Four Polyanionic Compounds in the K-Au-Ga System: A Case Study in Exploratory Synthesis and of the Art of Structural Analysis Inorganic Chemistry, 2012, 51, 1695-1702 |
| 4329713 | CIF | Au3 Ga2 Rb | P n m a | 13.384; 5.577; 7.017 90; 90; 90 | 523.77 | Volodymyr Smetana; Gordon J. Miller; John D. Corbett Three Alkali-Metal-Gold-Gallium Systems. Ternary Tunnel Structures and Some Problems with Poorly Ordered Cations Inorganic Chemistry, 2012, 51, 7711-7721 |
| 4329515 | CIF | Ba2 Ga Gd Se5 | P -1 | 7.2834; 8.7062; 9.4079 103.65; 103.02; 107.52 | 523.8 | Wenlong Yin; Kai Feng; Wendong Wang; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Optical and Magnetic Properties of Ba2MLnSe5 (M = Ga, In; Ln= Y, Nd, Sm, Gd, Dy, Er) Inorganic Chemistry, 2012, 51, 6860-6867 |
| 2236084 | CIF HKL Paper | C12 H22 Cl2 N2 Ni O12 | P -1 | 7.0245; 7.3436; 11.547 86.35; 77.78; 64.55 | 525.4 | Xia, Qiao-Hua; Guo, Zhong-Fu; Liu, Li; Lv, Jian-Quan; Li, Bing Tetraaquabis(6-chloropyridine-3-carboxylato-κ<i>O</i>)nickel(II) tetrahydrate Acta Crystallographica Section E, 2012, 68, m1393 |
| 7030127 | CIF | C22 H16 Co N2 O10 | P -1 | 7.3968; 9.1349; 9.41 110.547; 98.24; 111.63 | 525.6 | Wang, Ming-Fang; Hong, Xu-Jia; Zhan, Qing-Guang; Jin, Hong-Guang; Liu, Yi-Ting; Zheng, Zhi-Peng; Xu, Shi-Hai; Cai, Yue-Peng Temperature-/solvent-dependent low-dimensional compounds based on quinoline-2,3-dicarboxylic acid: structures and fluorescent properties. Dalton transactions (Cambridge, England : 2003), 2012, 41, 11898-11906 |
| 7208713 | CIF | C16 H14 Cd N6 S4 | P -1 | 5.8239; 9.2118; 11.001 105.22; 104.66; 102.32 | 525.6 | Jia, Hong-Li; Jia, Ming-Jun; Zeng, Guang; Jin, Juan; Yu, Jie-Hui; Xu, Ji-Qing Structural characterization of a series of new organically templated chained thiocyanato(halo)cadmates CrystEngComm, 2012, 14, 6599 |
| 9015554 | CIF | C4 H0.03 Ba Ca0.39 Ce0.66 F0.89 La0.78 Na0.61 Nd0.08 O12.03 Pr0.02 Sr0.44 | P 63/m m c | 5.1182; 5.1182; 23.1785 90; 90; 120 | 525.836 | Mills, S. J.; Kartashov, P. M.; Kampf, A. R.; Konev, A. A.; Konev, A. A.; Raudsepp, M. Cordylite-(La), a new mineral species in fenite from the Biraya Fe-REE deposit, Irkutsk, Russia Note: crystal 1 The Canadian Mineralogist, 2012, 50, 1281-1290 |
| 9016637 | CIF | C4 H0.19 Ba Ca0.39 Ce0.66 F0.75 La0.7 Na0.61 Nd0.12 O12.19 Pr0.04 Sr0.46 | P 63/m m c | 5.1196; 5.1196; 23.1784 90; 90; 120 | 526.122 | Mills, S. J.; Kartashov, P. M.; Kampf, A. R.; Konev, A. A.; Konev, A. A.; Raudsepp, M. Cordylite-(La), a new mineral species in fenite from the Biraya Fe-REE deposit, Irkutsk, Russia Note: crystal 2 The Canadian Mineralogist, 2012, 50, 1281-1290 |
| 9016658 | CIF | Mg1.96 O4 Si | F d -3 m :2 | 8.0746; 8.0746; 8.0746 90; 90; 90 | 526.457 | Ye, Y.; Brown, D. A.; Smyth, J. R.; Panero, W. R.; Jacobsen, S. D.; Chang, Y. Y.; Townsend, J. P.; Thomas, S. M.; Hauri, E. H.; Dera, P.; Frost, D. J. Compressibility and thermal expansion of hydrous ringwoodite with 2.5(3) wt% H2O Note: T = 143 K American Mineralogist, 2012, 97, 573-582 |
| 7030130 | CIF | C22 H16 N2 O10 Zn | P -1 | 7.4062; 9.136; 9.415 110.466; 98.32; 111.664 | 526.5 | Wang, Ming-Fang; Hong, Xu-Jia; Zhan, Qing-Guang; Jin, Hong-Guang; Liu, Yi-Ting; Zheng, Zhi-Peng; Xu, Shi-Hai; Cai, Yue-Peng Temperature-/solvent-dependent low-dimensional compounds based on quinoline-2,3-dicarboxylic acid: structures and fluorescent properties. Dalton transactions (Cambridge, England : 2003), 2012, 41, 11898-11906 |
| 9014471 | CIF | Mg1.94 O4 Si | F d -3 m :2 | 8.0756; 8.0756; 8.0756 90; 90; 90 | 526.653 | Ye, Y.; Brown, D. A.; Smyth, J. R.; Panero, W. R.; Jacobsen, S. D.; Chang, Y. Y.; Townsend, J. P.; Thomas, S. M.; Hauri, E. H.; Dera, P.; Frost, D. J. Compressibility and thermal expansion of hydrous ringwoodite with 2.5(3) wt% H2O Note: T = 193 K American Mineralogist, 2012, 97, 573-582 |
| 7208172 | CIF | C10 H11 N3 O3 | P 1 21 1 | 3.7849; 7.6754; 18.1962 90; 94.825; 90 | 526.74 | Chiya, Thabang J.; Lemmerer, Andreas Stoichiometric variation in two molecular salts of the anti-tuberculosis drug isoniazid with 2-butynoic acid CrystEngComm, 2012, 14, 5124 |
| 9016467 | CIF | Mg1.92 O4 Si0.98 | F d -3 m :2 | 8.0777; 8.0777; 8.0777 90; 90; 90 | 527.064 | Ye, Y.; Brown, D. A.; Smyth, J. R.; Panero, W. R.; Jacobsen, S. D.; Chang, Y. Y.; Townsend, J. P.; Thomas, S. M.; Hauri, E. H.; Dera, P.; Frost, D. J. Compressibility and thermal expansion of hydrous ringwoodite with 2.5(3) wt% H2O Note: T = 243 K American Mineralogist, 2012, 97, 573-582 |
| 2105283 | CIF Paper | Ca5 Cl0.18 H0.82 O12.82 P3 | P 63/m | 9.4139; 9.4139; 6.8679 90; 90; 120 | 527.1 | García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight Acta Crystallographica Section B, 2012, 68, 467-479 |
| 9015126 | CIF | Al2 Cu O4 | F d -3 m :2 | 8.0793; 8.0793; 8.0793 90; 90; 90 | 527.377 | Fregola, R. A.; Bosi, F.; Skogby, H.; Halenius, U. Cation ordering over short-range and long-range scales in the MgAl2O4-CuAl2O4 series Sample: CuAl100h American Mineralogist, 2012, 97, 1821-1827 |
| 4329862 | CIF | C8 H9 B F5 N S | P -1 | 5.4531; 10.225; 10.23 108.206; 98.613; 96.804 | 527.38 | Alasdair P. M. Robertson; Mairi F. Haddow; Ian Manners Synthesis and the Thermal and Catalytic Dehydrogenation Reactions of Amine-Thioboranes Inorganic Chemistry, 2012, 51, 8254-8264 |
| 8103273 | CIF | C14 H24 Mn N4 O13 | P -1 | 7.292; 8.964; 9.51 64.269; 88.749; 71.84 | 527.4 | Cheng-Jun Hao; Hui Xie; De-Yong Li Crystal structure of diaquabis(2-ethyl-4-carboxylato-5-carboxy-1H-imidazole-k2N3,O4)manganese(II) — water (1:3), [Mn(H2O)2(C7H7N2O4)2] · 3H2O Zeitschrift für Kristallographie - New Crystal Structures, 2012, 227, 77 |
| 4027270 | CIF | C12 H16 O3 | P 1 21 1 | 6.4233; 9.7999; 8.5116 90; 100.147; 90 | 527.41 | Daniel T. Hog; Peter Mayer; Dirk Trauner A Unified Approach to trans-Hydrindane Sesterterpenoids Journal of Organic Chemistry, 2012, 77, 5838-5843 |
| 9014644 | CIF | B Be2 F0.04 H0.96 O3.96 | P b c a | 9.762; 12.201; 4.43 90; 90; 90 | 527.64 | Gatta, G. D.; McIntyre, G. J.; Bromiley, G.; Guastoni, A.; Nestola, F. A single-crystal neutron diffraction study of hambergite, Be2BO3(OH,F) American Mineralogist, 2012, 97, 1891-1897 |
| 9015610 | CIF | Mg1.9 O4 Si0.99 | F d -3 m :2 | 8.0816; 8.0816; 8.0816 90; 90; 90 | 527.828 | Ye, Y.; Brown, D. A.; Smyth, J. R.; Panero, W. R.; Jacobsen, S. D.; Chang, Y. Y.; Townsend, J. P.; Thomas, S. M.; Hauri, E. H.; Dera, P.; Frost, D. J. Compressibility and thermal expansion of hydrous ringwoodite with 2.5(3) wt% H2O Note: T = 303 K American Mineralogist, 2012, 97, 573-582 |
| 7018861 | CIF | C12 H18 Fe3 N4 O18 | P -1 | 7.505; 9.049; 9.245 111.494; 107.567; 99.924 | 527.9 | Zhou, Chun-Ding; Chen, Chao; Cai, Li-Xuan; Zhang, Jie Solvent-modulated metamagnetism in an Fe(ii) system exhibiting a two-step field-induced magnetic transition. Dalton transactions (Cambridge, England : 2003), 2012, 41, 5912-5918 |
| 7214756 | CIF | C30 H18 F4 | P -1 | 4.0152; 9.821; 13.736 78.74; 86.02; 84.26 | 527.9 | Dong, Yujie; Xu, Bin; Zhang, Jibo; Lu, Hongguang; Wen, Shanpeng; Chen, Feipeng; He, Jiating; Li, Bao; Ye, Ling; Tian, Wenjing Supramolecular interactions induced fluorescent organic nanowires with high quantum yield based on 9,10-distyrylanthracene CrystEngComm, 2012, 14, 6593 |
| 2233340 | CIF HKL Paper | C6 H24 F2 N12 O10 P2 | P 1 | 6.7523; 8.2926; 9.7297 100.63; 90.885; 99.168 | 528.05 | Fábry, Jan; Fridrichová, Michaela; Dušek, Michal; Fejfarová, Karla; Krupková, Radmila Tris(2-carbamoylguanidinium) hydrogen fluorophosphonate fluorophosphonate monohydrate Acta Crystallographica Section E, 2012, 68, o47-o48 |
| 9016511 | CIF | Al2 Cu0.7 Mg0.3 O4 | F d -3 m :2 | 8.0831; 8.0831; 8.0831 90; 90; 90 | 528.122 | Fregola, R. A.; Bosi, F.; Skogby, H.; Halenius, U. Cation ordering over short-range and long-range scales in the MgAl2O4-CuAl2O4 series Sample: CuAl90dm American Mineralogist, 2012, 97, 1821-1827 |
| 9014418 | CIF | Al2 Co0.11 Mg0.89 O4 | F d -3 m :2 | 8.084; 8.084; 8.084 90; 90; 90 | 528.298 | Bosi, F.; Halenius, U.; D'Ippolito V; Andreozzi, G. B. Blue spinel crystals in the MgAl2O4-CoAl2O4 series: Part II. Cation ordering over short-range and long-range scales Sample: CoAl10 American Mineralogist, 2012, 97, 1834-1840 |
| 9015756 | CIF | Al2 Cu0.78 Mg0.22 O4 | F d -3 m :2 | 8.0841; 8.0841; 8.0841 90; 90; 90 | 528.318 | Fregola, R. A.; Bosi, F.; Skogby, H.; Halenius, U. Cation ordering over short-range and long-range scales in the MgAl2O4-CuAl2O4 series Sample: CuAl95b American Mineralogist, 2012, 97, 1821-1827 |
| 2105281 | CIF Paper | Ca5 Cl0.29 H0.71 O12.71 P3 | P 63/m | 9.431; 9.431; 6.86 90; 90; 120 | 528.4 | García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight Acta Crystallographica Section B, 2012, 68, 467-479 |
| 9016434 | CIF | Al2 Cu0.44 Mg0.56 O4 | F d -3 m :2 | 8.0846; 8.0846; 8.0846 90; 90; 90 | 528.416 | Fregola, R. A.; Bosi, F.; Skogby, H.; Halenius, U. Cation ordering over short-range and long-range scales in the MgAl2O4-CuAl2O4 series Sample: CuAl70bm American Mineralogist, 2012, 97, 1821-1827 |
| 9016719 | CIF | Al2 Co0.08 Mg0.91 O4 | F d -3 m :2 | 8.0848; 8.0848; 8.0848 90; 90; 90 | 528.455 | Bosi, F.; Halenius, U.; D'Ippolito V; Andreozzi, G. B. Blue spinel crystals in the MgAl2O4-CoAl2O4 series: Part II. Cation ordering over short-range and long-range scales Sample: CoAl1 American Mineralogist, 2012, 97, 1834-1840 |
| 7152264 | CIF | C12 H12 O2 S | P -1 | 7.2317; 8.138; 9.5 108.982; 90.709; 90.925 | 528.5 | Mitra, Prithiba; Shome, Brateen; Ranjan De, Saroj; Sarkar, Anindya; Mal, Dipakranjan Stereoselective synthesis of hydroxy stilbenoids and styrenes by atom-efficient olefination with thiophthalides. Organic & biomolecular chemistry, 2012, 10, 2742-2752 |
| 9015626 | CIF | Al2 Co0.07 Mg0.93 O4 | F d -3 m :2 | 8.0851; 8.0851; 8.0851 90; 90; 90 | 528.514 | Bosi, F.; Halenius, U.; D'Ippolito V; Andreozzi, G. B. Blue spinel crystals in the MgAl2O4-CoAl2O4 series: Part II. Cation ordering over short-range and long-range scales Sample: CoAl0.5 American Mineralogist, 2012, 97, 1834-1840 |
| 9015620 | CIF | Al2 O4 Zn | F d -3 m :2 | 8.08514; 8.08514; 8.08514 90; 90; 90 | 528.521 | Ardit, M.; Cruciani, G.; Dondi, M. Structural relaxation in tetrahedrally coordinated Co2+ along the gahnite-Co-aluminate spinel solid solution Note: inversion parameter = 0.000, Co content = 0.00 apfu American Mineralogist, 2012, 97, 1394-1401 |
| 9016362 | CIF | Al1.99 Cu0.41 Mg0.59 O4 | F d -3 m :2 | 8.0852; 8.0852; 8.0852 90; 90; 90 | 528.533 | Fregola, R. A.; Bosi, F.; Skogby, H.; Halenius, U. Cation ordering over short-range and long-range scales in the MgAl2O4-CuAl2O4 series Sample: CuAl70aw American Mineralogist, 2012, 97, 1821-1827 |
| 9015256 | CIF | Al2.01 Cu0.01 Mg0.99 O4 | F d -3 m :2 | 8.0853; 8.0853; 8.0853 90; 90; 90 | 528.553 | Fregola, R. A.; Bosi, F.; Skogby, H.; Halenius, U. Cation ordering over short-range and long-range scales in the MgAl2O4-CuAl2O4 series Sample: CuAl05b American Mineralogist, 2012, 97, 1821-1827 |
| 9014339 | CIF | Al2 Cu0.69 Mg0.31 O4 | F d -3 m :2 | 8.0857; 8.0857; 8.0857 90; 90; 90 | 528.631 | Fregola, R. A.; Bosi, F.; Skogby, H.; Halenius, U. Cation ordering over short-range and long-range scales in the MgAl2O4-CuAl2O4 series Sample: CuAl90dw American Mineralogist, 2012, 97, 1821-1827 |
| 9015304 | CIF | Al2 Cu0.12 Mg0.88 O4 | F d -3 m :2 | 8.0857; 8.0857; 8.0857 90; 90; 90 | 528.631 | Fregola, R. A.; Bosi, F.; Skogby, H.; Halenius, U. Cation ordering over short-range and long-range scales in the MgAl2O4-CuAl2O4 series Sample: CuAl30bw American Mineralogist, 2012, 97, 1821-1827 |
| 9015551 | CIF | Al2 Cu0.06 Mg0.94 O4 | F d -3 m :2 | 8.0858; 8.0858; 8.0858 90; 90; 90 | 528.651 | Fregola, R. A.; Bosi, F.; Skogby, H.; Halenius, U. Cation ordering over short-range and long-range scales in the MgAl2O4-CuAl2O4 series Sample: CuAl15a2 American Mineralogist, 2012, 97, 1821-1827 |
| 9015285 | CIF | Mg1.9 O4 Si | F d -3 m :2 | 8.086; 8.086; 8.086 90; 90; 90 | 528.69 | Ye, Y.; Brown, D. A.; Smyth, J. R.; Panero, W. R.; Jacobsen, S. D.; Chang, Y. Y.; Townsend, J. P.; Thomas, S. M.; Hauri, E. H.; Dera, P.; Frost, D. J. Compressibility and thermal expansion of hydrous ringwoodite with 2.5(3) wt% H2O Note: T = 350 K American Mineralogist, 2012, 97, 573-582 |
| 2236742 | CIF HKL Paper | C12 H22 Cl2 Co N2 O12 | P -1 | 7.0314; 7.3569; 11.564 86.41; 77.75; 64.8 | 528.7 | Xia, Qiao-Hua; Zhang, Yue; Liu, Li; Shi, Lin-Fang; Li, Bing Tetraaquabis(6-chloropyridine-3-carboxylato-κ<i>O</i>)cobalt(II) tetrahydrate Acta Crystallographica Section E, 2012, 68, m1394 |
| 9015272 | CIF | Al2 Cu0.24 Mg0.76 O4 | F d -3 m :2 | 8.0867; 8.0867; 8.0867 90; 90; 90 | 528.827 | Fregola, R. A.; Bosi, F.; Skogby, H.; Halenius, U. Cation ordering over short-range and long-range scales in the MgAl2O4-CuAl2O4 series Sample: CuAl50bw American Mineralogist, 2012, 97, 1821-1827 |
| 9014508 | CIF | Al2 Co0.25 Mg0.75 O4 | F d -3 m :2 | 8.0875; 8.0875; 8.0875 90; 90; 90 | 528.984 | Bosi, F.; Halenius, U.; D'Ippolito V; Andreozzi, G. B. Blue spinel crystals in the MgAl2O4-CoAl2O4 series: Part II. Cation ordering over short-range and long-range scales Sample: CoAl14 American Mineralogist, 2012, 97, 1834-1840 |
| 2105284 | CIF Paper | Ca5 Cl0.18 H0.82 O12.82 P3 | P 63/m | 9.423; 9.423; 6.8794 90; 90; 120 | 529 | García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight Acta Crystallographica Section B, 2012, 68, 467-479 |
| 7207921 | CIF | B6 Ba3 F2 O11 | P 1 21 1 | 6.5672; 8.5035; 9.6637 90; 101.351; 90 | 529.11 | Yu, Hongwei; Wu, Hongping; Pan, Shilie; Yang, Zhihua; Su, Xin; Zhang, Fangfang A novel deep UV nonlinear optical crystal Ba3B6O11F2, with a new fundamental building block, B6O14 group Journal of Materials Chemistry, 2012, 22, 9665 |
| 9016433 | CIF | Mg1.92 O4 Si | F d -3 m :2 | 8.0889; 8.0889; 8.0889 90; 90; 90 | 529.259 | Ye, Y.; Brown, D. A.; Smyth, J. R.; Panero, W. R.; Jacobsen, S. D.; Chang, Y. Y.; Townsend, J. P.; Thomas, S. M.; Hauri, E. H.; Dera, P.; Frost, D. J. Compressibility and thermal expansion of hydrous ringwoodite with 2.5(3) wt% H2O Note: T = 396 K American Mineralogist, 2012, 97, 573-582 |
| 2105282 | CIF Paper | Ca5 Cl0.28 H0.72 O12.71 P3 | P 63/m | 9.4284; 9.4284; 6.8756 90; 90; 120 | 529.32 | García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight Acta Crystallographica Section B, 2012, 68, 467-479 |
| 4328765 | CIF | B6 Ba3 F2 O11 | P 1 21 1 | 6.5572; 8.5107; 9.6726 90; 101.21; 90 | 529.49 | Colin D. McMillen; Jared T. Stritzinger; Joseph W. Kolis Two Novel Acentric Borate Fluorides: M3B6O11F2 (M = Sr, Ba) Inorganic Chemistry, 2012, 51, 3953-3955 |
| 9015369 | CIF | Al2 Co0.25 O4 Zn0.75 | F d -3 m :2 | 8.09014; 8.09014; 8.09014 90; 90; 90 | 529.503 | Ardit, M.; Cruciani, G.; Dondi, M. Structural relaxation in tetrahedrally coordinated Co2+ along the gahnite-Co-aluminate spinel solid solution Note: inversion parameter = 0.025, Co content = 0.25 apfu American Mineralogist, 2012, 97, 1394-1401 |
| 2234393 | CIF HKL Paper | C10 H10 Cl N O4 | P 1 21/m 1 | 3.8932; 9.1841; 14.8394 90; 93.664; 90 | 529.51 | Anitha, R.; Athimoolam, S.; Bahadur, S. Asath; Gunasekaran, M. 4-Chloroanilinium 3-carboxyprop-2-enoate Acta Crystallographica Section E, 2012, 68, o959-o960 |
| 9015514 | CIF | Al2 Co0.34 Mg0.66 O4 | F d -3 m :2 | 8.0902; 8.0902; 8.0902 90; 90; 90 | 529.514 | Bosi, F.; Halenius, U.; D'Ippolito V; Andreozzi, G. B. Blue spinel crystals in the MgAl2O4-CoAl2O4 series: Part II. Cation ordering over short-range and long-range scales Sample: CoAl20 American Mineralogist, 2012, 97, 1834-1840 |
| 9015589 | CIF | Al2 Co0.48 Mg0.52 O4 | F d -3 m :2 | 8.0914; 8.0914; 8.0914 90; 90; 90 | 529.75 | Bosi, F.; Halenius, U.; D'Ippolito V; Andreozzi, G. B. Blue spinel crystals in the MgAl2O4-CoAl2O4 series: Part II. Cation ordering over short-range and long-range scales Sample: CoAl34 American Mineralogist, 2012, 97, 1834-1840 |
| 4330136 | CIF | Co3 Fe3 H12 O24 Pr2 Sr6 | I 1 2/m 1 | 3.8442; 3.8492; 35.811 90; 88.809; 90 | 529.78 | Laurent Jantsky; Hiroshi Okamoto; Antoine Demont; Helmer Fjellvåg Tuning of Water and Hydroxide Content of Intercalated Ruddlesden-Popper-type Oxides in the PrSr3Co1.5Fe1.5O10-δSystem Inorganic Chemistry, 2012, 51, 9181-9191 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!