Crystallography Open Database
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Searching year of publication is 2014
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7239458 | CIF | C20 H17 N3 O2 | P 1 21 1 | 8.358; 6.1406; 16.069 90; 93.667; 90 | 823 | Goel, Richa; Luxami, Vijay; Paul, Kamaldeep Palladium catalyzed novel monoarylation and symmetrical/unsymmetrical diarylation of imidazo[1,2-a]pyrazines and their in vitro anticancer activities RSC Advances, 2014, 4, 9885 |
| 7239459 | CIF | C19 H12 Cl N3 O | P -1 | 5.5494; 11.2136; 12.5273 96.086; 98.854; 98.261 | 755.7 | Goel, Richa; Luxami, Vijay; Paul, Kamaldeep Palladium catalyzed novel monoarylation and symmetrical/unsymmetrical diarylation of imidazo[1,2-a]pyrazines and their in vitro anticancer activities RSC Advances, 2014, 4, 9885 |
| 7239460 | CIF | C27 H24 F3 N3 O3 | P 1 21/c 1 | 7.673; 18.385; 17.392 90; 92.942; 90 | 2450 | Qiang, Dong zhi; Shi, Jing Bo; Song, Bao An; Liu, Xin Hua Novel 2H-chromen derivatives: design, synthesis and anticancer activity RSC Advances, 2014, 4, 5607 |
| 7239461 | CIF | C4 H Cl N2 S2 | P 1 21/c 1 | 7.5167; 11.28; 8.1382 90; 108.043; 90 | 656.1 | Kalogirou, Andreas S.; Christoforou, Irene C.; Ioannidou, Heraklidia A.; Manos, Manolis J.; Koutentis, Panayiotis A. Ring transformation of (4-chloro-5H-1,2,3-dithiazol-5-ylidene)acetonitriles to 3-haloisothiazole-5-carbonitriles RSC Adv., 2014, 4, 7735 |
| 7239462 | CIF | C4 Br Cl N2 S2 | P n m a | 8.1226; 6.7318; 13.5987 90; 90; 90 | 743.57 | Kalogirou, Andreas S.; Christoforou, Irene C.; Ioannidou, Heraklidia A.; Manos, Manolis J.; Koutentis, Panayiotis A. Ring transformation of (4-chloro-5H-1,2,3-dithiazol-5-ylidene)acetonitriles to 3-haloisothiazole-5-carbonitriles RSC Adv., 2014, 4, 7735 |
| 7239463 | CIF | C25 H37 N O2 | P 1 21 1 | 11.8655; 6.3477; 14.6161 90; 97.031; 90 | 1092.59 | Jiao, Wei-Hua; Xu, Ting-Ting; Yu, Hao-Bing; Mu, Feng-Rong; Li, Jia; Li, Yu-Shan; Yang, Fan; Han, Bing-Nan; Lin, Hou-Wen Dysidaminones A‒M, cytotoxic and NF-κB inhibitory sesquiterpene aminoquinones from the South China Sea sponge Dysidea fragilis RSC Adv., 2014, 4, 9236 |
| 7239464 | CIF | C26 H39 N O2 | P 21 21 21 | 11.957; 12.5129; 15.4458 90; 90; 90 | 2310.95 | Jiao, Wei-Hua; Xu, Ting-Ting; Yu, Hao-Bing; Mu, Feng-Rong; Li, Jia; Li, Yu-Shan; Yang, Fan; Han, Bing-Nan; Lin, Hou-Wen Dysidaminones A‒M, cytotoxic and NF-κB inhibitory sesquiterpene aminoquinones from the South China Sea sponge Dysidea fragilis RSC Adv., 2014, 4, 9236 |
| 7239465 | CIF | C22 H31 N O2 | P 21 21 21 | 7.2191; 7.6075; 35.255 90; 90; 90 | 1936.2 | Jiao, Wei-Hua; Xu, Ting-Ting; Yu, Hao-Bing; Mu, Feng-Rong; Li, Jia; Li, Yu-Shan; Yang, Fan; Han, Bing-Nan; Lin, Hou-Wen Dysidaminones A‒M, cytotoxic and NF-κB inhibitory sesquiterpene aminoquinones from the South China Sea sponge Dysidea fragilis RSC Adv., 2014, 4, 9236 |
| 7239466 | CIF | C15 H7 F5 N2 O | P 1 21/c 1 | 14.9819; 7.9992; 11.2134 90; 101.48; 90 | 1317 | Hong, Tao; Song, Heli; Li, Xin; Zhang, Weibing; Xie, Yongshu Syntheses of mono- and diacylated bipyrroles with rich substitution modes and development of a prodigiosin derivative as a fluorescent Zn(ii) probe RSC Advances, 2014, 4, 6133 |
| 7239467 | CIF | C22 H6 F10 N2 O2 | P 1 21/c 1 | 11.9337; 9.6006; 17.6397 90; 94.108; 90 | 2015.8 | Hong, Tao; Song, Heli; Li, Xin; Zhang, Weibing; Xie, Yongshu Syntheses of mono- and diacylated bipyrroles with rich substitution modes and development of a prodigiosin derivative as a fluorescent Zn(ii) probe RSC Advances, 2014, 4, 6133 |
| 7239468 | CIF | C26 H9 F10 N3 O | P 1 2/c 1 | 12.3922; 9.0079; 20.4967 90; 92.244; 90 | 2286.2 | Hong, Tao; Song, Heli; Li, Xin; Zhang, Weibing; Xie, Yongshu Syntheses of mono- and diacylated bipyrroles with rich substitution modes and development of a prodigiosin derivative as a fluorescent Zn(ii) probe RSC Advances, 2014, 4, 6133 |
| 7239469 | CIF | C14 H26 Ni O6 | P -1 | 5.275; 8.7923; 9.3895 74.675; 81.562; 76.634 | 406.91 | Zhang, Qi-Long; Feng, Guang-Wei; Zhang, Yun-Qian; Zhu, Bi-Xue Syntheses, structures, and luminescence properties of anion-controlled heterometal modular coordination polymers based on a metalloligand RSC Advances, 2014, 4, 11384 |
| 7239470 | CIF | C15 H21 Ag3 N2 Ni O13 | P 41 | 15.0637; 15.0637; 10.8379 90; 90; 90 | 2459.3 | Zhang, Qi-Long; Feng, Guang-Wei; Zhang, Yun-Qian; Zhu, Bi-Xue Syntheses, structures, and luminescence properties of anion-controlled heterometal modular coordination polymers based on a metalloligand RSC Advances, 2014, 4, 11384 |
| 7239471 | CIF | C19 H33 Ag3 Cl2 Ni O16 | P 1 21 1 | 10.255; 12.84; 12.682 90; 107.119; 90 | 1595.9 | Zhang, Qi-Long; Feng, Guang-Wei; Zhang, Yun-Qian; Zhu, Bi-Xue Syntheses, structures, and luminescence properties of anion-controlled heterometal modular coordination polymers based on a metalloligand RSC Advances, 2014, 4, 11384 |
| 7239472 | CIF | C12 H14 Ag2 F6 Ni O12 S2 | P 1 21/c 1 | 10.5956; 9.9517; 11.3334 90; 93.328; 90 | 1193.03 | Zhang, Qi-Long; Feng, Guang-Wei; Zhang, Yun-Qian; Zhu, Bi-Xue Syntheses, structures, and luminescence properties of anion-controlled heterometal modular coordination polymers based on a metalloligand RSC Advances, 2014, 4, 11384 |
| 7239473 | CIF | C15 H29 Cl2 Cu N5 O4 | P 1 21/n 1 | 11.9964; 15.825; 21.4986 90; 91.78; 90 | 4079.4 | Betts, Helen M.; Pascu, Sofia I.; Buchard, Antoine; Bonnitcha, Paul D.; Dilworth, Jonathan R. One-pot synthesis, characterisation and kinetic stability of novel side-bridged pentaazamacrocyclic copper(ii) complexes RSC Advances, 2014, 4, 12964 |
| 7239474 | CIF | C34 H52 N8 O2 S2 | P 1 21 1 | 7.3468; 19.924; 13.152 90; 100.454; 90 | 1893.2 | Podyachev, Sergey N.; Semenov, Vyacheslav E.; Syakaev, Victor V.; Kashapova, Nadezda E.; Sudakova, Svetlana N.; Voronina, Julia K.; Mikhailov, Anatoly S.; Voloshina, Alexandra D.; Reznik, Vladimir S.; Konovalov, Alexander I. Metal binding properties of pyrimidinophanes and their acyclic counterparts RSC Advances, 2014, 4, 10228 |
| 7239475 | CIF | C35 H32 N2 O2 S | P 1 21/c 1 | 10.1191; 9.9999; 30.776 90; 96.077; 90 | 3096.7 | Zhong, Mei-Jin; Zhu, Hai-Tao; Gao, Pin; Qiu, Yi-Feng; Liang, Yong-Min Synthesis of (E)-3-styryl-2,5-dihydro-1H-pyrrole derivatives via Pd-catalyzed addition of indoles to hydroxy 1,6-enynes RSC Advances, 2014, 4, 8914 |
| 7239476 | CIF | C35 H32 N2 O2 S | P 1 21/c 1 | 10.1191; 9.9999; 30.776 90; 96.077; 90 | 3096.7 | Zhong, Mei-Jin; Zhu, Hai-Tao; Gao, Pin; Qiu, Yi-Feng; Liang, Yong-Min Synthesis of (E)-3-styryl-2,5-dihydro-1H-pyrrole derivatives via Pd-catalyzed addition of indoles to hydroxy 1,6-enynes RSC Advances, 2014, 4, 8914 |
| 7239477 | CIF | C15 H5 Cd3 La N6 O13 | P a -3 | 16.8594; 16.8594; 16.8594 90; 90; 90 | 4792.1 | Yang, Ting-Hai; Ferreira, Rute A. S.; Carlos, Luis D.; Rocha, João; Shi, Fa-Nian Crystal structure, topology, tiling and photoluminescence properties of 4d‒4f hetero-metal organic frameworks based on 3,5-pyrazoledicaboxylate RSC Advances, 2014, 4, 7818 |
| 7239478 | CIF | C15 H5 Cd3 N6 O13 Pr | P a -3 | 16.8075; 16.8075; 16.8075 90; 90; 90 | 4748 | Yang, Ting-Hai; Ferreira, Rute A. S.; Carlos, Luis D.; Rocha, João; Shi, Fa-Nian Crystal structure, topology, tiling and photoluminescence properties of 4d‒4f hetero-metal organic frameworks based on 3,5-pyrazoledicaboxylate RSC Advances, 2014, 4, 7818 |
| 7239479 | CIF | C15 H5 Cd3 N6 Nd O13 | P a -3 | 16.7718; 16.7718; 16.7718 90; 90; 90 | 4717.79 | Yang, Ting-Hai; Ferreira, Rute A. S.; Carlos, Luis D.; Rocha, João; Shi, Fa-Nian Crystal structure, topology, tiling and photoluminescence properties of 4d‒4f hetero-metal organic frameworks based on 3,5-pyrazoledicaboxylate RSC Advances, 2014, 4, 7818 |
| 7239480 | CIF | C15 H5 Cd3 N6 O13 Sm | P a -3 | 16.7466; 16.7466; 16.7466 90; 90; 90 | 4696.56 | Yang, Ting-Hai; Ferreira, Rute A. S.; Carlos, Luis D.; Rocha, João; Shi, Fa-Nian Crystal structure, topology, tiling and photoluminescence properties of 4d‒4f hetero-metal organic frameworks based on 3,5-pyrazoledicaboxylate RSC Advances, 2014, 4, 7818 |
| 7239481 | CIF | C15 H5 Cd3 Eu N6 O13 | P a -3 | 16.736; 16.736; 16.736 90; 90; 90 | 4687.65 | Yang, Ting-Hai; Ferreira, Rute A. S.; Carlos, Luis D.; Rocha, João; Shi, Fa-Nian Crystal structure, topology, tiling and photoluminescence properties of 4d‒4f hetero-metal organic frameworks based on 3,5-pyrazoledicaboxylate RSC Advances, 2014, 4, 7818 |
| 7239482 | CIF | C42 H53 N3 O2 S4 | P c c n | 15.4; 15.405; 17.403 90; 90; 90 | 4129 | Katagiri, Hiroshi; Tanaka, Shinya; Ohkubo, Kazuya; Akahira, Yuki; Morohashi, Naoya; Iki, Nobukiho; Hattori, Tetsutaro; Miyano, Sotaro Regioselective synthesis of 1,2- and 1,3-diaminothiacalix[4]arenes via nucleophilic aromatic substitution and their X-ray structures RSC Advances, 2014, 4, 9608 |
| 7239483 | CIF | C40 H50 N2 O2 S4 | P 1 21 1 | 10.019; 15.041; 13.613 90; 103.487; 90 | 1994.8 | Katagiri, Hiroshi; Tanaka, Shinya; Ohkubo, Kazuya; Akahira, Yuki; Morohashi, Naoya; Iki, Nobukiho; Hattori, Tetsutaro; Miyano, Sotaro Regioselective synthesis of 1,2- and 1,3-diaminothiacalix[4]arenes via nucleophilic aromatic substitution and their X-ray structures RSC Advances, 2014, 4, 9608 |
| 7239484 | CIF | C42 H53 N3 O2 S4 | P 4/n c c :2 | 15.3887; 15.3887; 17.563 90; 90; 90 | 4159.1 | Katagiri, Hiroshi; Tanaka, Shinya; Ohkubo, Kazuya; Akahira, Yuki; Morohashi, Naoya; Iki, Nobukiho; Hattori, Tetsutaro; Miyano, Sotaro Regioselective synthesis of 1,2- and 1,3-diaminothiacalix[4]arenes via nucleophilic aromatic substitution and their X-ray structures RSC Advances, 2014, 4, 9608 |
| 7239485 | CIF | C57 H72 N2 O8 S4 | P 1 21/c 1 | 13.8234; 19.7567; 24.5819 90; 123.419; 90 | 5603.5 | Katagiri, Hiroshi; Tanaka, Shinya; Ohkubo, Kazuya; Akahira, Yuki; Morohashi, Naoya; Iki, Nobukiho; Hattori, Tetsutaro; Miyano, Sotaro Regioselective synthesis of 1,2- and 1,3-diaminothiacalix[4]arenes via nucleophilic aromatic substitution and their X-ray structures RSC Advances, 2014, 4, 9608 |
| 7239486 | CIF | C26 H28 Cl3 N7 O6 | P b c a | 17.004; 18.042; 19.082 90; 90; 90 | 5854 | Liu, Wei; Wang, Qi-Qiang; Wang, Yuanyuan; Huang, Zhi-Tang; Wang, De-Xian Designed self-assemblies based on cooperative noncovalent interactions including anion‒π, lone-pair electron‒π and hydrogen bonding RSC Advances, 2014, 4, 9339 |
| 7239487 | CIF | C26 H28 Br Cl2 N7 O6 | P b c a | 17.077; 17.927; 19.393 90; 90; 90 | 5937 | Liu, Wei; Wang, Qi-Qiang; Wang, Yuanyuan; Huang, Zhi-Tang; Wang, De-Xian Designed self-assemblies based on cooperative noncovalent interactions including anion‒π, lone-pair electron‒π and hydrogen bonding RSC Advances, 2014, 4, 9339 |
| 7239488 | CIF | C26 H28 Cl2 N8 O9 | P b c a | 17.539; 17.744; 19.73 90; 90; 90 | 6140 | Liu, Wei; Wang, Qi-Qiang; Wang, Yuanyuan; Huang, Zhi-Tang; Wang, De-Xian Designed self-assemblies based on cooperative noncovalent interactions including anion‒π, lone-pair electron‒π and hydrogen bonding RSC Advances, 2014, 4, 9339 |
| 7239489 | CIF | C44 H34 Cl4 N12 O17 | P 1 21/n 1 | 13.47; 12.046; 30.738 90; 92.59; 90 | 4982.4 | Liu, Wei; Wang, Qi-Qiang; Wang, Yuanyuan; Huang, Zhi-Tang; Wang, De-Xian Designed self-assemblies based on cooperative noncovalent interactions including anion‒π, lone-pair electron‒π and hydrogen bonding RSC Advances, 2014, 4, 9339 |
| 7239490 | CIF | C16 H16 N4 O6 | P 1 21 1 | 5.0171; 16.1781; 10.3154 90; 102.463; 90 | 817.54 | Alcaine, Ana; Marqués-López, Eugenia; Herrera, Raquel P. Synthesis of interesting β-nitrohydrazides through a thiourea organocatalysed aza-Michael addition RSC Adv., 2014, 4, 9856 |
| 7239549 | CIF | C32 H44 N2 O6 | P b c n | 15.0473; 18.1959; 10.7775 90; 90; 90 | 2950.9 | Viterisi, Aurélien; Montcada, Núria F.; Kumar, Challuri Vijay; Gispert-Guirado, Francesc; Martin, Eddy; Escudero, Eduardo; Palomares, Emilio Unambiguous determination of molecular packing in crystalline donor domains of small molecule solution processed solar cell devices using routine X-ray diffraction techniques Journal of Materials Chemistry A, 2014, 2, 3536 |
| 7239550 | CIF | C66 H34 Eu4 N2 O34 | P -1 | 12.949; 13.869; 27.972 104.315; 98.301; 94.349 | 4784 | Hao, Zhaomin; Yang, Guocheng; Song, Xuezhi; Zhu, Min; Meng, Xing; Zhao, Shuna; Song, Shuyan; Zhang, Hongjie A europium(iii) based metal‒organic framework: bifunctional properties related to sensing and electronic conductivity J. Mater. Chem. A, 2014, 2, 237 |
| 7239556 | CIF | C402 H338 Cd17 N2 O116 | R 3 c :H | 25.7369; 25.7369; 61.601 90; 90; 120 | 35337.1 | Tian, Dan; Li, Yue; Chen, Rong-Ying; Chang, Ze; Wang, Guan-Yao; Bu, Xian-He A luminescent metal‒organic framework demonstrating ideal detection ability for nitroaromatic explosives J. Mater. Chem. A, 2014, 2, 1465 |
| 7239558 | CIF | C31 H41 Cd N5 O14 | P -1 | 10.217; 10.362; 18.118 102.53; 99.35; 93.79 | 1837.3 | Wang, Guan-Yao; Song, Chan; Kong, De-Ming; Ruan, Wen-Juan; Chang, Ze; Li, Yue Two luminescent metal‒organic frameworks for the sensing of nitroaromatic explosives and DNA strands J. Mater. Chem. A, 2014, 2, 2213 |
| 7239559 | CIF | C31 H41 N5 O14 Zn | P -1 | 10.004; 10.293; 17.914 103.66; 99.58; 93.45 | 1757.9 | Wang, Guan-Yao; Song, Chan; Kong, De-Ming; Ruan, Wen-Juan; Chang, Ze; Li, Yue Two luminescent metal‒organic frameworks for the sensing of nitroaromatic explosives and DNA strands J. Mater. Chem. A, 2014, 2, 2213 |
| 7239560 | CIF | C31 H22 Cu2 O10 | P 63/m m c | 18.4819; 18.4819; 34.4495 90; 90; 120 | 10190.8 | Duan, Xing; Zhang, Qi; Cai, Jianfeng; Yang, Yu; Cui, Yuanjin; He, Yabing; Wu, Chuande; Krishna, Rajamani; Chen, Banglin; Qian, Guodong A new metal‒organic framework with potential for adsorptive separation of methane from carbon dioxide, acetylene, ethylene, and ethane established by simulated breakthrough experiments Journal of Materials Chemistry A, 2014, 2, 2628 |
| 7239561 | CIF | C24 H48 Al Cl7 Mg2 O6 | P 1 21/c 1 | 12.9088; 12.2522; 23.79 90; 90.379; 90 | 3762.6 | Liu, Tianbiao; Shao, Yuyan; Li, Guosheng; Gu, Meng; Hu, Jianzhi; Xu, Suochang; Nie, Zimin; Chen, Xilin; Wang, Chongmin; Liu, Jun A facile approach using MgCl2 to formulate high performance Mg2+ electrolytes for rechargeable Mg batteries Journal of Materials Chemistry A, 2014, 2, 3430 |
| 7239562 | CIF | C42 H63 Al Cl4 Mg2 O6 | P -1 | 11.7192; 14.7431; 15.6936 101.118; 105.884; 109.517 | 2334.1 | Liu, Tianbiao; Shao, Yuyan; Li, Guosheng; Gu, Meng; Hu, Jianzhi; Xu, Suochang; Nie, Zimin; Chen, Xilin; Wang, Chongmin; Liu, Jun A facile approach using MgCl2 to formulate high performance Mg2+ electrolytes for rechargeable Mg batteries Journal of Materials Chemistry A, 2014, 2, 3430 |
| 7239563 | CIF | C9 H20 F6 N P | P 1 21/c 1 | 13.019; 15.518; 14.001 90; 110.76; 90 | 2645 | Murugesan, Sankaran; Quintero, Oliver A.; Chou, Brendan P.; Xiao, Penghao; Park, Kyusung; Hall, Justin W.; Jones, Richard A.; Henkelman, Graeme; Goodenough, John B.; Stevenson, Keith J. Wide electrochemical window ionic salt for use in electropositive metal electrodeposition and solid state Li-ion batteries J. Mater. Chem. A, 2014, 2, 2194 |
| 7239564 | CIF | C5 H5 N9 O10 | P b c a | 11.0318; 10.0035; 22.999 90; 90; 90 | 2538.1 | Yin, Ping; Zhang, Jiaheng; He, Chunlin; Parrish, Damon A.; Shreeve, Jean'ne M. Polynitro-substituted pyrazoles and triazoles as potential energetic materials and oxidizers Journal of Materials Chemistry A, 2014, 2, 3200 |
| 7239565 | CIF | C5 H3 N11 O10 | P 1 21/c 1 | 18.9685; 7.7374; 27.7321 90; 91.248; 90 | 4069.2 | Yin, Ping; Zhang, Jiaheng; He, Chunlin; Parrish, Damon A.; Shreeve, Jean'ne M. Polynitro-substituted pyrazoles and triazoles as potential energetic materials and oxidizers Journal of Materials Chemistry A, 2014, 2, 3200 |
| 7239566 | CIF | C3 H4 N6 O4 | P b c a | 12.7023; 8.0688; 13.0694 90; 90; 90 | 1339.5 | Yin, Ping; Zhang, Jiaheng; He, Chunlin; Parrish, Damon A.; Shreeve, Jean'ne M. Polynitro-substituted pyrazoles and triazoles as potential energetic materials and oxidizers Journal of Materials Chemistry A, 2014, 2, 3200 |
| 7239567 | CIF | C12 H16 I N | P 21 21 21 | 6.944; 11.434; 15.743 90; 90; 90 | 1250 | Connell, Arthur; Holliman, Peter J.; Davies, Matthew L.; Gwenin, Christopher D.; Weiss, Sophie; Pitak, Mateusz B.; Horton, Peter N.; Coles, Simon J.; Cooke, Graeme A study of dye anchoring points in half-squarylium dyes for dye-sensitized solar cells J. Mater. Chem. A, 2014, 2, 4055 |
| 7239568 | CIF | C14 H18 I N O2 | P b c a | 7.4137; 13.643; 29.756 90; 90; 90 | 3009.7 | Connell, Arthur; Holliman, Peter J.; Davies, Matthew L.; Gwenin, Christopher D.; Weiss, Sophie; Pitak, Mateusz B.; Horton, Peter N.; Coles, Simon J.; Cooke, Graeme A study of dye anchoring points in half-squarylium dyes for dye-sensitized solar cells J. Mater. Chem. A, 2014, 2, 4055 |
| 7239569 | CIF | C18 H19 N O3 | P -1 | 7.2314; 9.476; 11.6165 82.094; 82.082; 78.631 | 767.95 | Connell, Arthur; Holliman, Peter J.; Davies, Matthew L.; Gwenin, Christopher D.; Weiss, Sophie; Pitak, Mateusz B.; Horton, Peter N.; Coles, Simon J.; Cooke, Graeme A study of dye anchoring points in half-squarylium dyes for dye-sensitized solar cells J. Mater. Chem. A, 2014, 2, 4055 |
| 7239570 | CIF | C17 H18 N Na O4.5 | P -1 | 8.81; 12.003; 17.977 82.678; 86.66; 74.635 | 1817.5 | Connell, Arthur; Holliman, Peter J.; Davies, Matthew L.; Gwenin, Christopher D.; Weiss, Sophie; Pitak, Mateusz B.; Horton, Peter N.; Coles, Simon J.; Cooke, Graeme A study of dye anchoring points in half-squarylium dyes for dye-sensitized solar cells J. Mater. Chem. A, 2014, 2, 4055 |
| 7239571 | CIF | C32 H49 N Na O4.5 | P -1 | 8.6755; 10.3795; 35.24 92.172; 91.37; 99.956 | 3121.7 | Connell, Arthur; Holliman, Peter J.; Davies, Matthew L.; Gwenin, Christopher D.; Weiss, Sophie; Pitak, Mateusz B.; Horton, Peter N.; Coles, Simon J.; Cooke, Graeme A study of dye anchoring points in half-squarylium dyes for dye-sensitized solar cells J. Mater. Chem. A, 2014, 2, 4055 |
| 7239572 | CIF | C17 H20 I N | P 1 21/c 1 | 15.3349; 7.5158; 13.7564 90; 92.545; 90 | 1583.92 | Connell, Arthur; Holliman, Peter J.; Davies, Matthew L.; Gwenin, Christopher D.; Weiss, Sophie; Pitak, Mateusz B.; Horton, Peter N.; Coles, Simon J.; Cooke, Graeme A study of dye anchoring points in half-squarylium dyes for dye-sensitized solar cells J. Mater. Chem. A, 2014, 2, 4055 |
| 7239573 | CIF | C33 H43 N O3 | C 1 2/c 1 | 19.2363; 10.283; 29.048 90; 92.704; 90 | 5739.5 | Connell, Arthur; Holliman, Peter J.; Davies, Matthew L.; Gwenin, Christopher D.; Weiss, Sophie; Pitak, Mateusz B.; Horton, Peter N.; Coles, Simon J.; Cooke, Graeme A study of dye anchoring points in half-squarylium dyes for dye-sensitized solar cells J. Mater. Chem. A, 2014, 2, 4055 |
| 7239574 | CIF | C32 H41 N O3 | P -1 | 9.802; 9.8259; 15.69 83.509; 89.4; 66.4 | 1375 | Connell, Arthur; Holliman, Peter J.; Davies, Matthew L.; Gwenin, Christopher D.; Weiss, Sophie; Pitak, Mateusz B.; Horton, Peter N.; Coles, Simon J.; Cooke, Graeme A study of dye anchoring points in half-squarylium dyes for dye-sensitized solar cells J. Mater. Chem. A, 2014, 2, 4055 |
| 7239575 | CIF | C34 H38 N3 Na O3.5 | P -1 | 11.9454; 12.4652; 24.378 90.54; 101.5; 118.1 | 3115.3 | Connell, Arthur; Holliman, Peter J.; Davies, Matthew L.; Gwenin, Christopher D.; Weiss, Sophie; Pitak, Mateusz B.; Horton, Peter N.; Coles, Simon J.; Cooke, Graeme A study of dye anchoring points in half-squarylium dyes for dye-sensitized solar cells J. Mater. Chem. A, 2014, 2, 4055 |
| 7239576 | CIF | C18 H20 I N O2 | P b c a | 7.53; 13.635; 34.164 90; 90; 90 | 3507.7 | Connell, Arthur; Holliman, Peter J.; Davies, Matthew L.; Gwenin, Christopher D.; Weiss, Sophie; Pitak, Mateusz B.; Horton, Peter N.; Coles, Simon J.; Cooke, Graeme A study of dye anchoring points in half-squarylium dyes for dye-sensitized solar cells J. Mater. Chem. A, 2014, 2, 4055 |
| 7239577 | CIF | C26 H33 N O5 | P 1 21/c 1 | 12.7035; 18.2291; 11.1693 90; 111.529; 90 | 2406.1 | Connell, Arthur; Holliman, Peter J.; Davies, Matthew L.; Gwenin, Christopher D.; Weiss, Sophie; Pitak, Mateusz B.; Horton, Peter N.; Coles, Simon J.; Cooke, Graeme A study of dye anchoring points in half-squarylium dyes for dye-sensitized solar cells J. Mater. Chem. A, 2014, 2, 4055 |
| 7239578 | CIF | C104 H130 N4 O20 | P -1 | 10.8885; 17.307; 27.892 78.372; 80.234; 77.874 | 4988.8 | Connell, Arthur; Holliman, Peter J.; Davies, Matthew L.; Gwenin, Christopher D.; Weiss, Sophie; Pitak, Mateusz B.; Horton, Peter N.; Coles, Simon J.; Cooke, Graeme A study of dye anchoring points in half-squarylium dyes for dye-sensitized solar cells J. Mater. Chem. A, 2014, 2, 4055 |
| 7239582 | CIF | C46.5 H50 Cl2.5 N4 O8.5 Ru2 | P 1 21/c 1 | 20.9534; 15.4403; 29.153 90; 96.57; 90 | 9369.8 | Rojas, S.; Quartapelle-Procopio, E.; Carmona, F. J.; Romero, M. A.; Navarro, J. A. R.; Barea, E. Biophysical characterisation, antitumor activity and MOF encapsulation of a half-sandwich ruthenium(ii) mitoxantronato system J. Mater. Chem. B, 2014, 2, 2473 |
| 7239583 | CIF | C20 H30 Br N3 O2 S | P 1 21/c 1 | 11.7757; 11.5358; 16.1129 90; 94.112; 90 | 2183.18 | Porosa, Lukasz M.; Mistry, Kamlesh B.; Mocella, Amanda; Deng, Hellen; Hamzehi, Shayan; Caschera, Alex; Lough, Alan J.; Wolfaardt, Gideon; Foucher, Daniel A. Synthesis, structures and properties of self-assembling quaternary ammonium dansyl fluorescent tags for porous and non-porous surfaces J. Mater. Chem. B, 2014, 2, 1509 |
| 7239584 | CIF | C17 H25 N3 O2 S | P 1 21/c 1 | 10.5518; 12.7906; 13.4228 90; 101.582; 90 | 1774.71 | Porosa, Lukasz M.; Mistry, Kamlesh B.; Mocella, Amanda; Deng, Hellen; Hamzehi, Shayan; Caschera, Alex; Lough, Alan J.; Wolfaardt, Gideon; Foucher, Daniel A. Synthesis, structures and properties of self-assembling quaternary ammonium dansyl fluorescent tags for porous and non-porous surfaces J. Mater. Chem. B, 2014, 2, 1509 |
| 7239585 | CIF | C38 H34 Cl2 Cu2 N4 O14 | P -1 | 7.9894; 10.0752; 12.0845 98.84; 100.429; 94.519 | 939.6 | Das, Sanju; Biswas, Surajit; Mukherjee, Santanu; Bandyopadhyay, Jaya; Samanta, Subhodip; Bhowmick, Indrani; Hazra, Dipak Kumar; Ray, Ambarish; Parui, Partha Pratim A cyanide selective off‒on fluorescent chemosensor with in vivo imaging in 100% water: solid probe preferred over in situ generation RSC Adv., 2014, 4, 9656 |
| 7239586 | CIF | C42 H36 N6 O21 Zn2 | P 1 21/c 1 | 24.516; 7.3474; 23.623 90; 99.65; 90 | 4195 | Li, Fang-Fang; Zhang, Qin-Qin; Zhao, Yan-Yan; Jiang, Shu-Xin; Shi, Xue-Ying; Cui, Jian-Zhong; Gao, Hong-ling Syntheses, structures, and properties of six new coordination polymers constructed from N-heterocyclic multicarboxylic acids RSC Advances, 2014, 4, 10424 |
| 7239587 | CIF | C27 H16 N4 O8 Zn2 | P 1 21/n 1 | 8.5377; 16.953; 17.256 90; 102.99; 90 | 2433.7 | Li, Fang-Fang; Zhang, Qin-Qin; Zhao, Yan-Yan; Jiang, Shu-Xin; Shi, Xue-Ying; Cui, Jian-Zhong; Gao, Hong-ling Syntheses, structures, and properties of six new coordination polymers constructed from N-heterocyclic multicarboxylic acids RSC Advances, 2014, 4, 10424 |
| 7239588 | CIF | C20 H14 N4 O9 Zn | P -1 | 7.526; 11.277; 12.205 71.997; 87.887; 74.766 | 949.4 | Li, Fang-Fang; Zhang, Qin-Qin; Zhao, Yan-Yan; Jiang, Shu-Xin; Shi, Xue-Ying; Cui, Jian-Zhong; Gao, Hong-ling Syntheses, structures, and properties of six new coordination polymers constructed from N-heterocyclic multicarboxylic acids RSC Advances, 2014, 4, 10424 |
| 7239589 | CIF | C16 H21 N3 O8.5 Zn | P -1 | 7.4083; 10.89; 13.632 66.67; 78.17; 71.78 | 955.1 | Li, Fang-Fang; Zhang, Qin-Qin; Zhao, Yan-Yan; Jiang, Shu-Xin; Shi, Xue-Ying; Cui, Jian-Zhong; Gao, Hong-ling Syntheses, structures, and properties of six new coordination polymers constructed from N-heterocyclic multicarboxylic acids RSC Advances, 2014, 4, 10424 |
| 7239590 | CIF | C19 H19 Cu2 N3 O13 | C 1 2/c 1 | 16.349; 16.979; 17.583 90; 112.86; 90 | 4497.5 | Li, Fang-Fang; Zhang, Qin-Qin; Zhao, Yan-Yan; Jiang, Shu-Xin; Shi, Xue-Ying; Cui, Jian-Zhong; Gao, Hong-ling Syntheses, structures, and properties of six new coordination polymers constructed from N-heterocyclic multicarboxylic acids RSC Advances, 2014, 4, 10424 |
| 7239591 | CIF | C19 H17 Cu2 N3 O12 | P 1 21/n 1 | 7.7911; 17.63; 15.874 90; 96.99; 90 | 2164.2 | Li, Fang-Fang; Zhang, Qin-Qin; Zhao, Yan-Yan; Jiang, Shu-Xin; Shi, Xue-Ying; Cui, Jian-Zhong; Gao, Hong-ling Syntheses, structures, and properties of six new coordination polymers constructed from N-heterocyclic multicarboxylic acids RSC Advances, 2014, 4, 10424 |
| 7239592 | CIF | C H N O S | P 1 21/n 1 | 16.334; 12.039; 16.574 90; 109.258; 90 | 3076.8 | Yang, Meipan; Xu, Chengchao; Li, Shaoni; Cheng, Zhao; Zhou, Jia; Yang, Bingqin Three selective and sensitive “off‒on” probes based on rhodamine for Fe3+ imaging in living cells RSC Advances, 2014, 4, 14248 |
| 7239593 | CIF | C37 H37 N5 O3 S | C 1 2/c 1 | 28.38; 17.275; 19.574 90; 129.802; 90 | 7373 | Yang, Meipan; Xu, Chengchao; Li, Shaoni; Cheng, Zhao; Zhou, Jia; Yang, Bingqin Three selective and sensitive “off‒on” probes based on rhodamine for Fe3+ imaging in living cells RSC Advances, 2014, 4, 14248 |
| 7239594 | CIF | C36 H34 N6 O4 S | P -1 | 9.558; 12.296; 14.954 74.955; 82.177; 72.016 | 1611.3 | Yang, Meipan; Xu, Chengchao; Li, Shaoni; Cheng, Zhao; Zhou, Jia; Yang, Bingqin Three selective and sensitive “off‒on” probes based on rhodamine for Fe3+ imaging in living cells RSC Advances, 2014, 4, 14248 |
| 7239595 | CIF | C12 H23 Eu N O14 | P 1 21/c 1 | 10.2389; 10.3829; 17.83 90; 97.856; 90 | 1877.71 | Wang, Hong-Ming; Liu, Hui-Ping; Chu, Tian-Shu; Yang, Yang-Yi; Hu, Yun-Song; Liu, Wen-Ting; Ng, Seik Weng A luminescent terbium coordination polymer for sensing methanol RSC Adv., 2014, 4, 14035 |
| 7702005 | CIF | C50 H42 Cl4 N16 O16 Zn2 | P n a 21 | 24.8564; 18.7724; 12.3412 90; 90; 90 | 5758.6 | Bodman, Samantha E.; Fitchett, Christopher M. Conformational control of the self-assembly of triple helicates and [2 ×2]-grids from zinc(II) and 3,6-di(2-pyridyl)pyridazine based ligands. Dalton transactions (Cambridge, England : 2003), 2014, 43, 12606-12613 |
| 7702006 | CIF | C75 H47 Cl4 N13 O8 Zn | P 1 21/n 1 | 17.67812; 14.09099; 26.4871 90; 102.406; 90 | 6443.94 | Bodman, Samantha E.; Fitchett, Christopher M. Conformational control of the self-assembly of triple helicates and [2 ×2]-grids from zinc(II) and 3,6-di(2-pyridyl)pyridazine based ligands. Dalton transactions (Cambridge, England : 2003), 2014, 43, 12606-12613 |
| 7702007 | CIF | C56 H49.5 Cl4 N14.5 O16 Zn2 | A e a 2 | 24.6982; 22.0178; 21.7705 90; 90; 90 | 11838.8 | Bodman, Samantha E.; Fitchett, Christopher M. Conformational control of the self-assembly of triple helicates and [2 ×2]-grids from zinc(II) and 3,6-di(2-pyridyl)pyridazine based ligands. Dalton transactions (Cambridge, England : 2003), 2014, 43, 12606-12613 |
| 7702008 | CIF | C35.5 H42 Cl3 N8 O18.5 Zn2 | P n m a | 24.2049; 24.8897; 14.9855 90; 90; 90 | 9028.1 | Bodman, Samantha E.; Fitchett, Christopher M. Conformational control of the self-assembly of triple helicates and [2 ×2]-grids from zinc(II) and 3,6-di(2-pyridyl)pyridazine based ligands. Dalton transactions (Cambridge, England : 2003), 2014, 43, 12606-12613 |
| 7702009 | CIF | C82 H81.5 Cl6 N21 O29.25 Zn4 | P 1 21/n 1 | 16.7902; 22.1991; 27.0999 90; 92.979; 90 | 10087.2 | Bodman, Samantha E.; Fitchett, Christopher M. Conformational control of the self-assembly of triple helicates and [2 ×2]-grids from zinc(II) and 3,6-di(2-pyridyl)pyridazine based ligands. Dalton transactions (Cambridge, England : 2003), 2014, 43, 12606-12613 |
| 7702010 | CIF | C88 H102 Cl6 N22 O30 Zn4 | P -1 | 14.0182; 15.9372; 24.4801 101.375; 95.3521; 96.55 | 5288.93 | Bodman, Samantha E.; Fitchett, Christopher M. Conformational control of the self-assembly of triple helicates and [2 ×2]-grids from zinc(II) and 3,6-di(2-pyridyl)pyridazine based ligands. Dalton transactions (Cambridge, England : 2003), 2014, 43, 12606-12613 |
| 7702015 | CIF | C46 H80 Dy4 N10 O35 P4 | C 1 2/c 1 | 44.8591; 19.1273; 23.9486 90; 91.09; 90 | 20545 | Zangana, Karzan H.; Pineda, Eufemio Moreno; Winpenny, Richard E. P. Tetrametallic lanthanide(III) phosphonate cages: synthetic, structural and magnetic studies. Dalton transactions (Cambridge, England : 2003), 2014, 43, 17101-17107 |
| 7702016 | CIF | C46 H80 Er4 N10 O35 P4 | C 1 2/c 1 | 44.7348; 19.1138; 23.8851 90; 91.3155; 90 | 20417.6 | Zangana, Karzan H.; Pineda, Eufemio Moreno; Winpenny, Richard E. P. Tetrametallic lanthanide(III) phosphonate cages: synthetic, structural and magnetic studies. Dalton transactions (Cambridge, England : 2003), 2014, 43, 17101-17107 |
| 7702017 | CIF | C51 H85 Gd4 N11 O35 P4 | C 1 2/c 1 | 44.8769; 19.0562; 24.0257 90; 91.0776; 90 | 20542.7 | Zangana, Karzan H.; Pineda, Eufemio Moreno; Winpenny, Richard E. P. Tetrametallic lanthanide(III) phosphonate cages: synthetic, structural and magnetic studies. Dalton transactions (Cambridge, England : 2003), 2014, 43, 17101-17107 |
| 7702018 | CIF | C46 H80 Ho4 N10 O35 P4 | C 1 2/c 1 | 44.7075; 19.097; 23.9771 90; 91.2548; 90 | 20466.2 | Zangana, Karzan H.; Pineda, Eufemio Moreno; Winpenny, Richard E. P. Tetrametallic lanthanide(III) phosphonate cages: synthetic, structural and magnetic studies. Dalton transactions (Cambridge, England : 2003), 2014, 43, 17101-17107 |
| 7702019 | CIF | C51 H85 N11 O35 P4 Tb4 | C 1 2/c 1 | 44.8792; 19.1254; 24.0145 90; 91.0749; 90 | 20608.8 | Zangana, Karzan H.; Pineda, Eufemio Moreno; Winpenny, Richard E. P. Tetrametallic lanthanide(III) phosphonate cages: synthetic, structural and magnetic studies. Dalton transactions (Cambridge, England : 2003), 2014, 43, 17101-17107 |
| 7702279 | CIF | C2 H18 B3 S Y | P 1 21/c 1 | 5.52621; 22.3255; 8.0616 90; 100.408; 90 | 978.24 | Ley, Morten B.; Paskevicius, Mark; Schouwink, Pascal; Richter, Bo; Sheppard, Drew A.; Buckley, Craig E.; Jensen, Torben R. Novel solvates M(BH₄)₃S(CH₃)₂ and properties of halide-free M(BH₄)₃ (M = Y or Gd). Dalton transactions (Cambridge, England : 2003), 2014, 43, 13333-13342 |
| 8000197 | CIF | C144 H162 Ag6.66 Au18.34 S18 | P -1 | 16.191; 17.244; 18.613 105.871; 106.252; 90.74 | 4776 | Kumara, Chanaka; Aikens, Christine M.; Dass, Amala X-ray Crystal Structure and Theoretical Analysis of Au25‒xAgx(SCH2CH2Ph)18‒Alloy The Journal of Physical Chemistry Letters, 2014, 5, 461 |
| 8000198 | CIF | C14 H12.8 N4 O1.4 | P 1 21/c 1 | 8.761; 16.167; 9.689 90; 108.314; 90 | 1302.8 | Fang, Xinxiu; Wang, Yan; Wang, Dan; Zhao, Guiyan; Zhang, Wenwen; Ren, Aimin; Wang, Haiyu; Xu, Jingwei; Gao, Bing-Rong; Yang, Wei Synthesized Blue Fluorescent Protein Analogue with Tunable Colors from Excited-State Intramolecular Proton Transfer through an N‒H···N Hydrogen Bond The Journal of Physical Chemistry Letters, 2014, 5, 92 |
| 8000199 | CIF | C14 H12 N4 O | P -1 | 7.5326; 9.6002; 10.1649 99.619; 109.189; 109.599 | 621.42 | Fang, Xinxiu; Wang, Yan; Wang, Dan; Zhao, Guiyan; Zhang, Wenwen; Ren, Aimin; Wang, Haiyu; Xu, Jingwei; Gao, Bing-Rong; Yang, Wei Synthesized Blue Fluorescent Protein Analogue with Tunable Colors from Excited-State Intramolecular Proton Transfer through an N‒H···N Hydrogen Bond The Journal of Physical Chemistry Letters, 2014, 5, 92 |
| 8000200 | CIF | C14 H3 F7 O2 | P 21 21 21 | 4.4782; 11.8813; 21.849 90; 90; 90 | 1162.5 | Peng, Yu; Ye, Huanqing; Li, Zhe; Motevalli, Majid; Hernández, Ignacio; Gillin, William P.; Wyatt, Peter B. Visible-Range Sensitization of Er3±Based Infrared Emission from Perfluorinated 2-Acylphenoxide Complexes The Journal of Physical Chemistry Letters, 2014, 5, 1560 |
| 8000201 | CIF | C44 Cs Er F52 O8 | P n n a | 26.1476; 14.1409; 14.6773 90; 90; 90 | 5426.9 | Peng, Yu; Ye, Huanqing; Li, Zhe; Motevalli, Majid; Hernández, Ignacio; Gillin, William P.; Wyatt, Peter B. Visible-Range Sensitization of Er3±Based Infrared Emission from Perfluorinated 2-Acylphenoxide Complexes The Journal of Physical Chemistry Letters, 2014, 5, 1560 |
| 8000202 | CIF | C58 H14 Cs Er F28 O8 | C 1 2/c 1 | 26.905; 8.464; 24.2743 90; 107.21; 90 | 5280.3 | Peng, Yu; Ye, Huanqing; Li, Zhe; Motevalli, Majid; Hernández, Ignacio; Gillin, William P.; Wyatt, Peter B. Visible-Range Sensitization of Er3±Based Infrared Emission from Perfluorinated 2-Acylphenoxide Complexes The Journal of Physical Chemistry Letters, 2014, 5, 1560 |
| 8000203 | CIF | C56 Cs Er F28 O12 | P -1 | 13.2677; 14.96; 15.5993 99.293; 101.038; 115.265 | 2643.1 | Peng, Yu; Ye, Huanqing; Li, Zhe; Motevalli, Majid; Hernández, Ignacio; Gillin, William P.; Wyatt, Peter B. Visible-Range Sensitization of Er3±Based Infrared Emission from Perfluorinated 2-Acylphenoxide Complexes The Journal of Physical Chemistry Letters, 2014, 5, 1560 |
| 8000206 | CIF | C46 H54 O2 S4 | P -1 | 5.8691; 14.2212; 14.2606 113.921; 100.286; 93.039 | 1060.1 | Nicolini, Tommaso; Famulari, Antonino; Gatti, Teresa; Martí-Rujas, Javier; Villafiorita-Monteleone, Francesca; Canesi, Eleonora V.; Meinardi, Francesco; Botta, Chiara; Parisini, Emilio; Meille, Stefano Valdo; Bertarelli, Chiara Structure‒Photoluminescence Correlation for Two Crystalline Polymorphs of a Thiophene‒Phenylene Co-Oligomer with Bulky Terminal Substituents The Journal of Physical Chemistry Letters, 2014, 5, 2171 |
| 8000207 | CIF | C23 H27 O S2 | P -1 | 10.0773; 12.626; 17.705 82.176; 77.112; 76.89 | 2130 | Nicolini, Tommaso; Famulari, Antonino; Gatti, Teresa; Martí-Rujas, Javier; Villafiorita-Monteleone, Francesca; Canesi, Eleonora V.; Meinardi, Francesco; Botta, Chiara; Parisini, Emilio; Meille, Stefano Valdo; Bertarelli, Chiara Structure‒Photoluminescence Correlation for Two Crystalline Polymorphs of a Thiophene‒Phenylene Co-Oligomer with Bulky Terminal Substituents The Journal of Physical Chemistry Letters, 2014, 5, 2171 |
| 8000208 | CIF | C32 H36 N2 | P -1 | 6.202; 8.602; 12.334 83.36; 79.79; 73.78 | 620.3 | Chen, Jinlong; Ma, Suqian; Zhang, Jibo; Wang, Lijuan; Ye, Ling; Li, Bao; Xu, Bin; Tian, Wenjing Proton-Triggered Hypsochromic Luminescence in 1,1′-(2,5-Distyryl-1,4-phenylene) Dipiperidine The Journal of Physical Chemistry Letters, 2014, 5, 2781 |
| 8000258 | CIF | C17 H17 N3 O | P -1 | 4.8686; 15.1351; 19.0283 94.372; 93.841; 93.639 | 1391.6 | Garrett C. Moraski; Allen G. Oliver; Lowell D. Markley; Sanghyun Cho; Scott G. Franzblau; Marvin J. Miller Scaffold-switching: An exploration of 5,6-fused bicyclic heteroaromatics systems to afford antituberculosis activity akin to the imidazo[1,2-a]pyridine-3-carboxylates Bioorganic & Medicinal Chemistry Letters, 2014, 24, 3493-3498 |
| 8000259 | CIF | C16 H16 N4 O | P 1 21/m 1 | 9.3005; 6.6121; 11.8267 90; 106.276; 90 | 698.14 | Garrett C. Moraski; Allen G. Oliver; Lowell D. Markley; Sanghyun Cho; Scott G. Franzblau; Marvin J. Miller Scaffold-switching: An exploration of 5,6-fused bicyclic heteroaromatics systems to afford antituberculosis activity akin to the imidazo[1,2-a]pyridine-3-carboxylates Bioorganic & Medicinal Chemistry Letters, 2014, 24, 3493-3498 |
| 8000260 | CIF | C18 H18 N2 O | P 1 21/c 1 | 4.783; 25.5753; 11.9469 90; 98.639; 90 | 1444.84 | Garrett C. Moraski; Allen G. Oliver; Lowell D. Markley; Sanghyun Cho; Scott G. Franzblau; Marvin J. Miller Scaffold-switching: An exploration of 5,6-fused bicyclic heteroaromatics systems to afford antituberculosis activity akin to the imidazo[1,2-a]pyridine-3-carboxylates Bioorganic & Medicinal Chemistry Letters, 2014, 24, 3493-3498 |
| 8000261 | CIF | C16 H15 N3 O | P -1 | 5.9164; 13.074; 18.5711 109.499; 93.229; 94.402 | 1344.97 | Garrett C. Moraski; Allen G. Oliver; Lowell D. Markley; Sanghyun Cho; Scott G. Franzblau; Marvin J. Miller Scaffold-switching: An exploration of 5,6-fused bicyclic heteroaromatics systems to afford antituberculosis activity akin to the imidazo[1,2-a]pyridine-3-carboxylates Bioorganic & Medicinal Chemistry Letters, 2014, 24, 3493-3498 |
| 8000262 | CIF | C15 H14 N4 O | P 1 21/n 1 | 9.772; 5.8461; 22.078 90; 91.411; 90 | 1260.9 | Garrett C. Moraski; Allen G. Oliver; Lowell D. Markley; Sanghyun Cho; Scott G. Franzblau; Marvin J. Miller Scaffold-switching: An exploration of 5,6-fused bicyclic heteroaromatics systems to afford antituberculosis activity akin to the imidazo[1,2-a]pyridine-3-carboxylates Bioorganic & Medicinal Chemistry Letters, 2014, 24, 3493-3498 |
| 8000263 | CIF | C15 H15 N5 O | C 1 2/c 1 | 20.3189; 10.8268; 15.6023 90; 129.107; 90 | 2663.4 | Garrett C. Moraski; Allen G. Oliver; Lowell D. Markley; Sanghyun Cho; Scott G. Franzblau; Marvin J. Miller Scaffold-switching: An exploration of 5,6-fused bicyclic heteroaromatics systems to afford antituberculosis activity akin to the imidazo[1,2-a]pyridine-3-carboxylates Bioorganic & Medicinal Chemistry Letters, 2014, 24, 3493-3498 |
| 8000264 | CIF | C17 H17 N3 O | P 1 21/c 1 | 7.9379; 19.6844; 9.5568 90; 100.934; 90 | 1466.17 | Garrett C. Moraski; Allen G. Oliver; Lowell D. Markley; Sanghyun Cho; Scott G. Franzblau; Marvin J. Miller Scaffold-switching: An exploration of 5,6-fused bicyclic heteroaromatics systems to afford antituberculosis activity akin to the imidazo[1,2-a]pyridine-3-carboxylates Bioorganic & Medicinal Chemistry Letters, 2014, 24, 3493-3498 |
| 9016974 | CIF | C2 H4.27 Ca O6.135 | I 4/m | 12.3363; 12.3363; 7.3448 90; 90; 90 | 1117.76 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 1 American Mineralogist, 2014, 99, 2-7 |
| 9016975 | CIF | C2 H4.4 Ca O6.2 | I 4/m | 12.3543; 12.3543; 7.3547 90; 90; 90 | 1122.54 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 2 American Mineralogist, 2014, 99, 2-7 |
| 9016976 | CIF | C2 H4.38 Ca O6.19 | I 4/m | 12.3462; 12.3462; 7.3535 90; 90; 90 | 1120.88 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 3 American Mineralogist, 2014, 99, 2-7 |
| 9016977 | CIF | C2 H4.39 Ca O6.195 | I 4/m | 12.353; 12.353; 7.3594 90; 90; 90 | 1123.02 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 4 American Mineralogist, 2014, 99, 2-7 |
| 9016978 | CIF | C2 H4.4 Ca O6.2 | I 4/m | 12.3528; 12.3528; 7.3569 90; 90; 90 | 1122.6 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 5 American Mineralogist, 2014, 99, 2-7 |
| 9016979 | CIF | C2 H4.39 Ca O6.195 | I 4/m | 12.3542; 12.3542; 7.3604 90; 90; 90 | 1123.39 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 6 American Mineralogist, 2014, 99, 2-7 |
| 9016980 | CIF | C2 H4.47 Ca O6.235 | I 4/m | 12.3565; 12.3565; 7.3592 90; 90; 90 | 1123.62 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 7 American Mineralogist, 2014, 99, 2-7 |
| 9016981 | CIF | C2 H4.43 Ca O6.215 | I 4/m | 12.3443; 12.3443; 7.3599 90; 90; 90 | 1121.51 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 8 American Mineralogist, 2014, 99, 2-7 |
| 9016982 | CIF | C2 H4.46 Ca O6.23 | I 4/m | 12.3573; 12.3573; 7.3587 90; 90; 90 | 1123.69 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 9 American Mineralogist, 2014, 99, 2-7 |
| 9016983 | CIF | C2 H4.39 Ca O6.195 | I 4/m | 12.3558; 12.3558; 7.3601 90; 90; 90 | 1123.64 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 10 American Mineralogist, 2014, 99, 2-7 |
| 9016984 | CIF | C2 H4.52 Ca O6.26 | I 4/m | 12.3576; 12.3576; 7.3578 90; 90; 90 | 1123.61 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 11 American Mineralogist, 2014, 99, 2-7 |
| 9016985 | CIF | C2 H4.51 Ca O6.255 | I 4/m | 12.3567; 12.3567; 7.3573 90; 90; 90 | 1123.37 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 12 American Mineralogist, 2014, 99, 2-7 |
| 9016986 | CIF | C2 H4.52 Ca O6.26 | I 4/m | 12.3622; 12.3622; 7.3603 90; 90; 90 | 1124.83 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 13 American Mineralogist, 2014, 99, 2-7 |
| 9016987 | CIF | C2 H4.54 Ca O6.27 | I 4/m | 12.363; 12.363; 7.346 90; 90; 90 | 1122.79 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 14 American Mineralogist, 2014, 99, 2-7 |
| 9016988 | CIF | C2 H4.55 Ca O6.275 | I 4/m | 12.362; 12.362; 7.3574 90; 90; 90 | 1124.35 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 15 American Mineralogist, 2014, 99, 2-7 |
| 9016989 | CIF | C2 H4.58 Ca O6.29 | I 4/m | 12.3627; 12.3627; 7.3574 90; 90; 90 | 1124.48 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 16 American Mineralogist, 2014, 99, 2-7 |
| 9016990 | CIF | C2 H4.69 Ca O6.345 | I 4/m | 12.3783; 12.3783; 7.3659 90; 90; 90 | 1128.62 | Izatulina, A.; Gurzhiy, V.; Frank-Kamenetskaya O Weddellite from renal stones: Structure refinement and dependence of crystal chemical features on H2O content. Note: Sample 17 American Mineralogist, 2014, 99, 2-7 |
| 9016991 | CIF | Mg2 O4 Si | P b n m | 4.5232; 9.274; 5.5467 90; 90; 90 | 232.674 | Finkelstein, G. J.; Dera, P. K.; Jahn, S.; Oganov, A. R.; Holl, C. M.; Meng, Y.; Duffy, T. S. Phase transitions and equation of state of forsterite to 90 GPa from single-crystal X-ray diffraction and molecular modeling Note: P = 45.3 GPa American Mineralogist, 2014, 99, 35-43 |
| 9016992 | CIF | Mg2 O4 Si | P 1 | 4.695; 9.201; 5.311 93.1; 107.264; 98.133 | 215.766 | Finkelstein, G. J.; Dera, P. K.; Jahn, S.; Oganov, A. R.; Holl, C. M.; Meng, Y.; Duffy, T. S. Phase transitions and equation of state of forsterite to 90 GPa from single-crystal X-ray diffraction and molecular modeling Note: P = 52.4 GPa American Mineralogist, 2014, 99, 35-43 |
| 9016993 | CIF | Mg2 O4 Si | C m c 21 | 2.64; 8.596; 9.04 90; 90; 90 | 205.149 | Finkelstein, G. J.; Dera, P. K.; Jahn, S.; Oganov, A. R.; Holl, C. M.; Meng, Y.; Duffy, T. S. Phase transitions and equation of state of forsterite to 90 GPa from single-crystal X-ray diffraction and molecular modeling Note: P = 58.2 GPa American Mineralogist, 2014, 99, 35-43 |
| 9016994 | CIF | Mg2 O4 Si | C m c 21 | 2.591; 8.726; 8.794 90; 90; 90 | 198.824 | Finkelstein, G. J.; Dera, P. K.; Jahn, S.; Oganov, A. R.; Holl, C. M.; Meng, Y.; Duffy, T. S. Phase transitions and equation of state of forsterite to 90 GPa from single-crystal X-ray diffraction and molecular modeling Note: DFT Optimized Note: P = 58.2 GPa American Mineralogist, 2014, 99, 35-43 |
| 9016995 | CIF | Al3.544 Ca1.303 Ce2.697 Fe0.456 H2 O22 Si5 | P 1 21/m 1 | 8.9277; 5.6548; 17.587 90; 116.475; 90 | 794.757 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST4_11 American Mineralogist, 2014, 99, 157-169 |
| 9016996 | CIF | Al3.433 Ca1.225 Ce2.775 Fe0.567 H2 O22 Si5 | P 1 21/m 1 | 8.931; 5.6574; 17.6 90; 116.517; 90 | 795.713 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST4_09 American Mineralogist, 2014, 99, 157-169 |
| 9016997 | CIF | Al3.476 Ca1.211 Ce2.789 Fe0.524 H2 O22 Si5 | P 1 21/m 1 | 8.9205; 5.6573; 17.5715 90; 116.5; 90 | 793.594 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST3_01 American Mineralogist, 2014, 99, 157-169 |
| 9016998 | CIF | Al3.395 Ca1.21 Ce2.79 Fe0.605 H2 O22 Si5 | P 1 21/m 1 | 8.9546; 5.6675; 17.652 90; 116.677; 90 | 800.482 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: NE_01 American Mineralogist, 2014, 99, 157-169 |
| 9016999 | CIF | Al3.418 Ca1.146 Ce2.854 Fe0.582 H2 O22 Si5 | P 1 21/m 1 | 8.9222; 5.665; 17.569 90; 116.47; 90 | 794.92 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST4_10 American Mineralogist, 2014, 99, 157-169 |
| 9017000 | CIF | Al3.374 Ca1.108 Ce2.892 Fe0.626 H2 O22 Si5 | P 1 21/m 1 | 8.9165; 5.6754; 17.5253 90; 116.321; 90 | 794.916 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST4_02 American Mineralogist, 2014, 99, 157-169 |
| 9017001 | CIF | Al3.283 Ca1.119 Ce2.881 Fe0.717 H2 O22 Si5 | P 1 21/m 1 | 8.9327; 5.6817; 17.5807 90; 116.465; 90 | 798.768 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_01 American Mineralogist, 2014, 99, 157-169 |
| 9017002 | CIF | Al3.23 Ca1.11 Ce2.89 Fe0.77 H2 O22 Si5 | P 1 21/m 1 | 8.9313; 5.6608; 17.549 90; 116.396; 90 | 794.746 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_03 American Mineralogist, 2014, 99, 157-169 |
| 9017003 | CIF | Al3.221 Ca1.072 Ce2.928 Fe0.779 H2 O22 Si5 | P 1 21/m 1 | 8.911; 5.6866; 17.5252 90; 116.3; 90 | 796.133 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: HU_02 American Mineralogist, 2014, 99, 157-169 |
| 9017004 | CIF | Al3.197 Ca1.079 Ce2.921 Fe0.803 H2 O22 Si5 | P 1 21/m 1 | 8.8996; 5.6759; 17.5154 90; 116.221; 90 | 793.715 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_04 American Mineralogist, 2014, 99, 157-169 |
| 9017005 | CIF | Al3.15 Ca1.092 Ce2.908 Fe0.85 H2 O22 Si5 | P 1 21/m 1 | 8.895; 5.6827; 17.5044 90; 116.24; 90 | 793.626 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: HU_01 American Mineralogist, 2014, 99, 157-169 |
| 9017006 | CIF | Al3.252 Ca1.105 Ce2.895 Fe0.748 H2 O22 Si5 | P 1 21/m 1 | 8.9039; 5.6785; 17.5039 90; 116.301; 90 | 793.394 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_02 American Mineralogist, 2014, 99, 157-169 |
| 9017007 | CIF | Al3.273 Ca1.115 Ce2.885 Fe0.727 H2 O22 Si5 | P 1 21/m 1 | 8.9044; 5.665; 17.5261 90; 116.399; 90 | 791.885 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_02-350, annealed for 48 hours at 350 C American Mineralogist, 2014, 99, 157-169 |
| 9017008 | CIF | Al3.229 Ca1.098 Ce2.902 Fe0.771 H2 O22 Si5 | P 1 21/m 1 | 8.9002; 5.6304; 17.7324 90; 116.71; 90 | 793.781 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_02-450, annealed for 48 hours at 450 C American Mineralogist, 2014, 99, 157-169 |
| 9017009 | CIF | Al3.233 Ca1.11 Ce2.89 Fe0.767 H2 O22 Si5 | P 1 21/m 1 | 8.9031; 5.629; 17.7392 90; 116.752; 90 | 793.853 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_02-550, annealed for 48 hours at 550 C American Mineralogist, 2014, 99, 157-169 |
| 9017010 | CIF | Al3.234 Ca1.098 Ce2.902 Fe0.766 H2 O22 Si5 | P 1 21/m 1 | 8.8979; 5.6235; 17.731 90; 116.815; 90 | 791.808 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_02-650, annealed for 48 hours at 650 C American Mineralogist, 2014, 99, 157-169 |
| 9017011 | CIF | Al3.232 Ca1.091 Ce2.909 Fe0.768 H2 O22 Si5 | P 1 21/m 1 | 8.8936; 5.6189; 17.755 90; 116.952; 90 | 790.889 | Bonazzi, P.; Lepore, G. O.; Bindi, L.; Chopin, C.; Husdal, T. A.; Medenbach, O. Perboeite-(Ce) and alnaperboeite-(Ce), two new members of the epidote-tornebohmite polysomatic series: Chemistry, structure, dehydrogenation, and clue for a sodian epidote end-member Sample ID: ST2_02-750, annealed for 48 hours at 750 C American Mineralogist, 2014, 99, 157-169 |
| 9017012 | CIF | O2 Pb | P n a m | 5.493; 6.52; 3.453 90; 90; 90 | 123.667 | Grocholski, B.; Shim, S. H.; Cottrell, E.; Prakapenka, V. B. Crystal structure and compressibility of lead dioxide up to 140 GPa Note: P = 23.5 GPa American Mineralogist, 2014, 99, 170-177 |
| 9017013 | CIF | O2 Pb | P n a m | 5.464; 6.468; 3.415 90; 90; 90 | 120.69 | Grocholski, B.; Shim, S. H.; Cottrell, E.; Prakapenka, V. B. Crystal structure and compressibility of lead dioxide up to 140 GPa Note: P = 29.0 GPa American Mineralogist, 2014, 99, 170-177 |
| 9017014 | CIF | O2 Pb | P n a m | 5.426; 6.389; 3.362 90; 90; 90 | 116.549 | Grocholski, B.; Shim, S. H.; Cottrell, E.; Prakapenka, V. B. Crystal structure and compressibility of lead dioxide up to 140 GPa Note: P = 39.0 GPa American Mineralogist, 2014, 99, 170-177 |
| 9017015 | CIF | O2 Pb | P n a m | 5.343; 6.29; 3.295 90; 90; 90 | 110.737 | Grocholski, B.; Shim, S. H.; Cottrell, E.; Prakapenka, V. B. Crystal structure and compressibility of lead dioxide up to 140 GPa Note: P = 62.7 GPa American Mineralogist, 2014, 99, 170-177 |
| 9017016 | CIF | O2 Pb | P n a m | 5.298; 6.239; 3.269 90; 90; 90 | 108.054 | Grocholski, B.; Shim, S. H.; Cottrell, E.; Prakapenka, V. B. Crystal structure and compressibility of lead dioxide up to 140 GPa Note: P = 75.1 GPa American Mineralogist, 2014, 99, 170-177 |
| 9017017 | CIF | O2 Pb | P n a m | 5.246; 6.194; 3.228 90; 90; 90 | 104.89 | Grocholski, B.; Shim, S. H.; Cottrell, E.; Prakapenka, V. B. Crystal structure and compressibility of lead dioxide up to 140 GPa Note: P = 93 GPa American Mineralogist, 2014, 99, 170-177 |
| 9017018 | CIF | O2 Pb | P n a m | 5.215; 6.167; 3.211 90; 90; 90 | 103.269 | Grocholski, B.; Shim, S. H.; Cottrell, E.; Prakapenka, V. B. Crystal structure and compressibility of lead dioxide up to 140 GPa Note: P = 105 GPa American Mineralogist, 2014, 99, 170-177 |
| 9017019 | CIF | O2 Pb | P n a m | 5.128; 6.108; 3.183 90; 90; 90 | 99.697 | Grocholski, B.; Shim, S. H.; Cottrell, E.; Prakapenka, V. B. Crystal structure and compressibility of lead dioxide up to 140 GPa Note: P = 120 GPa American Mineralogist, 2014, 99, 170-177 |
| 9017020 | CIF | O2 Pb | P n a m | 5.083; 6.046; 3.152 90; 90; 90 | 96.867 | Grocholski, B.; Shim, S. H.; Cottrell, E.; Prakapenka, V. B. Crystal structure and compressibility of lead dioxide up to 140 GPa Note: P = 140 GPa American Mineralogist, 2014, 99, 170-177 |
| 9017021 | CIF | He O2 Si | P 1 21/c 1 | 8.062; 4.797; 9.491 90; 120.43; 90 | 316.488 | Matsui, M.; Sato, T.; Funamori, N. Crystal structures and stabilities of cristobalite-helium phases at high pressures Note: P = 10 GPa American Mineralogist, 2014, 99, 184-189 |
| 9017022 | CIF | He O2 Si | R -3 c :R | 9.08; 9.08; 9.08 31.809; 31.809; 31.809 | 184.735 | Matsui, M.; Sato, T.; Funamori, N. Crystal structures and stabilities of cristobalite-helium phases at high pressures Note: P = 4 GPa American Mineralogist, 2014, 99, 184-189 |
| 9017023 | CIF | Al4.14 B3 Ca0.207 Cr0.18 H3 Mg2.4 Na0.793 O31 Si6 V2.253 | R 3 m :H | 16.0273; 16.0273; 7.2833 90; 90; 120 | 1620.24 | Bosi, F.; Skogby, H.; Reznitskii, L.; Halenius, U. Vanadio-oxy-dravite, NaV3(Al4Mg2)(Si6O18)(BO3)3(OH)3O, a new mineral species of the tourmaline supergroup American Mineralogist, 2014, 99, 218-224 |
| 9017024 | CIF | Al0.12 Ca0.55 Ce0.01 Fe1.41 K0.04 La0.02 Mg0.05 Mn0.26 Na2.45 O24 Si8 Sr3.84 Ti0.01 Zn0.16 | P 1 21/c 1 | 5.21381; 7.9143; 26.0888 90; 90.3556; 90 | 1076.5 | Chakhmourdian, A. R.; Cooper, M. A.; Ball, N.; Reguir, E. P.; Medici, L.; Abdu, Y. A.; Antonov, A. A. Vladykinite, Na3Sr4(Fe2+Fe3+)Si8O24: A new complex sheet silicate from peralkaline rocks of the Murun complex, eastern Siberia, Russia American Mineralogist, 2014, 99, 235-241 |
| 9017025 | CIF | Fe2.134 O4 Ti0.866 | F d -3 m :2 | 8.5139; 8.5139; 8.5139 90; 90; 90 | 617.143 | Gatta, G. D.; Bosi, F.; McIntyre, G. J.; Halenius, U. Static positional disorder in ulvospinel: A single-crystal neutron diffraction study. Note:Crystal 1 American Mineralogist, 2014, 99, 255-260 |
| 9017026 | CIF | Fe2.111 O4 Ti0.889 | F d -3 m :2 | 8.5139; 8.5139; 8.5139 90; 90; 90 | 617.143 | Gatta, G. D.; Bosi, F.; McIntyre, G. J.; Halenius, U. Static positional disorder in ulvospinel: A single-crystal neutron diffraction study. Note:Crystal 2 American Mineralogist, 2014, 99, 255-260 |
| 9017027 | CIF | Fe2.134 O4 Ti0.864 | F d -3 m :2 | 8.5139; 8.5139; 8.5139 90; 90; 90 | 617.143 | Gatta, G. D.; Bosi, F.; McIntyre, G. J.; Halenius, U. Static positional disorder in ulvospinel: A single-crystal neutron diffraction study. Note:Refinement with Ti at .49, .49, .49 American Mineralogist, 2014, 99, 255-260 |
| 9017028 | CIF | Al1.94 Fe0.01 Mg0.38 Mn0.15 O4 Zn0.52 | F d -3 m :2 | 8.1123; 8.1123; 8.1123 90; 90; 90 | 533.866 | Halenius, U.; Bosi, F. Color of Mn-bearing gahnite: A first example of electronic transitions in heterovalent exchange coupled IVMn2±VIMn3+ pairs in minerals. American Mineralogist, 2014, 99, 261-266 |
| 9017029 | CIF | Al1.758 Cr0.242 Fe0.242 Mg0.758 O4 | F d -3 m :2 | 8.1334; 8.1334; 8.1334 90; 90; 90 | 538.042 | Lenaz, D.; Youbi, N.; Min, A. D.; Boumehdi, M. A.; Abbou, M. B. Low intra-crystalline closure temperatures of Cr-bearing spinels from the mantle xenoliths of the Middle AtlasNeogene-Quaternary Volcanic Field (Morocco):Mineralogical evidence of a cooler mantle beneath the West African Craton. Note:Sample MAR-BI2 American Mineralogist, 2014, 99, 267-275 |
| 9017030 | CIF | Al1.6 Cr0.4 Fe0.25 Mg0.75 O4 | F d -3 m :2 | 8.1454; 8.1454; 8.1454 90; 90; 90 | 540.427 | Lenaz, D.; Youbi, N.; Min, A. D.; Boumehdi, M. A.; Abbou, M. B. Low intra-crystalline closure temperatures of Cr-bearing spinels from the mantle xenoliths of the Middle AtlasNeogene-Quaternary Volcanic Field (Morocco):Mineralogical evidence of a cooler mantle beneath the West African Craton. Note:Sample MAR-BI4 American Mineralogist, 2014, 99, 267-275 |
| 9017031 | CIF | Al1.206 Cr0.794 Fe0.287 Mg0.714 O4 | F d -3 m :2 | 8.2021; 8.2021; 8.2021 90; 90; 90 | 551.792 | Lenaz, D.; Youbi, N.; Min, A. D.; Boumehdi, M. A.; Abbou, M. B. Low intra-crystalline closure temperatures of Cr-bearing spinels from the mantle xenoliths of the Middle AtlasNeogene-Quaternary Volcanic Field (Morocco):Mineralogical evidence of a cooler mantle beneath the West African Craton. Note:Sample MAR-BI16 American Mineralogist, 2014, 99, 267-275 |
| 9017032 | CIF | Al1.38 Cr0.62 Fe0.306 Mg0.694 O4 | F d -3 m :2 | 8.1727; 8.1727; 8.1727 90; 90; 90 | 545.879 | Lenaz, D.; Youbi, N.; Min, A. D.; Boumehdi, M. A.; Abbou, M. B. Low intra-crystalline closure temperatures of Cr-bearing spinels from the mantle xenoliths of the Middle AtlasNeogene-Quaternary Volcanic Field (Morocco):Mineralogical evidence of a cooler mantle beneath the West African Craton. Note:Sample MAR-BI24 American Mineralogist, 2014, 99, 267-275 |
| 9017033 | CIF | Al1.718 Cr0.282 Fe0.24 Mg0.76 O4 | F d -3 m :2 | 8.1339; 8.1339; 8.1339 90; 90; 90 | 538.142 | Lenaz, D.; Youbi, N.; Min, A. D.; Boumehdi, M. A.; Abbou, M. B. Low intra-crystalline closure temperatures of Cr-bearing spinels from the mantle xenoliths of the Middle AtlasNeogene-Quaternary Volcanic Field (Morocco): Mineralogical evidence of a cooler mantle beneath the West African Craton. Note:Sample MAR-TF6 American Mineralogist, 2014, 99, 267-275 |
| 9017034 | CIF | Al1.76 Cr0.24 Fe0.236 Mg0.764 O4 | F d -3 m :2 | 8.1351; 8.1351; 8.1351 90; 90; 90 | 538.38 | Lenaz, D.; Youbi, N.; Min, A. D.; Boumehdi, M. A.; Abbou, M. B. Low intra-crystalline closure temperatures of Cr-bearing spinels from the mantle xenoliths of the Middle AtlasNeogene-Quaternary Volcanic Field (Morocco):Mineralogical evidence of a cooler mantle beneath the West African Craton. Note:Sample MAR-TF7 American Mineralogist, 2014, 99, 267-275 |
| 9017035 | CIF | Al1.42 Cr0.58 Fe0.3 Mg0.7 O4 | F d -3 m :2 | 8.1704; 8.1704; 8.1704 90; 90; 90 | 545.419 | Lenaz, D.; Youbi, N.; Min, A. D.; Boumehdi, M. A.; Abbou, M. B. Low intra-crystalline closure temperatures of Cr-bearing spinels from the mantle xenoliths of the Middle AtlasNeogene-Quaternary Volcanic Field (Morocco):Mineralogical evidence of a cooler mantle beneath the West African Craton. Note:Sample MAR-TF8 American Mineralogist, 2014, 99, 267-275 |
| 9017036 | CIF | Al1.6 Cr0.4 Fe0.268 Mg0.732 O4 | F d -3 m :2 | 8.1391; 8.1391; 8.1391 90; 90; 90 | 539.174 | Lenaz, D.; Youbi, N.; Min, A. D.; Boumehdi, M. A.; Abbou, M. B. Low intra-crystalline closure temperatures of Cr-bearing spinels from the mantle xenoliths of the Middle AtlasNeogene-Quaternary Volcanic Field (Morocco):Mineralogical evidence of a cooler mantle beneath the West African Craton. Note:Sample MAR-TF21 American Mineralogist, 2014, 99, 267-275 |
| 9017037 | CIF | Al1.612 Cr0.388 Fe0.234 Mg0.766 O4 | F d -3 m :2 | 8.1499; 8.1499; 8.1499 90; 90; 90 | 541.323 | Lenaz, D.; Youbi, N.; Min, A. D.; Boumehdi, M. A.; Abbou, M. B. Low intra-crystalline closure temperatures of Cr-bearing spinels from the mantle xenoliths of the Middle AtlasNeogene-Quaternary Volcanic Field (Morocco):Mineralogical evidence of a cooler mantle beneath the West African Craton. Note:Sample MAR-TF28 American Mineralogist, 2014, 99, 267-275 |
| 9017038 | CIF | C H O4.926 Pb0.926 U0.5 | P m m n :1 | 4.977; 9.3869; 8.9597 90; 90; 90 | 418.585 | Plasil, J.; Palatinus, L.; Rohlicek, J.; Houdkovaq, L.; Klementova, M.; Golias, V.; Skacha, P. Crystal structure of lead uranyl carbonate mineral widenmannite: Precession electron-diffraction and synchrotron powder-diffraction study Note: data collected at synchrotron American Mineralogist, 2014, 99, 276-282 |
| 9017039 | CIF | C H O4.824 Pb0.824 U0.5 | P m m n :1 | 4.977; 9.3869; 8.9597 90; 90; 90 | 418.585 | Plasil, J.; Palatinus, L.; Rohlicek, J.; Houdkovaq, L.; Klementova, M.; Golias, V.; Skacha, P. Crystal structure of lead uranyl carbonate mineral widenmannite: Precession electron-diffraction and synchrotron powder-diffraction study Note: data collected by electron diffraction American Mineralogist, 2014, 99, 276-282 |
| 9017040 | CIF | Ca5 Cl0.332 F0.773 O12 P3 | P 63/m | 9.5104; 9.5104; 6.8311 90; 90; 120 | 535.08 | Hughes, J. M.; Nekvasil, H.; Ustunisik, G.; Lindsley, D. H.; Coraor, A. E.; Vaughn, J.; Phillips, B. L.; McCubbin, F. M.; Woerner, W. R. Solid solution in the fluorapatite-chlorapatite binary system: High-precision crystal structure refinements of synthetic F-Cl apatite. Note: Sample HNF5CL5 American Mineralogist, 2014, 99, 369-376 |
| 9017041 | CIF | Ca5 Cl0.343 F0.766 O12 P3 | P 63/m | 9.5101; 9.5101; 6.83 90; 90; 120 | 534.96 | Hughes, J. M.; Nekvasil, H.; Ustunisik, G.; Lindsley, D. H.; Coraor, A. E.; Vaughn, J.; Phillips, B. L.; McCubbin, F. M.; Woerner, W. R. Solid solution in the fluorapatite-chlorapatite binary system: High-precision crystal structure refinements of synthetic F-Cl apatite. Note: Sample HNF5CL5-8 American Mineralogist, 2014, 99, 369-376 |
| 9017042 | CIF | Ca5 Cl0.336 F0.764 O12 P3 | P 63/m | 9.51; 9.51; 6.8289 90; 90; 120 | 534.863 | Hughes, J. M.; Nekvasil, H.; Ustunisik, G.; Lindsley, D. H.; Coraor, A. E.; Vaughn, J.; Phillips, B. L.; McCubbin, F. M.; Woerner, W. R. Solid solution in the fluorapatite-chlorapatite binary system: High-precision crystal structure refinements of synthetic F-Cl apatite. Note: Sample HNF5CL5-9 American Mineralogist, 2014, 99, 369-376 |
| 9017043 | CIF | Ca5 Cl0.332 F0.763 O12 P3 | P 63/m | 9.5084; 9.5084; 6.8293 90; 90; 120 | 534.714 | Hughes, J. M.; Nekvasil, H.; Ustunisik, G.; Lindsley, D. H.; Coraor, A. E.; Vaughn, J.; Phillips, B. L.; McCubbin, F. M.; Woerner, W. R. Solid solution in the fluorapatite-chlorapatite binary system: High-precision crystal structure refinements of synthetic F-Cl apatite. Note: HNF5CL5-10 American Mineralogist, 2014, 99, 369-376 |
| 9017044 | CIF | Ba0.01 Be2 Ca0.05 O8 P2 Sr0.87 | P 1 21/c 1 | 7.997; 8.979; 8.42 90; 90.18; 90 | 604.596 | Rao, C.; Wang, R.; Hatert, F.; Gu, X.; Ottolini, L.; Hu, H.; Dong, C.; Bo, F. D.; Baijot, M. Strontiohurlbutite, SrBe2(PO4)2, a new mineral from Nanping No. 31 pegmatite, Fujian Province, Southeastern China American Mineralogist, 2014, 99, 494-499 |
| 9017045 | CIF | Cu6.55 H4 K Li Mg0.45 O26 Si8 | P c n b | 19.046; 20.377; 5.2497 90; 90; 90 | 2037.41 | Yang, H.; Downs, R. T.; Evans, S. H.; Pinch, W. W. Lavinskyite, K(LiCu)Cu6(Si4O11)2(OH)4, isotypic with plancheite, a new mineral from the Wessels mine, Kalahari Manganese Fields, South Africa American Mineralogist, 2014, 99, 525-530 |
| 9017046 | CIF | H8 K4.916 O33 S4.04 U4 V0.87 | P 4/n :1 | 14.9704; 14.9704; 6.817 90; 90; 90 | 1527.78 | Plasil, J.; Veselovsky, F.; Hlousek, J.; Skoda, R.; Novak, M.; Sejkora, J.; Cejka, J.; Skacha, P.; Kasatkin, A. V. Mathesiusite, K5(UO2)4(SO4)4(VO5)(H2O)4, a new uranyl vanadate-sulfate from Jachymov, Czech Republic American Mineralogist, 2014, 99, 625-632 |
| 9017047 | CIF | B1.1 N0.9 | F -4 3 m | 3.61; 3.61; 3.61 90; 90; 90 | 47.046 | Dobrzhinetskaya, L. F.; Wirth, R.; Yang, J.; Green, H. W.; Hutcheon, I. D.; Weber, P. K.; Grew, E. S. Qingsongite, natural cubic boron nitride: The first boron mineral from the Earth's mantle American Mineralogist, 2014, 99, 764-772 |
| 9017048 | CIF | Al2.97 As0.03 Ca0.13 F1.68 Fe0.03 H6.32 Na0.87 O12.32 P1.97 | P 41 21 2 | 7.077; 7.077; 19.227 90; 90; 90 | 962.964 | Kampf, A. R.; Adams, P. M.; Housley, R. M.; Rossman, G. R. Fluorowardite, NaAl3(PO4)2(OH)2F2*2H2O, the fluorine analog of wardite from the Silver Coin mine, Valmy, Nevada American Mineralogist, 2014, 99, 804-810 |
| 9017049 | CIF | Fe1.32 H6 Mn1.68 O11 P2 | P b n a | 9.48871; 10.11494; 8.70624 90; 90; 90 | 835.605 | Chukanov, N. V.; Scholz, R.; Zubkova, N. V.; Pekov, I. V.; Belakovskiy, D. I.; Van, K. V.; Lagoeiro, L.; Graca, L. M.; Krambrock, K.; de Oliveire, L. C. A.; Menezes, L. A. D.; Chaves, M. L. S. C.; Pushcharovsky, D. Y. Correianevesite, Fe2+Mn2+2(PO4)2*3H2O, a new reddingite-group mineral from the Cigana mine, Conselheiro Pena, Minas Gerais, Brazil American Mineralogist, 2014, 99, 811-816 |
| 9017050 | CIF | O57 Pb21 Si18 | P 63/m | 9.9244; 9.9244; 34.2357 90; 90; 120 | 2920.24 | Siidra, O. I.; Zenko, D. S.; Krivovichev, S. V. Structural complexity of lead silicates: Crystal structure of Pb21[Si7O22]2[Si4O13] and its comparison to hyttsjoite American Mineralogist, 2014, 99, 817-823 |
| 9017051 | CIF | F3 Mg Na | P b n m | 5.32517; 5.47795; 7.62732 90; 90; 90 | 222.497 | Knight, K. S. A high-resolution powder neutron diffraction study of the crystal structure of neighborite (NaMgF3) between 9 and 440 K Note: T = 9 K American Mineralogist, 2014, 99, 824-838 |
| 9017052 | CIF | Fe1.929 Mg0.135 O4 Ti0.94 | F d -3 m :2 | 8.5271; 8.5271; 8.5271 90; 90; 90 | 620.018 | Bosi, F.; Halenius, U.; Skogby, H. Crystal chemistry of the ulvospinel-qandilite series. Note: sample T1 American Mineralogist, 2014, 99, 847-851 |
| 9017053 | CIF | Fe1.768 Mg0.29 O4 Ti0.94 | F d -3 m :2 | 8.5184; 8.5184; 8.5184 90; 90; 90 | 618.122 | Bosi, F.; Halenius, U.; Skogby, H. Crystal chemistry of the ulvospinel-qandilite series. Note: sample T2 American Mineralogist, 2014, 99, 847-851 |
| 9017054 | CIF | Fe1.511 Mg0.531 O4 Ti0.96 | F d -3 m :2 | 8.5104; 8.5104; 8.5104 90; 90; 90 | 616.382 | Bosi, F.; Halenius, U.; Skogby, H. Crystal chemistry of the ulvospinel-qandilite series. Note: sample T3 American Mineralogist, 2014, 99, 847-851 |
| 9017055 | CIF | Fe1.228 Mg0.79 O4 Ti0.98 | F d -3 m :2 | 8.5021; 8.5021; 8.5021 90; 90; 90 | 614.58 | Bosi, F.; Halenius, U.; Skogby, H. Crystal chemistry of the ulvospinel-qandilite series. Note: sample T4 American Mineralogist, 2014, 99, 847-851 |
| 9017056 | CIF | Fe1.106 Mg0.918 O4 Ti0.98 | F d -3 m :2 | 8.4946; 8.4946; 8.4946 90; 90; 90 | 612.955 | Bosi, F.; Halenius, U.; Skogby, H. Crystal chemistry of the ulvospinel-qandilite series. Note: sample T5 American Mineralogist, 2014, 99, 847-851 |
| 9017057 | CIF | Cr0.138 Mg0.931 O3 Si0.931 | P b n m | 4.8213; 4.9368; 6.9132 90; 90; 90 | 164.547 | Bindi, L.; Sirotkina, E. A.; Bobrov, A. V.; Irifune, T. Chromium solubility in perovskite at high pressure: The structure of (Mg1-xCrx)(Si1-xCrx)O3 (with x = 0.07) synthesized at 23 GPa and 1600 C American Mineralogist, 2014, 99, 866-869 |
| 9017058 | CIF | Al0.015 Ca Cr0.011 Fe1.957 Mg0.003 O4 Ti0.004 | P n m a | 9.2183; 3.0175; 10.6934 90; 90; 90 | 297.45 | Galuskina, I. O.; Vapnik, Y.; Lazic, B.; Armbruster, T.; Murashko, M.; Galuskin, E. V. Harmunite CaFe2O4: A new mineral from the Jabel Harmun, West Bank, Palestinian Autonomy, Israel American Mineralogist, 2014, 99, 965-975 |
| 9017059 | CIF | Ca0.835 Fe0.86 H48 Mg2.24 Mn1.02 O58 Sb0.225 W8.72 Zn0.6 | P -1 | 11.986; 13.2073; 17.6891 69.69; 85.364; 64.875 | 2370.35 | Kampf, A. R.; Hughes, J. M.; Nash, B. P.; Wright, S. E.; Rossman, G. R.; Marty, J. Ophirite, Ca2Mg4[Zn2Mn3+2(H2O)2(Fe3+W9O34)2]*46H2O, a new mineral with a heteropolytungstate tri-lacunary Keggin anion American Mineralogist, 2014, 99, 1045-1051 |
| 9017060 | CIF | Ag0.002 Bi3.95 Cd0.018 Cu0.085 Fe0.65 Mn1.102 Pb0.142 S8 Sb0.036 Se0.024 Te0.014 | C 1 2/m 1 | 12.677; 3.914; 14.758 90; 115.31; 90 | 661.968 | Ciobanu, C. L.; Brugger, J.; Cook, N. J.; Mills, S. J.; Elliott, P.; Damian, G.; Damian, F. Gratianite, MnBi2S4, a new mineral from the Baita Bihor skarn, Romania American Mineralogist, 2014, 99, 1163-1170 |
| 9017061 | CIF | Ca0.1 Li0.725 Mg0.19 Mn3.71 Na0.275 O15 Si5 | P -1 | 7.5391; 11.7475; 6.7137 93.024; 95.147; 106.266 | 566.611 | Nagashima, M.; Armbruster, T.; Kolitsch, U.; Pettke, T. The relation between Li <-> Na substitution and hydrogen bonding in five-periodic single-chain silicates nambulite and marsturite: A single-crystal X-ray study American Mineralogist, 2014, 99, 1462-1470 |
| 9017062 | CIF | Ca0.05 H Li0.821 Mg0.26 Mn3.69 Na0.179 O15 Si5 | P -1 | 7.5372; 11.7267; 6.7078 93.057; 95.147; 106.24 | 565.017 | Nagashima, M.; Armbruster, T.; Kolitsch, U.; Pettke, T. The relation between Li <-> Na substitution and hydrogen bonding in five-periodic single-chain silicates nambulite and marsturite: A single-crystal X-ray study American Mineralogist, 2014, 99, 1462-1470 |
| 9017063 | CIF | Ca0.212 H Li0.276 Mg0.22 Mn3.568 Na0.724 O15 Si5 | P -1 | 7.6115; 11.734; 6.7324 92.876; 94.846; 106.65 | 572.278 | Nagashima, M.; Armbruster, T.; Kolitsch, U.; Pettke, T. The relation between Li <-> Na substitution and hydrogen bonding in five-periodic single-chain silicates nambulite and marsturite: A single-crystal X-ray study American Mineralogist, 2014, 99, 1462-1470 |
| 9017064 | CIF | Ca0.912 Fe0.11 H Li0.062 Mg0.07 Mn2.908 Na0.938 O15 Si5 | P -1 | 7.697; 11.72; 6.771 92.4; 94.41; 106.83 | 581.593 | Nagashima, M.; Armbruster, T.; Kolitsch, U.; Pettke, T. The relation between Li <-> Na substitution and hydrogen bonding in five-periodic single-chain silicates nambulite and marsturite: A single-crystal X-ray study American Mineralogist, 2014, 99, 1462-1470 |
| 9017065 | CIF | Li9 Mn18 O36 | F d d d :2 | 24.764; 24.862; 8.1995 90; 90; 90 | 5048.29 | Ishizawa, N.; Tateishi, K.; Oishi, S.; Kishimoto, S. Bond-length fluctuation in the orthorhombic 3x3x1 superstructure of LiMn2O4 Note: T = 230 K American Mineralogist, 2014, 99, 1528-1536 |
| 9017066 | CIF | Li Mn2 O4 | F d -3 m :2 | 8.2513; 8.2513; 8.2513 90; 90; 90 | 561.781 | Ishizawa, N.; Tateishi, K.; Oishi, S.; Kishimoto, S. Bond-length fluctuation in the orthorhombic 3x3x1 superstructure of LiMn2O4 Note: T = 320 K American Mineralogist, 2014, 99, 1528-1536 |
| 9017067 | CIF | Al2.455 Mg0.79 Na0.33 O6 Si0.63 | P 63/m | 8.7225; 8.7225; 2.7664 90; 90; 120 | 182.275 | Pamato, M. G.; Kurnosov, A.; Ballaran, T. B.; Trots, D. M.; Caracas, R.; Frost, D. J. Hexagonal Na0.41[Na0.125Mg0.79Al0.085]2[Al0.79Si0.21]6O12 (NAL phase): Crystal structure refinement and elasticity American Mineralogist, 2014, 99, 1562-1569 |
| 9017068 | CIF | Ca0.056 H Mn1.944 Na O9 Si3 | P -1 | 7.6844; 6.8913; 6.73493 90.4576; 94.0805; 102.777 | 346.835 | Williams, E. R.; Weller, M. T. A variable-temperature neutron diffraction study of serandite: A Mn-silicate framework with a very strong, two-proton site, hydrogen bond Note: T = 4 K American Mineralogist, 2014, 99, 1755-1760 |
| 9017069 | CIF | Ca0.053 H Mn1.947 Na O9 Si3 | P -1 | 7.6888; 6.8934; 6.73781 90.4467; 94.0672; 102.777 | 347.296 | Williams, E. R.; Weller, M. T. A variable-temperature neutron diffraction study of serandite: A Mn-silicate framework with a very strong, two-proton site, hydrogen bond Note: T = 150 K American Mineralogist, 2014, 99, 1755-1760 |
| 9017070 | CIF | Ca0.058 H Mn1.942 Na O9 Si3 | P -1 | 7.70244; 6.9003; 6.7447 90.4159; 94.0442; 102.801 | 348.599 | Williams, E. R.; Weller, M. T. A variable-temperature neutron diffraction study of serandite: A Mn-silicate framework with a very strong, two-proton site, hydrogen bond Note: T = 298 K American Mineralogist, 2014, 99, 1755-1760 |
| 9017071 | CIF | Ca0.074 H Mn1.926 Na O9 Si3 | P -1 | 7.7283; 6.9174; 6.7608 90.362; 94.016; 102.822 | 351.464 | Williams, E. R.; Weller, M. T. A variable-temperature neutron diffraction study of serandite: A Mn-silicate framework with a very strong, two-proton site, hydrogen bond Note: T = 575 K American Mineralogist, 2014, 99, 1755-1760 |
| 9017072 | CIF | Ca0.074 H Mn1.926 Na O9 Si3 | P -1 | 7.7513; 6.9384; 6.7761 90.307; 94.019; 102.858 | 354.335 | Williams, E. R.; Weller, M. T. A variable-temperature neutron diffraction study of serandite: A Mn-silicate framework with a very strong, two-proton site, hydrogen bond Note: T = 800 K American Mineralogist, 2014, 99, 1755-1760 |
| 9017073 | CIF | H28 K0.216 Mg2 N0.784 Na O22 P2 | P m n b | 6.9661; 25.236; 11.2919 90; 90; 90 | 1985.08 | Yang, H.; Martinelli, L.; Tasso, F.; Sprocati, A. R.; Pinzari, F.; Liu, Z.; Downs, R. T.; Sun, H. J. A new biogenic, struvite-related phosphate, the ammonium-analog of hazenite, (NH4)NaMg2(PO4)2*14H2O American Mineralogist, 2014, 99, 1761-1766 |
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