Crystallography Open Database

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Searching journal of publication like 'Journal of the American Chemical Society' volume of publication is 136

COD ID: 1516253
CIF file Formula: - C6 H3 F N3 S4 -
Comments: Lekin, Kristina; Phan, Hoa; Winter, Stephen M.; Wong, Joanne W. L.; Leitch, Alicea A.; Laniel, Dominique; Yong, Wenjun; Secco, Richard A.; Tse, John S.; Desgreniers, Serge; Dube, Paul A.; Shatruk, Michael; Oakley, Richard T. Heat, Pressure and Light-Induced Interconversion of Bisdithiazolyl Radicals and Dimers. Journal of the American Chemical Society 136(22) (2014) 8050
Space group: P 1 21/c 1
Cell volume: 954.8
Cell parameters: 4.789; 12.683; 16.599; 90; 71.26; 90;  

COD ID: 1516254
CIF file Formula: - C6 H3 F N3 S4 -
Comments: Lekin, Kristina; Phan, Hoa; Winter, Stephen M.; Wong, Joanne W. L.; Leitch, Alicea A.; Laniel, Dominique; Yong, Wenjun; Secco, Richard A.; Tse, John S.; Desgreniers, Serge; Dube, Paul A.; Shatruk, Michael; Oakley, Richard T. Heat, Pressure and Light-Induced Interconversion of Bisdithiazolyl Radicals and Dimers. Journal of the American Chemical Society 136(22) (2014) 8050
Space group: P 1 21/n 1
Cell volume: 1841.8
Cell parameters: 17.301; 4.0582; 26.249; 90; 92.074; 90;  

COD ID: 1516255
CIF file Formula: - C12 H6 F2 N6 S8 -
Comments: Lekin, Kristina; Phan, Hoa; Winter, Stephen M.; Wong, Joanne W. L.; Leitch, Alicea A.; Laniel, Dominique; Yong, Wenjun; Secco, Richard A.; Tse, John S.; Desgreniers, Serge; Dube, Paul A.; Shatruk, Michael; Oakley, Richard T. Heat, Pressure and Light-Induced Interconversion of Bisdithiazolyl Radicals and Dimers. Journal of the American Chemical Society 136(22) (2014) 8050
Space group: P 1 21/c 1
Cell volume: 914.8
Cell parameters: 4.6011; 12.7317; 15.9122; 90; 78.949; 90;  

COD ID: 1516256
CIF file Formula: - C12 H6 F2 N6 S8 -
Comments: Lekin, Kristina; Phan, Hoa; Winter, Stephen M.; Wong, Joanne W. L.; Leitch, Alicea A.; Laniel, Dominique; Yong, Wenjun; Secco, Richard A.; Tse, John S.; Desgreniers, Serge; Dube, Paul A.; Shatruk, Michael; Oakley, Richard T. Heat, Pressure and Light-Induced Interconversion of Bisdithiazolyl Radicals and Dimers. Journal of the American Chemical Society 136(22) (2014) 8050
Space group: P 1 21/c 1
Cell volume: 808.83
Cell parameters: 4.12168; 13.2722; 14.8586; 90; 84.318; 90;  

COD ID: 1516257
CIF file Formula: - C6 H3 F N3 S4 -
Comments: Lekin, Kristina; Phan, Hoa; Winter, Stephen M.; Wong, Joanne W. L.; Leitch, Alicea A.; Laniel, Dominique; Yong, Wenjun; Secco, Richard A.; Tse, John S.; Desgreniers, Serge; Dube, Paul A.; Shatruk, Michael; Oakley, Richard T. Heat, Pressure and Light-Induced Interconversion of Bisdithiazolyl Radicals and Dimers. Journal of the American Chemical Society 136(22) (2014) 8050
Space group: P 1 21/c 1
Cell volume: 954.7
Cell parameters: 4.789; 12.683; 16.281; 90; 74.89; 90;  

COD ID: 1516258
CIF file Formula: - C12 H6 F2 N6 S8 -
Comments: Lekin, Kristina; Phan, Hoa; Winter, Stephen M.; Wong, Joanne W. L.; Leitch, Alicea A.; Laniel, Dominique; Yong, Wenjun; Secco, Richard A.; Tse, John S.; Desgreniers, Serge; Dube, Paul A.; Shatruk, Michael; Oakley, Richard T. Heat, Pressure and Light-Induced Interconversion of Bisdithiazolyl Radicals and Dimers. Journal of the American Chemical Society 136(22) (2014) 8050
Space group: P 1 21/c 1
Cell volume: 753.42
Cell parameters: 3.86543; 13.4994; 14.4694; 90; 86.261; 90;  

COD ID: 4120430
CIF file Formula: - C16 H33 F3 N4 Ni O5 S -
Comments: Heims, Florian; Pfaff, Florian Felix; Abram, Sarah-Luise; Farquhar, Erik R.; Bruschi, Maurizio; Greco, Claudio; Ray, Kallol Redox non-innocence of a N-heterocyclic nitrenium cation bound to a nickel-cyclam core. Journal of the American Chemical Society 136(2) (2014) 582-585
Space group: P 21 21 21
Cell volume: 2185.27
Cell parameters: 11.5083; 11.7852; 16.1123; 90; 90; 90;  

COD ID: 4120431
CIF file Formula: - C24 H41 F12 N8 Ni P2 -
Comments: Heims, Florian; Pfaff, Florian Felix; Abram, Sarah-Luise; Farquhar, Erik R.; Bruschi, Maurizio; Greco, Claudio; Ray, Kallol Redox non-innocence of a N-heterocyclic nitrenium cation bound to a nickel-cyclam core. Journal of the American Chemical Society 136(2) (2014) 582-585
Space group: P c a 21
Cell volume: 6433.3
Cell parameters: 17.2639; 18.5917; 20.0435; 90; 90; 90;  

COD ID: 4120432
CIF file Formula: - C15 H19 Cl Cu N7 O6 -
Comments: Murdock, Christopher R.; McNutt, Nicholas W.; Keffer, David J.; Jenkins, David M. Rotating phenyl rings as a guest-dependent switch in two-dimensional metal-organic frameworks. Journal of the American Chemical Society 136(2) (2014) 671-678
Space group: C 1 2/m 1
Cell volume: 2031.7
Cell parameters: 21.381; 7.616; 15.488; 90; 126.334; 90;  

COD ID: 4120433
CIF file Formula: - C36 H52 Cl2 Cu2 N16 O13 -
Comments: Murdock, Christopher R.; McNutt, Nicholas W.; Keffer, David J.; Jenkins, David M. Rotating phenyl rings as a guest-dependent switch in two-dimensional metal-organic frameworks. Journal of the American Chemical Society 136(2) (2014) 671-678
Space group: C 1 2/m 1
Cell volume: 2571.7
Cell parameters: 21.5868; 7.3214; 18.2301; 90; 116.799; 90;  

COD ID: 4120434
CIF file Formula: - C16 H23 Cl Cu N7 O6 -
Comments: Murdock, Christopher R.; McNutt, Nicholas W.; Keffer, David J.; Jenkins, David M. Rotating phenyl rings as a guest-dependent switch in two-dimensional metal-organic frameworks. Journal of the American Chemical Society 136(2) (2014) 671-678
Space group: C m c a
Cell volume: 4814.5
Cell parameters: 7.3259; 21.889; 30.024; 90; 90; 90;  

COD ID: 4120435
CIF file Formula: - C17 H23 Cl Cu N7 O6 -
Comments: Murdock, Christopher R.; McNutt, Nicholas W.; Keffer, David J.; Jenkins, David M. Rotating phenyl rings as a guest-dependent switch in two-dimensional metal-organic frameworks. Journal of the American Chemical Society 136(2) (2014) 671-678
Space group: C 1 2/m 1
Cell volume: 2077
Cell parameters: 21.088; 7.861; 15.11; 90; 123.989; 90;  

COD ID: 4120436
CIF file Formula: - C39 H51 Cl2 Cu2 N15 O11 -
Comments: Murdock, Christopher R.; McNutt, Nicholas W.; Keffer, David J.; Jenkins, David M. Rotating phenyl rings as a guest-dependent switch in two-dimensional metal-organic frameworks. Journal of the American Chemical Society 136(2) (2014) 671-678
Space group: P -1
Cell volume: 1211.7
Cell parameters: 7.4576; 11.4553; 15.173; 100.375; 92.657; 107.116;  

COD ID: 4120437
CIF file Formula: - C44 H44 N20 O3 -
Comments: Li, Peng; He, Yabing; Guang, Jie; Weng, Linghong; Zhao, John Cong-Gui; Xiang, Shengchang; Chen, Banglin A homochiral microporous hydrogen-bonded organic framework for highly enantioselective separation of secondary alcohols. Journal of the American Chemical Society 136(2) (2014) 547-549
Space group: P 65
Cell volume: 8832.6
Cell parameters: 11.9083; 11.9083; 71.9218; 90; 90; 120;  

COD ID: 4120438
CIF file Formula: - C44 H44 N20 O3 -
Comments: Li, Peng; He, Yabing; Guang, Jie; Weng, Linghong; Zhao, John Cong-Gui; Xiang, Shengchang; Chen, Banglin A homochiral microporous hydrogen-bonded organic framework for highly enantioselective separation of secondary alcohols. Journal of the American Chemical Society 136(2) (2014) 547-549
Space group: P 65
Cell volume: 8801.3
Cell parameters: 11.8925; 11.8925; 71.857; 90; 90; 120;  

COD ID: 4120439
CIF file Formula: - C36 H34 N20 O2 -
Comments: Li, Peng; He, Yabing; Guang, Jie; Weng, Linghong; Zhao, John Cong-Gui; Xiang, Shengchang; Chen, Banglin A homochiral microporous hydrogen-bonded organic framework for highly enantioselective separation of secondary alcohols. Journal of the American Chemical Society 136(2) (2014) 547-549
Space group: P 65
Cell volume: 8784.4
Cell parameters: 11.8861; 11.8861; 71.796; 90; 90; 120;  

COD ID: 4120440
CIF file Formula: - C30 H16 Cu N6 O2 -
Comments: Liu, Guangfeng; Liu, Jie; Liu, Yang; Tao, Xutang Oriented Single-Crystal-to-Single-Crystal Phase Transition with Dramatic Changes in the Dimensions of Crystals. Journal of the American Chemical Society 136(2) (2014) 590-593
Space group: P -1
Cell volume: 593.6
Cell parameters: 7.127; 7.543; 12.014; 83.495; 88.783; 67.724;  

COD ID: 4120441
CIF file Formula: - C30 H16 Cu N6 O2 -
Comments: Liu, Guangfeng; Liu, Jie; Liu, Yang; Tao, Xutang Oriented Single-Crystal-to-Single-Crystal Phase Transition with Dramatic Changes in the Dimensions of Crystals. Journal of the American Chemical Society 136(2) (2014) 590-593
Space group: P -1
Cell volume: 599.26
Cell parameters: 8.035; 8.2606; 9.7665; 77.26; 73.554; 78.132;  

COD ID: 4120442
CIF file Formula: - C30 H16 Cu N6 O2 -
Comments: Liu, Guangfeng; Liu, Jie; Liu, Yang; Tao, Xutang Oriented Single-Crystal-to-Single-Crystal Phase Transition with Dramatic Changes in the Dimensions of Crystals. Journal of the American Chemical Society 136(2) (2014) 590-593
Space group: P -1
Cell volume: 585.11
Cell parameters: 7.9345; 8.2352; 9.7232; 77.5; 72.92; 77.61;  

COD ID: 4120443
CIF file Formula: - C30 H16 Cu N6 O2 -
Comments: Liu, Guangfeng; Liu, Jie; Liu, Yang; Tao, Xutang Oriented Single-Crystal-to-Single-Crystal Phase Transition with Dramatic Changes in the Dimensions of Crystals. Journal of the American Chemical Society 136(2) (2014) 590-593
Space group: P -1
Cell volume: 588.05
Cell parameters: 7.9548; 8.2408; 9.7333; 77.482; 73.031; 77.695;  

COD ID: 4120444
CIF file Formula: - C30 H16 Cu N6 O2 -
Comments: Liu, Guangfeng; Liu, Jie; Liu, Yang; Tao, Xutang Oriented Single-Crystal-to-Single-Crystal Phase Transition with Dramatic Changes in the Dimensions of Crystals. Journal of the American Chemical Society 136(2) (2014) 590-593
Space group: P -1
Cell volume: 591.15
Cell parameters: 7.9746; 8.2474; 9.7454; 77.428; 73.156; 77.796;  

COD ID: 4120445
CIF file Formula: - C30 H16 Cu N6 O2 -
Comments: Liu, Guangfeng; Liu, Jie; Liu, Yang; Tao, Xutang Oriented Single-Crystal-to-Single-Crystal Phase Transition with Dramatic Changes in the Dimensions of Crystals. Journal of the American Chemical Society 136(2) (2014) 590-593
Space group: P -1
Cell volume: 593.4
Cell parameters: 7.9932; 8.2504; 9.749; 77.377; 73.279; 77.9;  

COD ID: 4120446
CIF file Formula: - C30 H16 Cu N6 O2 -
Comments: Liu, Guangfeng; Liu, Jie; Liu, Yang; Tao, Xutang Oriented Single-Crystal-to-Single-Crystal Phase Transition with Dramatic Changes in the Dimensions of Crystals. Journal of the American Chemical Society 136(2) (2014) 590-593
Space group: P -1
Cell volume: 596.57
Cell parameters: 8.0146; 8.2576; 9.7583; 77.324; 73.418; 78.017;  

COD ID: 4120447
CIF file Formula: - C30 H16 Cu N6 O2 -
Comments: Liu, Guangfeng; Liu, Jie; Liu, Yang; Tao, Xutang Oriented Single-Crystal-to-Single-Crystal Phase Transition with Dramatic Changes in the Dimensions of Crystals. Journal of the American Chemical Society 136(2) (2014) 590-593
Space group: P -1
Cell volume: 593.2
Cell parameters: 7.123; 7.543; 12.009; 83.508; 88.837; 67.752;  

COD ID: 4120448
CIF file Formula: - C64 H112 Cu8 -
Comments: Geng, Weizhi; Wei, Junnian; Zhang, Wen-Xiong; Xi, Zhenfeng Isolable and well-defined butadienyl organocopper(i) aggregates: facile synthesis, structural characterization, and reaction chemistry. Journal of the American Chemical Society 136(2) (2014) 610-613
Space group: P 1 21/n 1
Cell volume: 3399.5
Cell parameters: 14.232; 16.803; 14.491; 90; 101.19; 90;  

COD ID: 4120449
CIF file Formula: - C48 H80 Cu8 -
Comments: Geng, Weizhi; Wei, Junnian; Zhang, Wen-Xiong; Xi, Zhenfeng Isolable and well-defined butadienyl organocopper(i) aggregates: facile synthesis, structural characterization, and reaction chemistry. Journal of the American Chemical Society 136(2) (2014) 610-613
Space group: P 1 21/n 1
Cell volume: 4823.4
Cell parameters: 18.6062; 14.647; 18.656; 90; 108.433; 90;  

COD ID: 4120450
CIF file Formula: - C60 H116 Cl4 Cu8 Li2 N4 -
Comments: Geng, Weizhi; Wei, Junnian; Zhang, Wen-Xiong; Xi, Zhenfeng Isolable and well-defined butadienyl organocopper(i) aggregates: facile synthesis, structural characterization, and reaction chemistry. Journal of the American Chemical Society 136(2) (2014) 610-613
Space group: P 1 21/c 1
Cell volume: 7407
Cell parameters: 16.3819; 12.9444; 35.6961; 90; 101.894; 90;  

COD ID: 4120451
CIF file Formula: - C96 H168 Cl4 Cu12 -
Comments: Geng, Weizhi; Wei, Junnian; Zhang, Wen-Xiong; Xi, Zhenfeng Isolable and well-defined butadienyl organocopper(i) aggregates: facile synthesis, structural characterization, and reaction chemistry. Journal of the American Chemical Society 136(2) (2014) 610-613
Space group: P -1
Cell volume: 5806
Cell parameters: 12.371; 17.06; 28.421; 95.05; 99.79; 98.53;  

COD ID: 4120452
CIF file Formula: - C44 H80 Cu3 I2 Li O3 -
Comments: Geng, Weizhi; Wei, Junnian; Zhang, Wen-Xiong; Xi, Zhenfeng Isolable and well-defined butadienyl organocopper(i) aggregates: facile synthesis, structural characterization, and reaction chemistry. Journal of the American Chemical Society 136(2) (2014) 610-613
Space group: P -1
Cell volume: 2512.17
Cell parameters: 9.1034; 12.6088; 22.6274; 95.008; 99.948; 98.618;  

COD ID: 4120453
CIF file Formula: - C38 H20 N2 O8 S2 -
Comments: Comotti, Angiolina; Bracco, Silvia; Yamamoto, Atsushi; Beretta, Mario; Hirukawa, Tomofumi; Tohnai, Norimitsu; Miyata, Mikiji; Sozzani, Piero Engineering switchable rotors in molecular crystals with open porosity. Journal of the American Chemical Society 136(2) (2014) 618-621
Space group: P 1 21/n 1
Cell volume: 3660.88
Cell parameters: 5.681; 43.239; 14.904; 90; 90.522; 90;  

COD ID: 4120454
CIF file Formula: - C32 H40 N2 O6 S2 -
Comments: Comotti, Angiolina; Bracco, Silvia; Yamamoto, Atsushi; Beretta, Mario; Hirukawa, Tomofumi; Tohnai, Norimitsu; Miyata, Mikiji; Sozzani, Piero Engineering switchable rotors in molecular crystals with open porosity. Journal of the American Chemical Society 136(2) (2014) 618-621
Space group: P 1 21/n 1
Cell volume: 3502.4
Cell parameters: 5.512; 43.593; 14.5819; 90; 91.628; 90;  

COD ID: 4120455
CIF file Formula: - C145 H180 S4 Si2 -
Comments: Lips, Felicitas; Fettinger, James C.; Mansikkamäki, Akseli; Tuononen, Heikki M.; Power, Philip P. Reversible Complexation of Ethylene by a Silylene under Ambient Conditions. Journal of the American Chemical Society 136(2) (2014) 634-637
Space group: P 1 21/c 1
Cell volume: 12546.8
Cell parameters: 25.6178; 19.6472; 25.9073; 90; 105.802; 90;  

COD ID: 4120456
CIF file Formula: - C62 H66 S2 Si -
Comments: Lips, Felicitas; Fettinger, James C.; Mansikkamäki, Akseli; Tuononen, Heikki M.; Power, Philip P. Reversible Complexation of Ethylene by a Silylene under Ambient Conditions. Journal of the American Chemical Society 136(2) (2014) 634-637
Space group: P 1 2/n 1
Cell volume: 2551.3
Cell parameters: 11.2065; 19.85; 12.2681; 90; 110.793; 90;  

COD ID: 4120457
CIF file Formula: - C98 H86 As Cl N8 O6 S8 -
Comments: Furuyama, Taniyuki; Satoh, Koh; Kushiya, Tomofumi; Kobayashi, Nagao Design, Synthesis, and Properties of Phthalocyanine Complexes with Main-Group Elements Showing Main Absorption and Fluorescence beyond 1000 nm. Journal of the American Chemical Society 136(2) (2014) 765-776
Space group: P 1 21/c 1
Cell volume: 10048
Cell parameters: 16.183; 22.854; 30.773; 90; 118.013; 90;  

COD ID: 4120458
CIF file Formula: - C83 H55 Cl3 F3 N8 O2 P1.5 S8 -
Comments: Furuyama, Taniyuki; Satoh, Koh; Kushiya, Tomofumi; Kobayashi, Nagao Design, Synthesis, and Properties of Phthalocyanine Complexes with Main-Group Elements Showing Main Absorption and Fluorescence beyond 1000 nm. Journal of the American Chemical Society 136(2) (2014) 765-776
Space group: C 1 2/c 1
Cell volume: 18909
Cell parameters: 17.407; 37.264; 29.795; 90; 101.927; 90;  

COD ID: 4120459
CIF file Formula: - C80 H50 N8 Se8 -
Comments: Furuyama, Taniyuki; Satoh, Koh; Kushiya, Tomofumi; Kobayashi, Nagao Design, Synthesis, and Properties of Phthalocyanine Complexes with Main-Group Elements Showing Main Absorption and Fluorescence beyond 1000 nm. Journal of the American Chemical Society 136(2) (2014) 765-776
Space group: P 1 21/c 1
Cell volume: 7480.8
Cell parameters: 15.5571; 17.2914; 28.018; 90; 96.999; 90;  

COD ID: 4120460
CIF file Formula: - C13 H12.25 N Te -
Comments: Furuyama, Taniyuki; Satoh, Koh; Kushiya, Tomofumi; Kobayashi, Nagao Design, Synthesis, and Properties of Phthalocyanine Complexes with Main-Group Elements Showing Main Absorption and Fluorescence beyond 1000 nm. Journal of the American Chemical Society 136(2) (2014) 765-776
Space group: P 42/n m c :2
Cell volume: 7431.3
Cell parameters: 21.3517; 21.3517; 16.3004; 90; 90; 90;  

COD ID: 4120461
CIF file Formula: - C96 H70 N8 S8 -
Comments: Furuyama, Taniyuki; Satoh, Koh; Kushiya, Tomofumi; Kobayashi, Nagao Design, Synthesis, and Properties of Phthalocyanine Complexes with Main-Group Elements Showing Main Absorption and Fluorescence beyond 1000 nm. Journal of the American Chemical Society 136(2) (2014) 765-776
Space group: C 1 2/c 1
Cell volume: 9119
Cell parameters: 39.099; 11.4435; 27.428; 90; 132.005; 90;  

COD ID: 4120462
CIF file Formula: - C84 H56 Cl3 N9 O S8 Zn -
Comments: Furuyama, Taniyuki; Satoh, Koh; Kushiya, Tomofumi; Kobayashi, Nagao Design, Synthesis, and Properties of Phthalocyanine Complexes with Main-Group Elements Showing Main Absorption and Fluorescence beyond 1000 nm. Journal of the American Chemical Society 136(2) (2014) 765-776
Space group: P 1 21/n 1
Cell volume: 8488
Cell parameters: 26.58; 10.488; 32.51; 90; 110.51; 90;  

COD ID: 4120463
CIF file Formula: - C9 H13 N O6 -
Comments: Aydillo, Carlos; Compañón, Ismael; Avenoza, Alberto; Busto, Jesús H; Corzana, Francisco; Peregrina, Jesús M; Zurbano, María M S-Michael additions to chiral dehydroalanines as an entry to glycosylated cysteines and a sulfa-tn antigen mimic. Journal of the American Chemical Society 136(2) (2014) 789-800
Space group: P 1 21 1
Cell volume: 535.21
Cell parameters: 6.801; 11.467; 6.882; 90; 94.28; 90;  

COD ID: 4120464
CIF file Formula: - C13 H21 N O6 -
Comments: Aydillo, Carlos; Compañón, Ismael; Avenoza, Alberto; Busto, Jesús H; Corzana, Francisco; Peregrina, Jesús M; Zurbano, María M S-Michael additions to chiral dehydroalanines as an entry to glycosylated cysteines and a sulfa-tn antigen mimic. Journal of the American Chemical Society 136(2) (2014) 789-800
Space group: P 1 21 1
Cell volume: 780.28
Cell parameters: 6.4895; 12.4868; 10.0658; 90; 106.939; 90;  

COD ID: 4120465
CIF file Formula: - C24 H27 Cl N2 O3 -
Comments: Wang, Ming; Huang, Zhijian; Xu, Jianfeng; Chi, Yonggui Robin N-heterocyclic carbene-catalyzed [3+4] cycloaddition and kinetic resolution of azomethine imines. Journal of the American Chemical Society 136(4) (2014) 1214-1217
Space group: P -1
Cell volume: 1104.93
Cell parameters: 8.7207; 11.0415; 12.0957; 76.6178; 77.387; 85.038;  

COD ID: 4120466
CIF file Formula: - C27.5 H25 Cl N2 O2.5 -
Comments: Wang, Ming; Huang, Zhijian; Xu, Jianfeng; Chi, Yonggui Robin N-heterocyclic carbene-catalyzed [3+4] cycloaddition and kinetic resolution of azomethine imines. Journal of the American Chemical Society 136(4) (2014) 1214-1217
Space group: C 1 2 1
Cell volume: 2313.8
Cell parameters: 19.268; 9.7295; 13.1749; 90; 110.476; 90;  

COD ID: 4120467
CIF file Formula: - C38 H76 O3 Si8 -
Comments: Izumiseki, Atsuto; Yamamoto, Hisashi Intermolecular/Intramolecular sequential aldol reaction. Journal of the American Chemical Society 136(4) (2014) 1308-1311
Space group: P -1
Cell volume: 2507
Cell parameters: 9.3625; 15.5302; 19.15; 106.249; 100.111; 103.789;  

COD ID: 4120468
CIF file Formula: - C35 H78 O3 Si8 -
Comments: Izumiseki, Atsuto; Yamamoto, Hisashi Intermolecular/Intramolecular sequential aldol reaction. Journal of the American Chemical Society 136(4) (2014) 1308-1311
Space group: P 1 21/n 1
Cell volume: 4884
Cell parameters: 9.645; 14.612; 34.8; 90; 95.245; 90;  

COD ID: 4120469
CIF file Formula: - C36 H80 O3 Si8 -
Comments: Izumiseki, Atsuto; Yamamoto, Hisashi Intermolecular/Intramolecular sequential aldol reaction. Journal of the American Chemical Society 136(4) (2014) 1308-1311
Space group: P -1
Cell volume: 2509.7
Cell parameters: 9.8072; 15.361; 18.474; 112.146; 95.528; 98.94;  

COD ID: 4120470
CIF file Formula: - C39 H84 O3 Si8 -
Comments: Izumiseki, Atsuto; Yamamoto, Hisashi Intermolecular/Intramolecular sequential aldol reaction. Journal of the American Chemical Society 136(4) (2014) 1308-1311
Space group: P b c a
Cell volume: 10332
Cell parameters: 16.947; 23.441; 26.008; 90; 90; 90;  

COD ID: 4120471
CIF file Formula: - C38 H84 O3 Si8 -
Comments: Izumiseki, Atsuto; Yamamoto, Hisashi Intermolecular/Intramolecular sequential aldol reaction. Journal of the American Chemical Society 136(4) (2014) 1308-1311
Space group: P -1
Cell volume: 2555.9
Cell parameters: 9.3553; 14.978; 18.5074; 97.412; 92.695; 95.354;  

COD ID: 4120472
CIF file Formula: - C35 H78 O3 Si8 -
Comments: Izumiseki, Atsuto; Yamamoto, Hisashi Intermolecular/Intramolecular sequential aldol reaction. Journal of the American Chemical Society 136(4) (2014) 1308-1311
Space group: P -1
Cell volume: 2795.4
Cell parameters: 9.0741; 15.281; 21.098; 83.64; 87.08; 74.09;  

COD ID: 4120473
CIF file Formula: - C40 H78 O3 Si8 -
Comments: Izumiseki, Atsuto; Yamamoto, Hisashi Intermolecular/Intramolecular sequential aldol reaction. Journal of the American Chemical Society 136(4) (2014) 1308-1311
Space group: P 1 21 1
Cell volume: 5184.9
Cell parameters: 14.981; 17.61; 20.61; 90; 107.525; 90;  

COD ID: 4120474
CIF file Formula: - C17 H19 Cl O2 -
Comments: Izumiseki, Atsuto; Yamamoto, Hisashi Intermolecular/Intramolecular sequential aldol reaction. Journal of the American Chemical Society 136(4) (2014) 1308-1311
Space group: P 1 21/n 1
Cell volume: 1420.6
Cell parameters: 12.453; 6.088; 19.577; 90; 106.84; 90;  

COD ID: 4120475
CIF file Formula: - C12 H30 N4 W -
Comments: McClain, K. Randall; O'Donohue, Christopher; Koley, Arijit; Bonsu, Richard O.; Abboud, Khalil A.; Revelli, Joseph C.; Anderson, Timothy J.; McElwee-White, Lisa Tungsten Nitrido Complexes as Precursors for Low Temperature Chemical Vapor Deposition of WNxCy Films as Diffusion Barriers for Cu Metallization. Journal of the American Chemical Society 136(4) (2014) 1650-1662
Space group: P 1 21/n 1
Cell volume: 1767.2
Cell parameters: 8.9854; 12.5595; 15.9376; 90; 100.712; 90;  

COD ID: 4120476
CIF file Formula: - C14 H34 N4 W -
Comments: McClain, K. Randall; O'Donohue, Christopher; Koley, Arijit; Bonsu, Richard O.; Abboud, Khalil A.; Revelli, Joseph C.; Anderson, Timothy J.; McElwee-White, Lisa Tungsten Nitrido Complexes as Precursors for Low Temperature Chemical Vapor Deposition of WNxCy Films as Diffusion Barriers for Cu Metallization. Journal of the American Chemical Society 136(4) (2014) 1650-1662
Space group: P 21 21 21
Cell volume: 5726.7
Cell parameters: 15.2965; 17.931; 20.879; 90; 90; 90;  

COD ID: 4120477
CIF file Formula: - C15 H25 F3 N2 Sn -
Comments: Samuel, Prinson P.; Li, Yan; Roesky, Herbert W.; Chevelkov, Veniamin; Lange, Adam; Burkhardt, Anja; Dittrich, Birger Synthetic Access to a Hydrocarbon-Soluble Trifluorinated Ge(II) Compound and its Sn(II) Congener. Journal of the American Chemical Society 136(4) (2014) 1292-1295
Space group: P 1 21/c 1
Cell volume: 1797
Cell parameters: 9.573; 17.473; 11.177; 90; 105.99; 90;  

COD ID: 4120478
CIF file Formula: - C15 H25 F3 Ge N2 -
Comments: Samuel, Prinson P.; Li, Yan; Roesky, Herbert W.; Chevelkov, Veniamin; Lange, Adam; Burkhardt, Anja; Dittrich, Birger Synthetic Access to a Hydrocarbon-Soluble Trifluorinated Ge(II) Compound and its Sn(II) Congener. Journal of the American Chemical Society 136(4) (2014) 1292-1295
Space group: P 21 21 21
Cell volume: 1758.1
Cell parameters: 9.3477; 10.5608; 17.8086; 90; 90; 90;  

COD ID: 4120479
CIF file Formula: - C55 H47 Cl Ni O2 P2 -
Comments: Ge, Shaozhong; Green, Rebecca A.; Hartwig, John F. Controlling First-Row Catalysts: Amination of Aryl and Heteroaryl Chlorides and Bromides with Primary Aliphatic Amines Catalyzed by a BINAP-Ligated Single-Component Ni(0) Complex. Journal of the American Chemical Society 136(4) (2014) 1617-1627
Space group: P -1
Cell volume: 2204.35
Cell parameters: 12.0364; 12.1697; 15.7969; 81.811; 74.339; 86.193;  

COD ID: 4120480
CIF file Formula: - C63.67 H79.33 Cl7.33 N12 -
Comments: Hasell, Tom; Culshaw, Jamie L.; Chong, Samantha Y.; Schmidtmann, Marc; Little, Marc A.; Jelfs, Kim E.; Pyzer-Knapp, Edward O; Shepherd, Hilary; Adams, Dave J.; Day, Graeme M.; Cooper, Andrew I. Controlling the crystallization of porous organic cages: molecular analogs of isoreticular frameworks using shape-specific directing solvents. Journal of the American Chemical Society 136(4) (2014) 1438-1448
Space group: P 3
Cell volume: 5378.2
Cell parameters: 24.075; 24.075; 10.7146; 90; 90; 120;  

COD ID: 4120481
CIF file Formula: - C74 H128 Ge12 K3 N10 O18 Ru -
Comments: Espinoza-Quintero, Gabriela; Duckworth, Jack C. A.; Myers, William K.; McGrady, John E.; Goicoechea, Jose M. Synthesis and characterization of [ru@ge12](3-): an endohedral 3-connected cluster. Journal of the American Chemical Society 136(4) (2014) 1210-1213
Space group: P 1 21 1
Cell volume: 5004.88
Cell parameters: 14.1424; 26.0428; 14.2684; 90; 107.754; 90;  

COD ID: 4120482
CIF file Formula: - C17 H25 N3 O5 Pt -
Comments: Proetto, Maria T.; Rush, Anthony M.; Chien, Miao-Ping; Abellan Baeza, Patricia; Patterson, Joseph P.; Thompson, Matthew P.; Olson, Norman H.; Moore, Curtis E.; Rheingold, Arnold L.; Andolina, Christopher; Millstone, Jill; Howell, Stephen B.; Browning, Nigel D.; Evans, James E.; Gianneschi, Nathan C. Dynamics of soft nanomaterials captured by transmission electron microscopy in liquid water. Journal of the American Chemical Society 136(4) (2014) 1162-1165
Space group: P b c a
Cell volume: 3522.51
Cell parameters: 11.005; 9.2447; 34.6234; 90; 90; 90;  

COD ID: 4120483
CIF file Formula: - C37 H55 Br2 Fe N O3 P2 -
Comments: Lagaditis, Paraskevi O.; Sues, Peter E.; Sonnenberg, Jessica F.; Wan, Kai Yang; Lough, Alan J.; Morris, Robert H. Iron(II) Complexes Containing Unsymmetrical P-N-P' Pincer Ligands for the Catalytic Asymmetric Hydrogenation of Ketones and Imines. Journal of the American Chemical Society 136(4) (2014) 1367-1380
Space group: P 1 21/c 1
Cell volume: 3871.7
Cell parameters: 13.7184; 19.4893; 14.7566; 90; 101.087; 90;  

COD ID: 4120484
CIF file Formula: - C54 H59 B Br Fe N O2 P2 -
Comments: Lagaditis, Paraskevi O.; Sues, Peter E.; Sonnenberg, Jessica F.; Wan, Kai Yang; Lough, Alan J.; Morris, Robert H. Iron(II) Complexes Containing Unsymmetrical P-N-P' Pincer Ligands for the Catalytic Asymmetric Hydrogenation of Ketones and Imines. Journal of the American Chemical Society 136(4) (2014) 1367-1380
Space group: P -1
Cell volume: 2380.32
Cell parameters: 11.0699; 14.9971; 15.9716; 88.297; 75.364; 68.451;  

COD ID: 4120485
CIF file Formula: - C24 H31 B Br F4 Fe N O2 P2 -
Comments: Lagaditis, Paraskevi O.; Sues, Peter E.; Sonnenberg, Jessica F.; Wan, Kai Yang; Lough, Alan J.; Morris, Robert H. Iron(II) Complexes Containing Unsymmetrical P-N-P' Pincer Ligands for the Catalytic Asymmetric Hydrogenation of Ketones and Imines. Journal of the American Chemical Society 136(4) (2014) 1367-1380
Space group: P 1 21/n 1
Cell volume: 2767
Cell parameters: 11.3747; 13.0802; 18.9709; 90; 101.385; 90;  

COD ID: 4120486
CIF file Formula: - C24 H33 Fe N O2 P2 -
Comments: Lagaditis, Paraskevi O.; Sues, Peter E.; Sonnenberg, Jessica F.; Wan, Kai Yang; Lough, Alan J.; Morris, Robert H. Iron(II) Complexes Containing Unsymmetrical P-N-P' Pincer Ligands for the Catalytic Asymmetric Hydrogenation of Ketones and Imines. Journal of the American Chemical Society 136(4) (2014) 1367-1380
Space group: P 1 21/c 1
Cell volume: 2390.6
Cell parameters: 16.5256; 7.4552; 20.1351; 90; 105.486; 90;  

COD ID: 4120487
CIF file Formula: - C60 H78 Br6 Fe3 N2 O4 P4 -
Comments: Lagaditis, Paraskevi O.; Sues, Peter E.; Sonnenberg, Jessica F.; Wan, Kai Yang; Lough, Alan J.; Morris, Robert H. Iron(II) Complexes Containing Unsymmetrical P-N-P' Pincer Ligands for the Catalytic Asymmetric Hydrogenation of Ketones and Imines. Journal of the American Chemical Society 136(4) (2014) 1367-1380
Space group: P -1
Cell volume: 4144.8
Cell parameters: 15.2379; 17.9143; 18.2681; 112.259; 91.536; 113.336;  

COD ID: 4120488
CIF file Formula: - C20 H25 N3 O2 -
Comments: Chang, Kai-Chi; Minami, Tsuyoshi; Koutnik, Petr; Savechenkov, Pavel Y.; Liu, Yuanli; Anzenbacher, Jr, Pavel Anion Binding Modes in meso-Substituted Hexapyrrolic Calix[4]pyrrole Isomers. Journal of the American Chemical Society 136(4) (2014) 1520-1525
Space group: C 1 2/c 1
Cell volume: 7417.6
Cell parameters: 32.6975; 10.0081; 24.9344; 90; 114.622; 90;  

COD ID: 4120489
CIF file Formula: - C26 H18 N2 O2 -
Comments: Chang, Kai-Chi; Minami, Tsuyoshi; Koutnik, Petr; Savechenkov, Pavel Y.; Liu, Yuanli; Anzenbacher, Jr, Pavel Anion Binding Modes in meso-Substituted Hexapyrrolic Calix[4]pyrrole Isomers. Journal of the American Chemical Society 136(4) (2014) 1520-1525
Space group: P -1
Cell volume: 1246.1
Cell parameters: 10.287; 11.15; 13.04; 111.592; 92.851; 113.076;  

COD ID: 4120490
CIF file Formula: - C52 H36 N6 O6 -
Comments: Chang, Kai-Chi; Minami, Tsuyoshi; Koutnik, Petr; Savechenkov, Pavel Y.; Liu, Yuanli; Anzenbacher, Jr, Pavel Anion Binding Modes in meso-Substituted Hexapyrrolic Calix[4]pyrrole Isomers. Journal of the American Chemical Society 136(4) (2014) 1520-1525
Space group: P -1
Cell volume: 2414.07
Cell parameters: 10.459; 14.643; 18.323; 103.891; 106.045; 107.136;  

COD ID: 4120491
CIF file Formula: - B9 Cs3 O21 Zn6 -
Comments: Yu, Hongwei; Wu, Hongping; Pan, Shilie; Yang, Zhihua; Hou, Xueling; Su, Xin; Jing, Qun; Poeppelmeier, Kenneth R.; Rondinelli, James M. Cs3Zn6B9O21: A Chemically Benign Member of the KBBF Family Exhibiting the Largest Second Harmonic Generation Response. Journal of the American Chemical Society 136(4) (2014) 1264-1267
Space group: C m c 21
Cell volume: 2357.1
Cell parameters: 8.4268; 19.2101; 14.5611; 90; 90; 90;  

COD ID: 4120492
CIF file Formula: - C52 H72 Li4 N4 O4 -
Comments: Bruneau, Angela M.; Liou, Lara; Collum, David B. Solution structures of lithium amino alkoxides used in highly enantioselective 1,2-additions. Journal of the American Chemical Society 136(7) (2014) 2885-2891
Space group: P 1 21 1
Cell volume: 4951.4
Cell parameters: 10.6188; 21.8666; 21.4263; 90; 95.593; 90;  

COD ID: 4120493
CIF file Formula: - C19 H27 Cl N O2 Rh -
Comments: Neely, Jamie M.; Rovis, Tomislav Rh(III)-Catalyzed Decarboxylative Coupling of Acrylic Acids with Unsaturated Oxime Esters: Carboxylic Acids Serve as Traceless Activators. Journal of the American Chemical Society 136(7) (2014) 2735-2738
Space group: P 1 21/n 1
Cell volume: 1849.4
Cell parameters: 10.006; 12.42; 15.542; 90; 106.763; 90;  

COD ID: 4120494
CIF file Formula: - C16 H18 N4 O3 -
Comments: Nath, Naba K.; Pejov, Ljupčo; Nichols, Shane M.; Hu, Chunhua; Saleh, Na'il; Kahr, Bart; Naumov, Panče Model for photoinduced bending of slender molecular crystals. Journal of the American Chemical Society 136(7) (2014) 2757-2766
Space group: P 1 21/n 1
Cell volume: 3043.6
Cell parameters: 10.152; 7.7688; 38.639; 90; 92.863; 90;  

COD ID: 4120495
CIF file Formula: - C22 H16 N2 -
Comments: Wei, Ye; Deb, Indubhusan; Yoshikai, Naohiko Correction to palladium-catalyzed aerobic oxidative cyclization of N-aryl imines: indole synthesis from anilines and ketones. Journal of the American Chemical Society 136(7) (2014) 2928
Space group: P 21 21 21
Cell volume: 1554.9
Cell parameters: 6.125; 7.74; 32.799; 90; 90; 90;  

COD ID: 4120496
CIF file Formula: - C56 H90 B20 Ir4 N4 O11 -
Comments: Yao, Zi-Jian; Yu, Wei-Bin; Lin, Yue-Jian; Huang, Sheng-Li; Li, Zhen-Hua; Jin, Guo-Xin Iridium-mediated regioselective B-h/c-h activation of carborane cage: a facile synthetic route to metallacycles with a carborane backbone. Journal of the American Chemical Society 136(7) (2014) 2825-2832
Space group: C 1 2/c 1
Cell volume: 19469.1
Cell parameters: 25.9999; 42.8479; 18.1346; 90; 105.488; 90;  

COD ID: 4120497
CIF file Formula: - C32 H59.6 B10 Cl1.8 Ir2 N O4.8 -
Comments: Yao, Zi-Jian; Yu, Wei-Bin; Lin, Yue-Jian; Huang, Sheng-Li; Li, Zhen-Hua; Jin, Guo-Xin Iridium-mediated regioselective B-h/c-h activation of carborane cage: a facile synthetic route to metallacycles with a carborane backbone. Journal of the American Chemical Society 136(7) (2014) 2825-2832
Space group: C 1 2/c 1
Cell volume: 22836
Cell parameters: 53.686; 11.179; 38.356; 90; 97.244; 90;  

COD ID: 4120498
CIF file Formula: - C62 H84 B20 Ir4 N4 O16 -
Comments: Yao, Zi-Jian; Yu, Wei-Bin; Lin, Yue-Jian; Huang, Sheng-Li; Li, Zhen-Hua; Jin, Guo-Xin Iridium-mediated regioselective B-h/c-h activation of carborane cage: a facile synthetic route to metallacycles with a carborane backbone. Journal of the American Chemical Society 136(7) (2014) 2825-2832
Space group: P 1 21/c 1
Cell volume: 4051.6
Cell parameters: 9.0176; 26.3822; 17.607; 90; 104.703; 90;  

COD ID: 4120499
CIF file Formula: - C15 H29 B10 Ir N O3 -
Comments: Yao, Zi-Jian; Yu, Wei-Bin; Lin, Yue-Jian; Huang, Sheng-Li; Li, Zhen-Hua; Jin, Guo-Xin Iridium-mediated regioselective B-h/c-h activation of carborane cage: a facile synthetic route to metallacycles with a carborane backbone. Journal of the American Chemical Society 136(7) (2014) 2825-2832
Space group: P 1 21/c 1
Cell volume: 2185.79
Cell parameters: 8.3463; 28.2369; 10.1409; 90; 113.854; 90;  

COD ID: 4120500
CIF file Formula: - C50 H102 B20 Ir2 N2 O10 -
Comments: Yao, Zi-Jian; Yu, Wei-Bin; Lin, Yue-Jian; Huang, Sheng-Li; Li, Zhen-Hua; Jin, Guo-Xin Iridium-mediated regioselective B-h/c-h activation of carborane cage: a facile synthetic route to metallacycles with a carborane backbone. Journal of the American Chemical Society 136(7) (2014) 2825-2832
Space group: P -1
Cell volume: 1660.6
Cell parameters: 8.8822; 10.1868; 19.2787; 104.059; 100.408; 91.12;  

COD ID: 4120501
CIF file Formula: - C34 H37 B2 F8 Fe N7 O S -
Comments: Widger, Leland R.; Davies, Casey G.; Yang, Tzuhsiung; Siegler, Maxime A.; Troeppner, Oliver; Jameson, Guy N. L.; Ivanović-Burmazović, Ivana; Goldberg, David P. Dramatically Accelerated Selective Oxygen-Atom Transfer by a Nonheme Iron(IV)-Oxo Complex: Tuning of the First and Second Coordination Spheres. Journal of the American Chemical Society 136(7) (2014) 2699-2702
Space group: P -1
Cell volume: 3705
Cell parameters: 12.7152; 17.1863; 17.3225; 89.9635; 81.5135; 81.8096;  

COD ID: 4120502
CIF file Formula: - C66 H71 B4 F16 Fe2 N13 O4 S2 -
Comments: Widger, Leland R.; Davies, Casey G.; Yang, Tzuhsiung; Siegler, Maxime A.; Troeppner, Oliver; Jameson, Guy N. L.; Ivanović-Burmazović, Ivana; Goldberg, David P. Dramatically Accelerated Selective Oxygen-Atom Transfer by a Nonheme Iron(IV)-Oxo Complex: Tuning of the First and Second Coordination Spheres. Journal of the American Chemical Society 136(7) (2014) 2699-2702
Space group: P -1
Cell volume: 1809.49
Cell parameters: 10.1678; 11.9592; 15.8456; 92.0341; 96.166; 108.703;  

COD ID: 4120503
CIF file Formula: - C32 H34 B Cl F4 Fe N6 O S -
Comments: Widger, Leland R.; Davies, Casey G.; Yang, Tzuhsiung; Siegler, Maxime A.; Troeppner, Oliver; Jameson, Guy N. L.; Ivanović-Burmazović, Ivana; Goldberg, David P. Dramatically Accelerated Selective Oxygen-Atom Transfer by a Nonheme Iron(IV)-Oxo Complex: Tuning of the First and Second Coordination Spheres. Journal of the American Chemical Society 136(7) (2014) 2699-2702
Space group: C 1 2/c 1
Cell volume: 6555.99
Cell parameters: 25.4707; 9.98637; 25.8674; 90; 94.8579; 90;  

COD ID: 4120504
CIF file Formula: - C6 H N2 O S4 -
Comments: Wong, Joanne W. L.; Mailman, Aaron; Lekin, Kristina; Winter, Stephen M.; Yong, Wenjun; Zhao, Jianbao; Garimella, Subrahmanyam V.; Tse, John S.; Secco, Richard A.; Desgreniers, Serge; Ohishi, Yasuo; Borondics, Ferenc; Oakley, Richard T. Pressure induced phase transitions and metallization of a neutral radical conductor. Journal of the American Chemical Society 136(3) (2014) 1070-1081
Space group: P b n 21
Cell volume: 675.7
Cell parameters: 13.211; 15.162; 3.3733; 90; 90; 90;  

COD ID: 4120505
CIF file Formula: - C6 H N2 O S4 -
Comments: Wong, Joanne W. L.; Mailman, Aaron; Lekin, Kristina; Winter, Stephen M.; Yong, Wenjun; Zhao, Jianbao; Garimella, Subrahmanyam V.; Tse, John S.; Secco, Richard A.; Desgreniers, Serge; Ohishi, Yasuo; Borondics, Ferenc; Oakley, Richard T. Pressure induced phase transitions and metallization of a neutral radical conductor. Journal of the American Chemical Society 136(3) (2014) 1070-1081
Space group: P b n 21
Cell volume: 627.8
Cell parameters: 12.8799; 14.888; 3.2737; 90; 90; 90;  

COD ID: 4120506
CIF file Formula: - C6 H N2 O S4 -
Comments: Wong, Joanne W. L.; Mailman, Aaron; Lekin, Kristina; Winter, Stephen M.; Yong, Wenjun; Zhao, Jianbao; Garimella, Subrahmanyam V.; Tse, John S.; Secco, Richard A.; Desgreniers, Serge; Ohishi, Yasuo; Borondics, Ferenc; Oakley, Richard T. Pressure induced phase transitions and metallization of a neutral radical conductor. Journal of the American Chemical Society 136(3) (2014) 1070-1081
Space group: P b n 21
Cell volume: 580.5
Cell parameters: 13.001; 14.9086; 2.99495; 90; 90; 90;  

COD ID: 4120507
CIF file Formula: - C6 H N2 O S4 -
Comments: Wong, Joanne W. L.; Mailman, Aaron; Lekin, Kristina; Winter, Stephen M.; Yong, Wenjun; Zhao, Jianbao; Garimella, Subrahmanyam V.; Tse, John S.; Secco, Richard A.; Desgreniers, Serge; Ohishi, Yasuo; Borondics, Ferenc; Oakley, Richard T. Pressure induced phase transitions and metallization of a neutral radical conductor. Journal of the American Chemical Society 136(3) (2014) 1070-1081
Space group: P b n 21
Cell volume: 590.18
Cell parameters: 13.0632; 14.9449; 3.02303; 90; 90; 90;  

COD ID: 4120508
CIF file Formula: - C6 H N2 O S4 -
Comments: Wong, Joanne W. L.; Mailman, Aaron; Lekin, Kristina; Winter, Stephen M.; Yong, Wenjun; Zhao, Jianbao; Garimella, Subrahmanyam V.; Tse, John S.; Secco, Richard A.; Desgreniers, Serge; Ohishi, Yasuo; Borondics, Ferenc; Oakley, Richard T. Pressure induced phase transitions and metallization of a neutral radical conductor. Journal of the American Chemical Society 136(3) (2014) 1070-1081
Space group: P b n 21
Cell volume: 567.92
Cell parameters: 12.9187; 14.8422; 2.96191; 90; 90; 90;  

COD ID: 4120509
CIF file Formula: - C6 H N2 O S4 -
Comments: Wong, Joanne W. L.; Mailman, Aaron; Lekin, Kristina; Winter, Stephen M.; Yong, Wenjun; Zhao, Jianbao; Garimella, Subrahmanyam V.; Tse, John S.; Secco, Richard A.; Desgreniers, Serge; Ohishi, Yasuo; Borondics, Ferenc; Oakley, Richard T. Pressure induced phase transitions and metallization of a neutral radical conductor. Journal of the American Chemical Society 136(3) (2014) 1070-1081
Space group: F d d 2
Cell volume: 2872
Cell parameters: 26.4363; 29.5785; 3.67284; 90; 90; 90;  

COD ID: 4120510
CIF file Formula: - C34 H30 N2 O3 -
Comments: Aihara, Yoshinori; Chatani, Naoto Nickel-Catalyzed Direct Arylation of C(sp(3))-H Bonds in Aliphatic Amides via Bidentate-Chelation Assistance. Journal of the American Chemical Society 136(3) (2014) 898-901
Space group: P 1 21/c 1
Cell volume: 3095.16
Cell parameters: 10.9396; 25.0618; 11.5197; 90; 101.477; 90;  

COD ID: 4120511
CIF file Formula: - C21 H32 O3 Si -
Comments: Shvartsbart, Artem; Smith, 3rd, Amos B Total synthesis of (-)-calyciphylline N. Journal of the American Chemical Society 136(3) (2014) 870-873
Space group: P 21 21 21
Cell volume: 1978.35
Cell parameters: 9.5916; 11.3171; 18.2254; 90; 90; 90;  

COD ID: 4120512
CIF file Formula: - C43 H61 Br Fe P3 -
Comments: Creutz, Sidney E.; Peters, Jonas C. Catalytic Reduction of N2 to NH3 by an Fe-N2 Complex Featuring a C-Atom Anchor. Journal of the American Chemical Society 136(3) (2014) 1105-1115
Space group: P 1 21/c 1
Cell volume: 4004.7
Cell parameters: 12.5154; 15.322; 20.9097; 90; 92.849; 90;  

COD ID: 4120513
CIF file Formula: - C37 H55 Fe N2 P3 -
Comments: Creutz, Sidney E.; Peters, Jonas C. Catalytic Reduction of N2 to NH3 by an Fe-N2 Complex Featuring a C-Atom Anchor. Journal of the American Chemical Society 136(3) (2014) 1105-1115
Space group: P 21 21 21
Cell volume: 3471.05
Cell parameters: 10.8051; 15.4905; 20.738; 90; 90; 90;  

COD ID: 4120514
CIF file Formula: - C37 H54 Fe N2 P3 -
Comments: Creutz, Sidney E.; Peters, Jonas C. Catalytic Reduction of N2 to NH3 by an Fe-N2 Complex Featuring a C-Atom Anchor. Journal of the American Chemical Society 136(3) (2014) 1105-1115
Space group: R -3 :H
Cell volume: 15648
Cell parameters: 19.4069; 19.4069; 47.9751; 90; 90; 120;  

COD ID: 4120515
CIF file Formula: - C49 H84 Fe K N2 O3 P3 -
Comments: Creutz, Sidney E.; Peters, Jonas C. Catalytic Reduction of N2 to NH3 by an Fe-N2 Complex Featuring a C-Atom Anchor. Journal of the American Chemical Society 136(3) (2014) 1105-1115
Space group: C 1 c 1
Cell volume: 5163
Cell parameters: 10.9229; 26.9376; 17.6054; 90; 94.663; 90;  

COD ID: 4120516
CIF file Formula: - C69 H66 B Cl0.12 F24 Fe N1.77 P3 -
Comments: Creutz, Sidney E.; Peters, Jonas C. Catalytic Reduction of N2 to NH3 by an Fe-N2 Complex Featuring a C-Atom Anchor. Journal of the American Chemical Society 136(3) (2014) 1105-1115
Space group: P b c a
Cell volume: 13643.6
Cell parameters: 19.7846; 25.88; 26.6463; 90; 90; 90;  

COD ID: 4120517
CIF file Formula: - C40.5 H59 Fe I2 P3 -
Comments: Creutz, Sidney E.; Peters, Jonas C. Catalytic Reduction of N2 to NH3 by an Fe-N2 Complex Featuring a C-Atom Anchor. Journal of the American Chemical Society 136(3) (2014) 1105-1115
Space group: C 1 2/c 1
Cell volume: 8335.7
Cell parameters: 39.338; 12.186; 18.667; 90; 111.327; 90;  

COD ID: 4120518
CIF file Formula: - C18 H11 F6 N3 -
Comments: Kim, Hyun Jin; Ajitha, Manjaly J.; Lee, Yongjae; Ryu, Jaeyune; Kim, Jin; Lee, Yunho; Jung, Yousung; Chang, Sukbok Hydrogen-Bond-Assisted Controlled C-H Functionalization via Adaptive Recognition of a Purine Directing Group. Journal of the American Chemical Society 136(3) (2014) 1132-1140
Space group: P -1
Cell volume: 824.16
Cell parameters: 8.5123; 9.2231; 11.4204; 87.226; 73.801; 73.29;  

COD ID: 4120519
CIF file Formula: - C24 H28 Cl N4 Rh -
Comments: Kim, Hyun Jin; Ajitha, Manjaly J.; Lee, Yongjae; Ryu, Jaeyune; Kim, Jin; Lee, Yunho; Jung, Yousung; Chang, Sukbok Hydrogen-Bond-Assisted Controlled C-H Functionalization via Adaptive Recognition of a Purine Directing Group. Journal of the American Chemical Society 136(3) (2014) 1132-1140
Space group: P b c a
Cell volume: 4418.8
Cell parameters: 13.2892; 18.1896; 18.2801; 90; 90; 90;  

COD ID: 4120520
CIF file Formula: - C29 H18 F12 N6 -
Comments: Kim, Hyun Jin; Ajitha, Manjaly J.; Lee, Yongjae; Ryu, Jaeyune; Kim, Jin; Lee, Yunho; Jung, Yousung; Chang, Sukbok Hydrogen-Bond-Assisted Controlled C-H Functionalization via Adaptive Recognition of a Purine Directing Group. Journal of the American Chemical Society 136(3) (2014) 1132-1140
Space group: P -1
Cell volume: 1422.74
Cell parameters: 11.3172; 11.5725; 13.2555; 93.226; 106.108; 118.872;  

COD ID: 4120521
CIF file Formula: - C21 H17 F6 N3 -
Comments: Kim, Hyun Jin; Ajitha, Manjaly J.; Lee, Yongjae; Ryu, Jaeyune; Kim, Jin; Lee, Yunho; Jung, Yousung; Chang, Sukbok Hydrogen-Bond-Assisted Controlled C-H Functionalization via Adaptive Recognition of a Purine Directing Group. Journal of the American Chemical Society 136(3) (2014) 1132-1140
Space group: P -1
Cell volume: 965.9
Cell parameters: 9.0095; 10.2547; 11.5131; 92.175; 110.319; 102.609;  

COD ID: 4120522
CIF file Formula: - C20 H18 N6 O2 -
Comments: Kim, Hyun Jin; Ajitha, Manjaly J.; Lee, Yongjae; Ryu, Jaeyune; Kim, Jin; Lee, Yunho; Jung, Yousung; Chang, Sukbok Hydrogen-Bond-Assisted Controlled C-H Functionalization via Adaptive Recognition of a Purine Directing Group. Journal of the American Chemical Society 136(3) (2014) 1132-1140
Space group: P 1 21/c 1
Cell volume: 1792.3
Cell parameters: 12.439; 10.0614; 14.778; 90; 104.288; 90;  

COD ID: 4120523
CIF file Formula: - C32 H50 B Ga N2 O -
Comments: Dettenrieder, Nicole; Schädle, Christoph; Maichle-Mössmer, Cäcilia; Sirsch, Peter; Anwander, Reiner A dimethylgallium boryl complex and its methyllithium addition compound. Journal of the American Chemical Society 136(3) (2014) 886-889
Space group: P 1 21/c 1
Cell volume: 3159.2
Cell parameters: 12.1653; 10.6931; 25.5308; 90; 107.966; 90;  

COD ID: 4120524
CIF file Formula: - C134 H198 B4 Ga4 Li4 N8 -
Comments: Dettenrieder, Nicole; Schädle, Christoph; Maichle-Mössmer, Cäcilia; Sirsch, Peter; Anwander, Reiner A dimethylgallium boryl complex and its methyllithium addition compound. Journal of the American Chemical Society 136(3) (2014) 886-889
Space group: P 1 21/c 1
Cell volume: 6655
Cell parameters: 19.5718; 18.8267; 20.2279; 90; 116.763; 90;  

COD ID: 4120525
CIF file Formula: - C28 H42 B Ga N2 -
Comments: Dettenrieder, Nicole; Schädle, Christoph; Maichle-Mössmer, Cäcilia; Sirsch, Peter; Anwander, Reiner A dimethylgallium boryl complex and its methyllithium addition compound. Journal of the American Chemical Society 136(3) (2014) 886-889
Space group: P b c a
Cell volume: 5609.7
Cell parameters: 18.7239; 14.7354; 20.3319; 90; 90; 90;  

COD ID: 4120526
CIF file Formula: - C16 H16 O4 -
Comments: Correa, Arkaitz; León, Thierry; Martin, Ruben Ni-Catalyzed Carboxylation of C(sp(2))- and C(sp(3))-O Bonds with CO2. Journal of the American Chemical Society 136(3) (2014) 1062-1069
Space group: P 1 21/n 1
Cell volume: 1379.42
Cell parameters: 10.3966; 6.3555; 21.0408; 90; 97.168; 90;  

COD ID: 4120527
CIF file Formula: - C59.5 H74.5 B4 F16 Fe2 N17 O0.5 -
Comments: Kulmaczewski, Rafal; Olguín, Juan; Kitchen, Jonathan A.; Feltham, Humphrey L. C.; Jameson, Guy N. L.; Tallon, Jeffery L.; Brooker, Sally Remarkable Scan Rate Dependence for a Highly Constrained Dinuclear Iron(II) Spin Crossover Complex with a Wide Thermal Hysteresis Loop. Journal of the American Chemical Society 136(3) (2014) 878-881
Space group: C 1 2/c 1
Cell volume: 7062.1
Cell parameters: 16.422; 12.2868; 35.081; 90; 93.898; 90;  

COD ID: 4120528
CIF file Formula: - As2 Ca0.73 Fe Pr0.27 -
Comments: Yakita, Hiroyuki; Ogino, Hiraku; Okada, Tomoyuki; Yamamoto, Akiyasu; Kishio, Kohji; Tohei, Tetsuya; Ikuhara, Yuichi; Gotoh, Yoshito; Fujihisa, Hiroshi; Kataoka, Kunimitsu; Eisaki, Hiroshi; Shimoyama, Jun-Ichi A New Layered Iron Arsenide Superconductor: (Ca,Pr)FeAs2. Journal of the American Chemical Society 136(3) (2014) 846-849
Space group: P 1 21/m 1
Cell volume: 157.28
Cell parameters: 3.9163; 3.8953; 10.311; 90; 90.788; 90;  

COD ID: 4120529
CIF file Formula: - C30 H36 Al Cl3 N4 -
Comments: Chen, Wen-Ching; Lee, Ching-Yu; Lin, Bo-Chao; Hsu, Yu-Chen; Shen, Jiun-Shian; Hsu, Chao-Ping; Yap, Glenn P. A.; Ong, Tiow-Gan The elusive three-coordinate dicationic hydrido boron complex. Journal of the American Chemical Society 136(3) (2014) 914-917
Space group: C 1 2/c 1
Cell volume: 5967.3
Cell parameters: 34.7075; 11.0418; 15.8058; 90; 99.887; 90;  

COD ID: 4120530
CIF file Formula: - C48 H69 B3 Cl4 N8 -
Comments: Chen, Wen-Ching; Lee, Ching-Yu; Lin, Bo-Chao; Hsu, Yu-Chen; Shen, Jiun-Shian; Hsu, Chao-Ping; Yap, Glenn P. A.; Ong, Tiow-Gan The elusive three-coordinate dicationic hydrido boron complex. Journal of the American Chemical Society 136(3) (2014) 914-917
Space group: P c a 21
Cell volume: 5105.69
Cell parameters: 19.9987; 10.2339; 24.9466; 90; 90; 90;  

COD ID: 4120531
CIF file Formula: - C39 H41 Mn N3 P2 -
Comments: Mukhopadhyay, Tufan K.; Flores, Marco; Groy, Thomas L.; Trovitch, Ryan J. A highly active manganese precatalyst for the hydrosilylation of ketones and esters. Journal of the American Chemical Society 136(3) (2014) 882-885
Space group: P -1
Cell volume: 1672.5
Cell parameters: 10.773; 12.341; 14.004; 95.103; 90.505; 115.432;  

COD ID: 4120532
CIF file Formula: - C41 H45 Cl2 Mn N3 O0.5 P2 -
Comments: Mukhopadhyay, Tufan K.; Flores, Marco; Groy, Thomas L.; Trovitch, Ryan J. A highly active manganese precatalyst for the hydrosilylation of ketones and esters. Journal of the American Chemical Society 136(3) (2014) 882-885
Space group: C 1 2/c 1
Cell volume: 7512.2
Cell parameters: 16.954; 12.1473; 37.0711; 90; 100.276; 90;  

COD ID: 4120533
CIF file Formula: - C11 H6 Ag5 F12 O11 -
Comments: Hau, Sam C. K.; Mak, Thomas C. W. Synthesis of Unstable Carbides Ag2C2n (n = 3, 4) and Characterization via Crystallographic Analysis of Their Double Salts with Silver(I) Trifluoroacetate. Journal of the American Chemical Society 136(3) (2014) 902-905
Space group: P 1 21/c 1
Cell volume: 2374.3
Cell parameters: 10.8715; 10.844; 20.3372; 90; 97.983; 90;  

COD ID: 4120534
CIF file Formula: - C170 H150 Ag48 F96 O93 S29 -
Comments: Hau, Sam C. K.; Mak, Thomas C. W. Synthesis of Unstable Carbides Ag2C2n (n = 3, 4) and Characterization via Crystallographic Analysis of Their Double Salts with Silver(I) Trifluoroacetate. Journal of the American Chemical Society 136(3) (2014) 902-905
Space group: P -1
Cell volume: 8097.3
Cell parameters: 15.1244; 22.255; 26.642; 102.224; 97.582; 108.848;  

COD ID: 4120535
CIF file Formula: - C60 H60 Ag15 F30 O30 S10 -
Comments: Hau, Sam C. K.; Mak, Thomas C. W. Synthesis of Unstable Carbides Ag2C2n (n = 3, 4) and Characterization via Crystallographic Analysis of Their Double Salts with Silver(I) Trifluoroacetate. Journal of the American Chemical Society 136(3) (2014) 902-905
Space group: C 1 2/c 1
Cell volume: 20782
Cell parameters: 58.133; 11.8141; 39.378; 90; 129.787; 90;  

COD ID: 4120536
CIF file Formula: - C51 H48 Cl O3 P2 Rh -
Comments: Gellrich, Urs; Meißner, Antje; Steffani, Alberto; Kähny, Matthias; Drexler, Hans-Joachim; Heller, Detlef; Plattner, Dietmar A.; Breit, Bernhard Mechanistic Investigations of the Rhodium Catalyzed Propargylic CH Activation. Journal of the American Chemical Society 136(3) (2014) 1097-1104
Space group: P -1
Cell volume: 2799.1
Cell parameters: 11.0932; 11.1066; 23.295; 84.295; 89.308; 78.559;  

COD ID: 4120537
CIF file Formula: - C18 H19 N O2 S -
Comments: Miura, Tomoya; Funakoshi, Yuuta; Murakami, Masahiro Intramolecular Dearomatizing [3 + 2] Annulation of α-Imino Carbenoids with Aryl Rings Furnishing 3,4-Fused Indole Skeletons. Journal of the American Chemical Society 136(6) (2014) 2272-2275
Space group: P 21 21 21
Cell volume: 1539.99
Cell parameters: 8.0828; 8.9952; 21.181; 90; 90; 90;  

COD ID: 4120538
CIF file Formula: - C28 H34 Au2 Cl2 O2 P2 -
Comments: Cano, Israel; Chapman, Andrew M.; Urakawa, Atsushi; van Leeuwen, Piet W. N. M. Air-stable gold nanoparticles ligated by secondary phosphine oxides for the chemoselective hydrogenation of aldehydes: crucial role of the ligand. Journal of the American Chemical Society 136(6) (2014) 2520-2528
Space group: P 1 21/n 1
Cell volume: 2927.3
Cell parameters: 20.686; 7.1818; 21.924; 90; 116.008; 90;  

COD ID: 4120539
CIF file Formula: - C36 H38 O6 -
Comments: Jin, Xu-Hui; Sheberla, Dennis; Shimon, Linda J. W.; Bendikov, Michael Highly Coplanar Very Long Oligo(alkylfuran)s: A Conjugated System with Specific Head-To-Head Defect. Journal of the American Chemical Society 136(6) (2014) 2592-2601
Space group: P -1
Cell volume: 1506.9
Cell parameters: 8.2211; 7.344; 25.041; 90.015; 94.66; 90.01;  

COD ID: 4120540
CIF file Formula: - C18 H20 Br N O3 -
Comments: Liu, Honglei; Wu, Yang; Zhao, Yan; Li, Zhen; Zhang, Lei; Yang, Wenjun; Jiang, Hui; Jing, Chengfeng; Yu, Hao; Wang, Bo; Xiao, Yumei; Guo, Hongchao Metal-catalyzed [6 + 3] cycloaddition of tropone with azomethine ylides: a practical access to piperidine-fused bicyclic heterocycles. Journal of the American Chemical Society 136(6) (2014) 2625-2629
Space group: P 21 21 21
Cell volume: 1658.5
Cell parameters: 7.1757; 8.249; 28.018; 90; 90; 90;  

COD ID: 4120541
CIF file Formula: - C19 H19 Cu N3 O3 -
Comments: Tran, Ba L.; Li, Bijie; Driess, Matthias; Hartwig, John F. Copper-catalyzed intermolecular amidation and imidation of unactivated alkanes. Journal of the American Chemical Society 136(6) (2014) 2555-2563
Space group: P 1 21/c 1
Cell volume: 1760.73
Cell parameters: 9.3032; 12.789; 14.7995; 90; 89.401; 90;  

COD ID: 4120542
CIF file Formula: - C20 H24 Cu N3 O3 S -
Comments: Tran, Ba L.; Li, Bijie; Driess, Matthias; Hartwig, John F. Copper-catalyzed intermolecular amidation and imidation of unactivated alkanes. Journal of the American Chemical Society 136(6) (2014) 2555-2563
Space group: P 1 21/a 1
Cell volume: 1984.7
Cell parameters: 9.7344; 16.996; 12.836; 90; 110.84; 90;  

COD ID: 4120543
CIF file Formula: - C36 H28 Cu2 N6 O4 S2 -
Comments: Tran, Ba L.; Li, Bijie; Driess, Matthias; Hartwig, John F. Copper-catalyzed intermolecular amidation and imidation of unactivated alkanes. Journal of the American Chemical Society 136(6) (2014) 2555-2563
Space group: C 1 2/c 1
Cell volume: 3294.2
Cell parameters: 22.361; 11.0125; 13.8061; 90; 104.314; 90;  

COD ID: 4120544
CIF file Formula: - C28 H16 Cu N4 O4 -
Comments: Tran, Ba L.; Li, Bijie; Driess, Matthias; Hartwig, John F. Copper-catalyzed intermolecular amidation and imidation of unactivated alkanes. Journal of the American Chemical Society 136(6) (2014) 2555-2563
Space group: P -1
Cell volume: 1126.58
Cell parameters: 10.7048; 10.895; 11.5387; 80.925; 68.386; 64.219;  

COD ID: 4120545
CIF file Formula: - C115 H103 Cl45 I2 N6 O16 -
Comments: Pochorovski, Igor; Knehans, Tim; Nettels, Daniel; Müller, Astrid M; Schweizer, W. Bernd; Caflisch, Amedeo; Schuler, Benjamin; Diederich, François Experimental and Computational Study of BODIPY Dye-Labeled Cavitand Dynamics. Journal of the American Chemical Society 136(6) (2014) 2441-2449
Space group: P 1 21/n 1
Cell volume: 29696
Cell parameters: 27.741; 29.059; 38.382; 90; 106.309; 90;  

COD ID: 4120546
CIF file Formula: - C84 H112 S6 -
Comments: Iyoda, Masahiko; Tanaka, Keita; Shimizu, Hideyuki; Hasegawa, Masashi; Nishinaga, Tohru; Nishiuchi, Tomohiko; Kunugi, Yoshihito; Ishida, Takayuki; Otani, Hiroyuki; Sato, Hiroyasu; Inukai, Koji; Tahara, Kazukuni; Tobe, Yoshito Multifunctional π-Expanded Macrocyclic Oligothiophene 6-Mers and Related Macrocyclic Oligomers. Journal of the American Chemical Society 136(6) (2014) 2389-2396
Space group: P 1 21/c 1
Cell volume: 3821
Cell parameters: 13.769; 18.431; 16.014; 90; 109.913; 90;  

COD ID: 4120547
CIF file Formula: - C90 H118 S6 -
Comments: Iyoda, Masahiko; Tanaka, Keita; Shimizu, Hideyuki; Hasegawa, Masashi; Nishinaga, Tohru; Nishiuchi, Tomohiko; Kunugi, Yoshihito; Ishida, Takayuki; Otani, Hiroyuki; Sato, Hiroyasu; Inukai, Koji; Tahara, Kazukuni; Tobe, Yoshito Multifunctional π-Expanded Macrocyclic Oligothiophene 6-Mers and Related Macrocyclic Oligomers. Journal of the American Chemical Society 136(6) (2014) 2389-2396
Space group: P -1
Cell volume: 2118.2
Cell parameters: 13.536; 13.731; 13.837; 117.032; 106.648; 95.35;  

COD ID: 4120548
CIF file Formula: - C126 H168 S9 -
Comments: Iyoda, Masahiko; Tanaka, Keita; Shimizu, Hideyuki; Hasegawa, Masashi; Nishinaga, Tohru; Nishiuchi, Tomohiko; Kunugi, Yoshihito; Ishida, Takayuki; Otani, Hiroyuki; Sato, Hiroyasu; Inukai, Koji; Tahara, Kazukuni; Tobe, Yoshito Multifunctional π-Expanded Macrocyclic Oligothiophene 6-Mers and Related Macrocyclic Oligomers. Journal of the American Chemical Society 136(6) (2014) 2389-2396
Space group: P -1
Cell volume: 5835.2
Cell parameters: 14.5307; 16.0648; 26.561; 99.03; 90.771; 107.277;  

COD ID: 4120549
CIF file Formula: - C28 H32 F6 N2 O3 Rh S Sb -
Comments: Park, Sae Hume; Kwak, Jaesung; Shin, Kwangmin; Ryu, Jaeyune; Park, Yoonsu; Chang, Sukbok Mechanistic studies of the rhodium-catalyzed direct C-h amination reaction using azides as the nitrogen source. Journal of the American Chemical Society 136(6) (2014) 2492-2502
Space group: P 1 21/n 1
Cell volume: 3093
Cell parameters: 8.9637; 23.4452; 14.728; 90; 92.17; 90;  

COD ID: 4120550
CIF file Formula: - C30 H36 Cl2 F6 N2 O4 Rh S Sb -
Comments: Park, Sae Hume; Kwak, Jaesung; Shin, Kwangmin; Ryu, Jaeyune; Park, Yoonsu; Chang, Sukbok Mechanistic studies of the rhodium-catalyzed direct C-h amination reaction using azides as the nitrogen source. Journal of the American Chemical Society 136(6) (2014) 2492-2502
Space group: C 1 2/c 1
Cell volume: 6989.1
Cell parameters: 24.728; 10.6883; 28.583; 90; 112.307; 90;  

COD ID: 4120551
CIF file Formula: - Al Ba N5 O3 Si4 -
Comments: Park, Woon Bae; Singh, Satendra Pal; Sohn, Kee-Sun Discovery of a phosphor for light emitting diode applications and its structural determination, ba(si,al)5(o,n)8:eu(2+). Journal of the American Chemical Society 136(6) (2014) 2363-2373
Space group: A 21 a m
Cell volume: 737.681
Cell parameters: 9.48461; 13.47194; 5.773234; 90; 90; 90;  

COD ID: 4120552
CIF file Formula: - Al2 Ba N4 O4 Si3 -
Comments: Park, Woon Bae; Singh, Satendra Pal; Sohn, Kee-Sun Discovery of a phosphor for light emitting diode applications and its structural determination, ba(si,al)5(o,n)8:eu(2+). Journal of the American Chemical Society 136(6) (2014) 2363-2373
Space group: A 21 a m
Cell volume: 735.704
Cell parameters: 9.47791; 13.45426; 5.7694; 90; 90; 90;  

COD ID: 4120553
CIF file Formula: - C9 H13 N3 O4 -
Comments: Blain, J. Craig; Ricardo, Alonso; Szostak, Jack W. Synthesis and Nonenzymatic Template-Directed Polymerization of 2'-Amino-2'-deoxythreose Nucleotides. Journal of the American Chemical Society 136(5) (2014) 2033-2039
Space group: P 1 21 1
Cell volume: 1010.55
Cell parameters: 11.345; 5.1744; 17.219; 90; 91.318; 90;  

COD ID: 4120554
CIF file Formula: - C9 H12 N6 O3 -
Comments: Blain, J. Craig; Ricardo, Alonso; Szostak, Jack W. Synthesis and Nonenzymatic Template-Directed Polymerization of 2'-Amino-2'-deoxythreose Nucleotides. Journal of the American Chemical Society 136(5) (2014) 2033-2039
Space group: P 21 21 21
Cell volume: 1071.9
Cell parameters: 7.8864; 11.2704; 12.0597; 90; 90; 90;  

COD ID: 4120555
CIF file Formula: - C3 H12 Br4 N2 Pb -
Comments: Dohner, Emma R.; Hoke, Eric T.; Karunadasa, Hemamala I. Self-assembly of broadband white-light emitters. Journal of the American Chemical Society 136(5) (2014) 1718-1721
Space group: P 21 21 21
Cell volume: 1210.77
Cell parameters: 6.0761; 8.3926; 23.7433; 90; 90; 90;  

COD ID: 4120556
CIF file Formula: - C4 H14 Br4 N2 Pb -
Comments: Dohner, Emma R.; Hoke, Eric T.; Karunadasa, Hemamala I. Self-assembly of broadband white-light emitters. Journal of the American Chemical Society 136(5) (2014) 1718-1721
Space group: P 1 21/c 1
Cell volume: 1362.45
Cell parameters: 8.3162; 8.3161; 20.1181; 90; 101.695; 90;  

COD ID: 4120557
CIF file Formula: - C126 H156 F28 N44.56 O91.35 Pd6 -
Comments: Takezawa, Hiroki; Murase, Takashi; Resnati, Giuseppe; Metrangolo, Pierangelo; Fujita, Makoto Recognition of polyfluorinated compounds through self-aggregation in a cavity. Journal of the American Chemical Society 136(5) (2014) 1786-1788
Space group: I 41/a :2
Cell volume: 22178
Cell parameters: 26.374; 26.374; 31.884; 90; 90; 90;  

COD ID: 4120558
CIF file Formula: - C124.8 H152.4 F8.4 N45.48 O85.02 Pd6 -
Comments: Takezawa, Hiroki; Murase, Takashi; Resnati, Giuseppe; Metrangolo, Pierangelo; Fujita, Makoto Recognition of polyfluorinated compounds through self-aggregation in a cavity. Journal of the American Chemical Society 136(5) (2014) 1786-1788
Space group: I 41/a :2
Cell volume: 21648
Cell parameters: 26.059; 26.059; 31.879; 90; 90; 90;  

COD ID: 4120559
CIF file Formula: - C126.8 H144 F16.78 N45.92 O78.76 Pd6 -
Comments: Takezawa, Hiroki; Murase, Takashi; Resnati, Giuseppe; Metrangolo, Pierangelo; Fujita, Makoto Recognition of polyfluorinated compounds through self-aggregation in a cavity. Journal of the American Chemical Society 136(5) (2014) 1786-1788
Space group: I 41/a :2
Cell volume: 21344
Cell parameters: 26.037; 26.037; 31.484; 90; 90; 90;  

COD ID: 4120560
CIF file Formula: - C256 H310.7 F56 N90.79 O173.83 Pd12 -
Comments: Takezawa, Hiroki; Murase, Takashi; Resnati, Giuseppe; Metrangolo, Pierangelo; Fujita, Makoto Recognition of polyfluorinated compounds through self-aggregation in a cavity. Journal of the American Chemical Society 136(5) (2014) 1786-1788
Space group: P -1
Cell volume: 10907
Cell parameters: 24.284; 24.306; 24.636; 115.99; 90.625; 119.371;  

COD ID: 4120561
CIF file Formula: - C268 H288 F40 N91.25 O168.2 Pd12 -
Comments: Takezawa, Hiroki; Murase, Takashi; Resnati, Giuseppe; Metrangolo, Pierangelo; Fujita, Makoto Recognition of polyfluorinated compounds through self-aggregation in a cavity. Journal of the American Chemical Society 136(5) (2014) 1786-1788
Space group: I 41/a :2
Cell volume: 21310
Cell parameters: 25.941; 25.941; 31.667; 90; 90; 90;  

COD ID: 4120562
CIF file Formula: - C132 H146.72 F20 N48.09 O85.32 Pd6 -
Comments: Takezawa, Hiroki; Murase, Takashi; Resnati, Giuseppe; Metrangolo, Pierangelo; Fujita, Makoto Recognition of polyfluorinated compounds through self-aggregation in a cavity. Journal of the American Chemical Society 136(5) (2014) 1786-1788
Space group: I 41/a :2
Cell volume: 21250
Cell parameters: 25.93; 25.93; 31.605; 90; 90; 90;  

COD ID: 4120563
CIF file Formula: - C16 H17 Br O3 -
Comments: Gao, Fang; Carr, James L.; Hoveyda, Amir H. A Broadly Applicable NHC-Cu-Catalyzed Approach for Efficient, Site-, and Enantioselective Coupling of Readily Accessible (Pinacolato)alkenylboron Compounds to Allylic Phosphates and Applications to Natural Product Synthesis. Journal of the American Chemical Society 136(5) (2014) 2149-2161
Space group: P 21 21 21
Cell volume: 1458.54
Cell parameters: 6.159; 9.1136; 25.9848; 90; 90; 90;  

COD ID: 4120564
CIF file Formula: - C51.5 H74 Co2 F3 N2 O3 S -
Comments: Mondal, Kartik Chandra; Samuel, Prinson P.; Roesky, Herbert W.; Carl, Elena; Herbst-Irmer, Regine; Stalke, Dietmar; Schwederski, Brigitte; Kaim, Wolfgang; Ungur, Liviu; Chibotaru, Liviu F.; Hermann, Markus; Frenking, Gernot Stabilization of a cobalt-cobalt bond by two cyclic alkyl amino carbenes. Journal of the American Chemical Society 136(5) (2014) 1770-1773
Space group: P 1 21/n 1
Cell volume: 4828.8
Cell parameters: 21.385; 10.513; 22.532; 90; 107.59; 90;  

COD ID: 4120565
CIF file Formula: - C64 H102 Cl6 Co2 Li N3 O -
Comments: Mondal, Kartik Chandra; Samuel, Prinson P.; Roesky, Herbert W.; Carl, Elena; Herbst-Irmer, Regine; Stalke, Dietmar; Schwederski, Brigitte; Kaim, Wolfgang; Ungur, Liviu; Chibotaru, Liviu F.; Hermann, Markus; Frenking, Gernot Stabilization of a cobalt-cobalt bond by two cyclic alkyl amino carbenes. Journal of the American Chemical Society 136(5) (2014) 1770-1773
Space group: P -4
Cell volume: 6766.6
Cell parameters: 25.322; 25.322; 10.553; 90; 90; 90;  

COD ID: 4120566
CIF file Formula: - C24 H40 Cl3 Co N O -
Comments: Mondal, Kartik Chandra; Samuel, Prinson P.; Roesky, Herbert W.; Carl, Elena; Herbst-Irmer, Regine; Stalke, Dietmar; Schwederski, Brigitte; Kaim, Wolfgang; Ungur, Liviu; Chibotaru, Liviu F.; Hermann, Markus; Frenking, Gernot Stabilization of a cobalt-cobalt bond by two cyclic alkyl amino carbenes. Journal of the American Chemical Society 136(5) (2014) 1770-1773
Space group: P -1
Cell volume: 2708.5
Cell parameters: 12.818; 14.301; 15.849; 90.11; 99.65; 108.68;  

COD ID: 4120567
CIF file Formula: - C47 H70 Cl Co N2 -
Comments: Mondal, Kartik Chandra; Samuel, Prinson P.; Roesky, Herbert W.; Carl, Elena; Herbst-Irmer, Regine; Stalke, Dietmar; Schwederski, Brigitte; Kaim, Wolfgang; Ungur, Liviu; Chibotaru, Liviu F.; Hermann, Markus; Frenking, Gernot Stabilization of a cobalt-cobalt bond by two cyclic alkyl amino carbenes. Journal of the American Chemical Society 136(5) (2014) 1770-1773
Space group: P -1
Cell volume: 2093.8
Cell parameters: 9.683; 11.794; 19.932; 104.34; 95.28; 105.55;  

COD ID: 4120568
CIF file Formula: - C47 H70 Co2 N2 -
Comments: Mondal, Kartik Chandra; Samuel, Prinson P.; Roesky, Herbert W.; Carl, Elena; Herbst-Irmer, Regine; Stalke, Dietmar; Schwederski, Brigitte; Kaim, Wolfgang; Ungur, Liviu; Chibotaru, Liviu F.; Hermann, Markus; Frenking, Gernot Stabilization of a cobalt-cobalt bond by two cyclic alkyl amino carbenes. Journal of the American Chemical Society 136(5) (2014) 1770-1773
Space group: P n a 21
Cell volume: 4102.4
Cell parameters: 22.773; 10.794; 16.689; 90; 90; 90;  

COD ID: 4120569
CIF file Formula: - C40 H64 Cl4 Co N2 -
Comments: Mondal, Kartik Chandra; Samuel, Prinson P.; Roesky, Herbert W.; Carl, Elena; Herbst-Irmer, Regine; Stalke, Dietmar; Schwederski, Brigitte; Kaim, Wolfgang; Ungur, Liviu; Chibotaru, Liviu F.; Hermann, Markus; Frenking, Gernot Stabilization of a cobalt-cobalt bond by two cyclic alkyl amino carbenes. Journal of the American Chemical Society 136(5) (2014) 1770-1773
Space group: P 21 21 21
Cell volume: 4173.4
Cell parameters: 10.02; 14.726; 28.284; 90; 90; 90;  

COD ID: 4120570
CIF file Formula: - C14 H15 Cl F3 N3 O3 Pt S -
Comments: Johnstone, Timothy C.; Lippard, Stephen J. The chiral potential of phenanthriplatin and its influence on Guanine binding. Journal of the American Chemical Society 136(5) (2014) 2126-2134
Space group: P b c a
Cell volume: 3671.3
Cell parameters: 12.87; 9.8433; 28.98; 90; 90; 90;  

COD ID: 4120571
CIF file Formula: - C23.5 H28 F6 N8 O8 Pt S2 -
Comments: Johnstone, Timothy C.; Lippard, Stephen J. The chiral potential of phenanthriplatin and its influence on Guanine binding. Journal of the American Chemical Society 136(5) (2014) 2126-2134
Space group: C 1 2/c 1
Cell volume: 6962.2
Cell parameters: 22.1704; 12.2581; 27.389; 90; 110.716; 90;  

COD ID: 4120572
CIF file Formula: - C6 H11 Cl F3 N3 O3 Pt S -
Comments: Johnstone, Timothy C.; Lippard, Stephen J. The chiral potential of phenanthriplatin and its influence on Guanine binding. Journal of the American Chemical Society 136(5) (2014) 2126-2134
Space group: P 1 21/c 1
Cell volume: 1334.16
Cell parameters: 11.8226; 4.9998; 23.0652; 90; 101.888; 90;  

COD ID: 4120573
CIF file Formula: - C13 H18 F6 N8 O7 Pt S2 -
Comments: Johnstone, Timothy C.; Lippard, Stephen J. The chiral potential of phenanthriplatin and its influence on Guanine binding. Journal of the American Chemical Society 136(5) (2014) 2126-2134
Space group: C 1 2/c 1
Cell volume: 5433.5
Cell parameters: 24.6325; 11.4033; 19.3606; 90; 92.399; 90;  

COD ID: 4120574
CIF file Formula: - C10 H10 Cl2 N2 Pt -
Comments: Johnstone, Timothy C.; Lippard, Stephen J. The chiral potential of phenanthriplatin and its influence on Guanine binding. Journal of the American Chemical Society 136(5) (2014) 2126-2134
Space group: P -1
Cell volume: 284.48
Cell parameters: 5.4655; 6.9612; 7.6303; 79.842; 84.579; 89.123;  

COD ID: 4120575
CIF file Formula: - C252 H332 Cl2 N10 O76 Rh2 -
Comments: Masai, Hiroshi; Terao, Jun; Seki, Shu; Nakashima, Shigeto; Kiguchi, Manabu; Okoshi, Kento; Fujihara, Tetsuaki; Tsuji, Yasushi Synthesis of One-Dimensional Metal-Containing Insulated Molecular Wire with Versatile Properties Directed toward Molecular Electronics Materials. Journal of the American Chemical Society 136(5) (2014) 1742-1745
Space group: P 1
Cell volume: 7694.9
Cell parameters: 16.7722; 20.9797; 23.1866; 89.038; 72.648; 81.321;  

COD ID: 4120576
CIF file Formula: - C11 H13 N O5 S -
Comments: Zhu, Haitao; Chen, Pinhong; Liu, Guosheng Pd-catalyzed intramolecular aminohydroxylation of alkenes with hydrogen peroxide as oxidant and water as nucleophile. Journal of the American Chemical Society 136(5) (2014) 1766-1769
Space group: P 1 21/n 1
Cell volume: 1205.7
Cell parameters: 9.9374; 10.7588; 11.9358; 90; 109.122; 90;  

COD ID: 4120577
CIF file Formula: - C22 H22 N4 O4 -
Comments: Sebaoun, Laure; Maurizot, Victor; Granier, Thierry; Kauffmann, Brice; Huc, Ivan Aromatic Oligoamide β-Sheet Foldamers. Journal of the American Chemical Society 136(5) (2014) 2168-2174
Space group: P -1
Cell volume: 2093.8
Cell parameters: 11.9493; 13.2285; 15.9117; 103.066; 112.628; 104.644;  

COD ID: 4120578
CIF file Formula: - C78 H90 N12 O17 -
Comments: Sebaoun, Laure; Maurizot, Victor; Granier, Thierry; Kauffmann, Brice; Huc, Ivan Aromatic Oligoamide β-Sheet Foldamers. Journal of the American Chemical Society 136(5) (2014) 2168-2174
Space group: P 1 21/n 1
Cell volume: 9128
Cell parameters: 13.922; 22.269; 30.117; 90; 102.16; 90;  

COD ID: 4120579
CIF file Formula: - C87 H101 Cl6 N12 O20 S -
Comments: Sebaoun, Laure; Maurizot, Victor; Granier, Thierry; Kauffmann, Brice; Huc, Ivan Aromatic Oligoamide β-Sheet Foldamers. Journal of the American Chemical Society 136(5) (2014) 2168-2174
Space group: P -1
Cell volume: 4609.1
Cell parameters: 15.248; 16.89; 19.555; 85.29; 67.3; 83.12;  

COD ID: 4120580
CIF file Formula: - C94 H106 Cl12 N12 O22 -
Comments: Sebaoun, Laure; Maurizot, Victor; Granier, Thierry; Kauffmann, Brice; Huc, Ivan Aromatic Oligoamide β-Sheet Foldamers. Journal of the American Chemical Society 136(5) (2014) 2168-2174
Space group: P -1
Cell volume: 2600
Cell parameters: 12.784; 14.385; 15.914; 112.032; 99.694; 98.655;  

COD ID: 4120581
CIF file Formula: - C12 H8.5 N3.5 O5 -
Comments: Sebaoun, Laure; Maurizot, Victor; Granier, Thierry; Kauffmann, Brice; Huc, Ivan Aromatic Oligoamide β-Sheet Foldamers. Journal of the American Chemical Society 136(5) (2014) 2168-2174
Space group: P n m a
Cell volume: 2433.7
Cell parameters: 15.984; 16.622; 9.16; 90; 90; 90;  

COD ID: 4120582
CIF file Formula: - C30 H38 N6 O9 -
Comments: Sebaoun, Laure; Maurizot, Victor; Granier, Thierry; Kauffmann, Brice; Huc, Ivan Aromatic Oligoamide β-Sheet Foldamers. Journal of the American Chemical Society 136(5) (2014) 2168-2174
Space group: P -1
Cell volume: 1655.9
Cell parameters: 7.442; 12.755; 18.706; 74.31; 82.691; 76.12;  

COD ID: 4120583
CIF file Formula: - C21.5 H21 N4 O4.5 -
Comments: Sebaoun, Laure; Maurizot, Victor; Granier, Thierry; Kauffmann, Brice; Huc, Ivan Aromatic Oligoamide β-Sheet Foldamers. Journal of the American Chemical Society 136(5) (2014) 2168-2174
Space group: P -1
Cell volume: 1010.3
Cell parameters: 7.477; 11.703; 12.598; 73.99; 74.91; 77.42;  

COD ID: 4120584
CIF file Formula: - C33 H41 Cl3 N6 O8 -
Comments: Sebaoun, Laure; Maurizot, Victor; Granier, Thierry; Kauffmann, Brice; Huc, Ivan Aromatic Oligoamide β-Sheet Foldamers. Journal of the American Chemical Society 136(5) (2014) 2168-2174
Space group: P -1
Cell volume: 3845.6
Cell parameters: 13.057; 16.5987; 20.386; 71.835; 87.525; 66.901;  

COD ID: 4120585
CIF file Formula: - C40 H46 N6 O9 -
Comments: Sebaoun, Laure; Maurizot, Victor; Granier, Thierry; Kauffmann, Brice; Huc, Ivan Aromatic Oligoamide β-Sheet Foldamers. Journal of the American Chemical Society 136(5) (2014) 2168-2174
Space group: P 1 21/c 1
Cell volume: 7871
Cell parameters: 21.202; 15.209; 24.506; 90; 95.07; 90;  

COD ID: 4120586
CIF file Formula: - C20 H16 N6 O9 -
Comments: Sebaoun, Laure; Maurizot, Victor; Granier, Thierry; Kauffmann, Brice; Huc, Ivan Aromatic Oligoamide β-Sheet Foldamers. Journal of the American Chemical Society 136(5) (2014) 2168-2174
Space group: P 1 21/n 1
Cell volume: 2084.9
Cell parameters: 7.434; 21.865; 12.827; 90; 90.51; 90;  

COD ID: 4120587
CIF file Formula: - C23 H38 N3 O6 -
Comments: Carney, Daniel W.; Schmitz, Karl R.; Truong, Jonathan V.; Sauer, Robert T.; Sello, Jason K. Restriction of the conformational dynamics of the cyclic acyldepsipeptide antibiotics improves their antibacterial activity. Journal of the American Chemical Society 136(5) (2014) 1922-1929
Space group: P 21 21 21
Cell volume: 2526.6
Cell parameters: 10.1948; 11.7506; 21.0907; 90; 90; 90;  

COD ID: 4120588
CIF file Formula: - C21 H34 N3 O6 -
Comments: Carney, Daniel W.; Schmitz, Karl R.; Truong, Jonathan V.; Sauer, Robert T.; Sello, Jason K. Restriction of the conformational dynamics of the cyclic acyldepsipeptide antibiotics improves their antibacterial activity. Journal of the American Chemical Society 136(5) (2014) 1922-1929
Space group: P 21 21 21
Cell volume: 2375
Cell parameters: 10.083; 11.513; 20.46; 90; 90; 90;  

COD ID: 4120589
CIF file Formula: - C48 H27 N0 O16 Zn4 -
Comments: Mo, Ke; Yang, Yuhua; Cui, Yong A homochiral metal-organic framework as an effective asymmetric catalyst for cyanohydrin synthesis. Journal of the American Chemical Society 136(5) (2014) 1746-1749
Space group: I 21 3
Cell volume: 24055
Cell parameters: 28.867; 28.867; 28.867; 90; 90; 90;  

COD ID: 4120590
CIF file Formula: - C12 H16 Cu4 N4 O8 -
Comments: Do, Hien-Quang; Bachman, Shoshana; Bissember, Alex C.; Peters, Jonas C.; Fu, Gregory C. Photoinduced, copper-catalyzed alkylation of amides with unactivated secondary alkyl halides at room temperature. Journal of the American Chemical Society 136(5) (2014) 2162-2167
Space group: I -4 2 d
Cell volume: 7028.4
Cell parameters: 12.2871; 12.2871; 46.554; 90; 90; 90;  

COD ID: 4120591
CIF file Formula: - C35 H32 I2 N2 Ni O -
Comments: Wiedemann, Thomas; Voit, Gregor; Tchernook, Alexandra; Roesle, Philipp; Göttker-Schnetmann, Inigo; Mecking, Stefan Monofunctional hyperbranched ethylene oligomers. Journal of the American Chemical Society 136(5) (2014) 2078-2085
Space group: P 1 21/c 1
Cell volume: 3191.8
Cell parameters: 11.1038; 16.6839; 18.0283; 90; 107.125; 90;  

COD ID: 4120592
CIF file Formula: - C63 H35 B2 F30 O2 P -
Comments: Xu, Tieqi; Chen, Eugene Y.-X. Probing site cooperativity of frustrated phosphine/borane lewis pairs by a polymerization study. Journal of the American Chemical Society 136(5) (2014) 1774-1777
Space group: P 1 21/c 1
Cell volume: 5925.1
Cell parameters: 12.4874; 14.509; 32.8803; 90; 95.954; 90;  

COD ID: 4120593
CIF file Formula: - C22 H16 Au I2 P -
Comments: Guenther, Johannes; Mallet-Ladeira, Sonia; Estevez, Laura; Miqueu, Karinne; Amgoune, Abderrahmane; Bourissou, Didier Activation of Aryl Halides at Gold(I): Practical Synthesis of (P,C) Cyclometalated Gold(III) Complexes. Journal of the American Chemical Society 136(5) (2014) 1778-1781
Space group: P 1 21/c 1
Cell volume: 2088.06
Cell parameters: 15.3537; 9.0513; 16.4471; 90; 114; 90;  

COD ID: 4120594
CIF file Formula: - C32 H27 Au Br2 P2 -
Comments: Guenther, Johannes; Mallet-Ladeira, Sonia; Estevez, Laura; Miqueu, Karinne; Amgoune, Abderrahmane; Bourissou, Didier Activation of Aryl Halides at Gold(I): Practical Synthesis of (P,C) Cyclometalated Gold(III) Complexes. Journal of the American Chemical Society 136(5) (2014) 1778-1781
Space group: P 1 21/c 1
Cell volume: 2865.6
Cell parameters: 15.6992; 11.3526; 16.8558; 90; 107.469; 90;  

COD ID: 4120595
CIF file Formula: - C22 H16 Au Cl2 P -
Comments: Guenther, Johannes; Mallet-Ladeira, Sonia; Estevez, Laura; Miqueu, Karinne; Amgoune, Abderrahmane; Bourissou, Didier Activation of Aryl Halides at Gold(I): Practical Synthesis of (P,C) Cyclometalated Gold(III) Complexes. Journal of the American Chemical Society 136(5) (2014) 1778-1781
Space group: P 1 21/n 1
Cell volume: 5923.3
Cell parameters: 8.6523; 45.28; 15.178; 90; 95.053; 90;  

COD ID: 4120596
CIF file Formula: - C28 H46 Cl2 Fe N4 O6 P2 -
Comments: Klepser, Benjamin M.; Bartlett, Bart M. Anchoring a Molecular Iron Catalyst to Solar-Responsive WO3 Improves the Rate and Selectivity of Photoelectrochemical Water Oxidation. Journal of the American Chemical Society 136(5) (2014) 1694-1697
Space group: P 1 21/n 1
Cell volume: 3328.7
Cell parameters: 15.8638; 11.7729; 18.0265; 90; 98.615; 90;  

COD ID: 4120597
CIF file Formula: - C101 H103 D16 N15 O13 Pd Pt -
Comments: Beves, Jonathon E.; Blanco, Victor; Blight, Barry A.; Carrillo, Romen; D'Souza, Daniel M; Howgego, David; Leigh, David A.; Slawin, Alexandra M. Z.; Symes, Mark D. Toward Metal Complexes That Can Directionally Walk Along Tracks: Controlled Stepping of a Molecular Biped with a Palladium(II) Foot. Journal of the American Chemical Society 136(5) (2014) 2094-2100
Space group: P -1
Cell volume: 5064
Cell parameters: 14.238; 18.939; 19.681; 104.533; 96.912; 94.763;  

COD ID: 4120598
CIF file Formula: - C21 H24 Cl Co1.04 Fe0.96 N7 -
Comments: Tereniak, Stephen J.; Carlson, Rebecca K.; Clouston, Laura J.; Young, Jr, Victor G; Bill, Eckhard; Maurice, Rémi; Chen, Yu-Sheng; Kim, Hyun Jung; Gagliardi, Laura; Lu, Connie C. Role of the metal in the bonding and properties of bimetallic complexes involving manganese, iron, and cobalt. Journal of the American Chemical Society 136(5) (2014) 1842-1855
Space group: P 1 21/n 1
Cell volume: 2120.4
Cell parameters: 9.245; 12.5597; 18.4751; 90; 98.724; 90;  

COD ID: 4120599
CIF file Formula: - C21 H24 Cl Co0.998 Mn1.002 N7 -
Comments: Tereniak, Stephen J.; Carlson, Rebecca K.; Clouston, Laura J.; Young, Jr, Victor G; Bill, Eckhard; Maurice, Rémi; Chen, Yu-Sheng; Kim, Hyun Jung; Gagliardi, Laura; Lu, Connie C. Role of the metal in the bonding and properties of bimetallic complexes involving manganese, iron, and cobalt. Journal of the American Chemical Society 136(5) (2014) 1842-1855
Space group: P 1 21/n 1
Cell volume: 2120.4
Cell parameters: 9.3012; 12.4519; 18.5177; 90; 98.632; 90;  

COD ID: 4120600
CIF file Formula: - C21 H24 Cl Fe0.955 Mn1.05 N7 -
Comments: Tereniak, Stephen J.; Carlson, Rebecca K.; Clouston, Laura J.; Young, Jr, Victor G; Bill, Eckhard; Maurice, Rémi; Chen, Yu-Sheng; Kim, Hyun Jung; Gagliardi, Laura; Lu, Connie C. Role of the metal in the bonding and properties of bimetallic complexes involving manganese, iron, and cobalt. Journal of the American Chemical Society 136(5) (2014) 1842-1855
Space group: P 1 21/n 1
Cell volume: 2126.1
Cell parameters: 9.3327; 12.4574; 18.4915; 90; 98.5268; 90;  

COD ID: 4120601
CIF file Formula: - C21 H24 Cl Co2 N7 -
Comments: Tereniak, Stephen J.; Carlson, Rebecca K.; Clouston, Laura J.; Young, Jr, Victor G; Bill, Eckhard; Maurice, Rémi; Chen, Yu-Sheng; Kim, Hyun Jung; Gagliardi, Laura; Lu, Connie C. Role of the metal in the bonding and properties of bimetallic complexes involving manganese, iron, and cobalt. Journal of the American Chemical Society 136(5) (2014) 1842-1855
Space group: P 21 21 21
Cell volume: 2128.7
Cell parameters: 9.5866; 14.8453; 14.9574; 90; 90; 90;  

COD ID: 4120602
CIF file Formula: - C21 H24 Cl Co Fe N7 -
Comments: Tereniak, Stephen J.; Carlson, Rebecca K.; Clouston, Laura J.; Young, Jr, Victor G; Bill, Eckhard; Maurice, Rémi; Chen, Yu-Sheng; Kim, Hyun Jung; Gagliardi, Laura; Lu, Connie C. Role of the metal in the bonding and properties of bimetallic complexes involving manganese, iron, and cobalt. Journal of the American Chemical Society 136(5) (2014) 1842-1855
Space group: P 1 21/n 1
Cell volume: 2120.4
Cell parameters: 9.245; 12.5597; 18.4751; 90; 98.724; 90;  

COD ID: 4120603
CIF file Formula: - C21 H24 Cl Co Mn N7 -
Comments: Tereniak, Stephen J.; Carlson, Rebecca K.; Clouston, Laura J.; Young, Jr, Victor G; Bill, Eckhard; Maurice, Rémi; Chen, Yu-Sheng; Kim, Hyun Jung; Gagliardi, Laura; Lu, Connie C. Role of the metal in the bonding and properties of bimetallic complexes involving manganese, iron, and cobalt. Journal of the American Chemical Society 136(5) (2014) 1842-1855
Space group: P 1 21/n 1
Cell volume: 2140.4
Cell parameters: 9.3125; 12.5159; 18.574; 90; 98.631; 90;  

COD ID: 4120604
CIF file Formula: - C21 H24 Cl Fe2 N7 -
Comments: Tereniak, Stephen J.; Carlson, Rebecca K.; Clouston, Laura J.; Young, Jr, Victor G; Bill, Eckhard; Maurice, Rémi; Chen, Yu-Sheng; Kim, Hyun Jung; Gagliardi, Laura; Lu, Connie C. Role of the metal in the bonding and properties of bimetallic complexes involving manganese, iron, and cobalt. Journal of the American Chemical Society 136(5) (2014) 1842-1855
Space group: P 1 21/n 1
Cell volume: 2113.1
Cell parameters: 9.206; 12.673; 18.423; 90; 100.544; 90;  

COD ID: 4120605
CIF file Formula: - C21 H24 Cl Fe Mn N7 -
Comments: Tereniak, Stephen J.; Carlson, Rebecca K.; Clouston, Laura J.; Young, Jr, Victor G; Bill, Eckhard; Maurice, Rémi; Chen, Yu-Sheng; Kim, Hyun Jung; Gagliardi, Laura; Lu, Connie C. Role of the metal in the bonding and properties of bimetallic complexes involving manganese, iron, and cobalt. Journal of the American Chemical Society 136(5) (2014) 1842-1855
Space group: P 1 21/n 1
Cell volume: 2147.65
Cell parameters: 9.3535; 12.5109; 18.5566; 90; 98.5002; 90;  

COD ID: 4120606
CIF file Formula: - C21 H24 Co K N7 -
Comments: Tereniak, Stephen J.; Carlson, Rebecca K.; Clouston, Laura J.; Young, Jr, Victor G; Bill, Eckhard; Maurice, Rémi; Chen, Yu-Sheng; Kim, Hyun Jung; Gagliardi, Laura; Lu, Connie C. Role of the metal in the bonding and properties of bimetallic complexes involving manganese, iron, and cobalt. Journal of the American Chemical Society 136(5) (2014) 1842-1855
Space group: P 1 21/c 1
Cell volume: 4286
Cell parameters: 12.955; 16.21; 21.245; 90; 106.123; 90;  

COD ID: 4120607
CIF file Formula: - C58 H75 Ge N O2 Si -
Comments: Hadlington, Terrance J.; Hermann, Markus; Frenking, Gernot; Jones, Cameron Low Coordinate Germanium(II) and Tin(II) Hydride Complexes: Efficient Catalysts for the Hydroboration of Carbonyl Compounds. Journal of the American Chemical Society 136(8) (2014) 3028
Space group: P -1
Cell volume: 2569.95
Cell parameters: 10.1666; 13.8647; 19.1051; 95.982; 103.95; 96.87;  

COD ID: 4120608
CIF file Formula: - C51 H67 Ge N O Si -
Comments: Hadlington, Terrance J.; Hermann, Markus; Frenking, Gernot; Jones, Cameron Low Coordinate Germanium(II) and Tin(II) Hydride Complexes: Efficient Catalysts for the Hydroboration of Carbonyl Compounds. Journal of the American Chemical Society 136(8) (2014) 3028
Space group: P 1 21/n 1
Cell volume: 4498.3
Cell parameters: 10.2694; 15.7032; 28.1381; 90; 97.545; 90;  

COD ID: 4120609
CIF file Formula: - C48 H61 N O Si Sn -
Comments: Hadlington, Terrance J.; Hermann, Markus; Frenking, Gernot; Jones, Cameron Low Coordinate Germanium(II) and Tin(II) Hydride Complexes: Efficient Catalysts for the Hydroboration of Carbonyl Compounds. Journal of the American Chemical Society 136(8) (2014) 3028
Space group: P -1
Cell volume: 2146.79
Cell parameters: 10.3523; 14.1047; 15.535; 93.82; 95.712; 107.061;  

COD ID: 4120610
CIF file Formula: - C51 H67 N O Si Sn -
Comments: Hadlington, Terrance J.; Hermann, Markus; Frenking, Gernot; Jones, Cameron Low Coordinate Germanium(II) and Tin(II) Hydride Complexes: Efficient Catalysts for the Hydroboration of Carbonyl Compounds. Journal of the American Chemical Society 136(8) (2014) 3028
Space group: P 1 21/n 1
Cell volume: 4506.4
Cell parameters: 10.2642; 15.679; 28.312; 90; 98.491; 90;  

COD ID: 4120611
CIF file Formula: - C58 H75 N O2 Si Sn -
Comments: Hadlington, Terrance J.; Hermann, Markus; Frenking, Gernot; Jones, Cameron Low Coordinate Germanium(II) and Tin(II) Hydride Complexes: Efficient Catalysts for the Hydroboration of Carbonyl Compounds. Journal of the American Chemical Society 136(8) (2014) 3028
Space group: P -1
Cell volume: 2624.2
Cell parameters: 10.2677; 13.953; 19.249; 95.626; 104.476; 97.307;  

COD ID: 4120612
CIF file Formula: - C12 H32 F6 N2 Si -
Comments: Senaweera, Sameera M.; Singh, Anuradha; Weaver, Jimmie D. Photocatalytic Hydrodefluorination: Facile Access to Partially Fluorinated Aromatics. Journal of the American Chemical Society 136(8) (2014) 3002
Space group: C 1 2/c 1
Cell volume: 1699.99
Cell parameters: 12.3645; 11.5922; 12.7948; 90; 112.031; 90;  

COD ID: 4120613
CIF file Formula: - C50 H72 Ir2 O P4 -
Comments: Burford, Richard J.; Piers, Warren E.; Ess, Daniel H.; Parvez, Masood Reversible Interconversion Between a Monomeric Iridium Hydroxo and a Dinuclear Iridium μ-Oxo Complex. Journal of the American Chemical Society 136(8) (2014) 3256
Space group: I 41/a :2
Cell volume: 4960
Cell parameters: 17.4249; 17.4249; 16.3359; 90; 90; 90;  

COD ID: 4120614
CIF file Formula: - C30 H37 N O2.08 -
Comments: Goetz, Adam E.; Silberstein, Amanda L.; Corsello, Michael A.; Garg, Neil K. Concise Enantiospecific Total Synthesis of Tubingensin A. Journal of the American Chemical Society 136(8) (2014) 3036
Space group: P -1
Cell volume: 1211.3
Cell parameters: 8.7034; 9.0617; 16.353; 102.348; 97.179; 102.277;  

COD ID: 4120615
CIF file Formula: - Al7.62 Au13.38 Sr3 -
Comments: Palasyuk, Andriy; Grin, Yuri; Miller, Gordon J. Turning Gold into "Diamond": A Family of Hexagonal Diamond-Type Au-Frameworks Interconnected by Triangular Clusters in the Sr-Al-Au System. Journal of the American Chemical Society 136(8) (2014) 3108
Space group: P -6 2 m
Cell volume: 462.04
Cell parameters: 8.6644; 8.6644; 7.1068; 90; 90; 120;  

COD ID: 4120616
CIF file Formula: - Al8.81 Au12.19 Sr3 -
Comments: Palasyuk, Andriy; Grin, Yuri; Miller, Gordon J. Turning Gold into "Diamond": A Family of Hexagonal Diamond-Type Au-Frameworks Interconnected by Triangular Clusters in the Sr-Al-Au System. Journal of the American Chemical Society 136(8) (2014) 3108
Space group: P -6 2 m
Cell volume: 457.18
Cell parameters: 8.633; 8.633; 7.0832; 90; 90; 120;  

COD ID: 4120617
CIF file Formula: - Al1.95 Au5.05 Sr -
Comments: Palasyuk, Andriy; Grin, Yuri; Miller, Gordon J. Turning Gold into "Diamond": A Family of Hexagonal Diamond-Type Au-Frameworks Interconnected by Triangular Clusters in the Sr-Al-Au System. Journal of the American Chemical Society 136(8) (2014) 3108
Space group: P n m a
Cell volume: 641.42
Cell parameters: 8.9424; 7.232; 9.9182; 90; 90; 90;  

COD ID: 4120618
CIF file Formula: - Al1.67 Au7.33 Sr2 -
Comments: Palasyuk, Andriy; Grin, Yuri; Miller, Gordon J. Turning Gold into "Diamond": A Family of Hexagonal Diamond-Type Au-Frameworks Interconnected by Triangular Clusters in the Sr-Al-Au System. Journal of the American Chemical Society 136(8) (2014) 3108
Space group: C 1 2/c 1
Cell volume: 922.3
Cell parameters: 14.956; 8.5641; 8.6718; 90; 123.86; 90;  

COD ID: 4120619
CIF file Formula: - Al2.82 Au6.18 Sr2 -
Comments: Palasyuk, Andriy; Grin, Yuri; Miller, Gordon J. Turning Gold into "Diamond": A Family of Hexagonal Diamond-Type Au-Frameworks Interconnected by Triangular Clusters in the Sr-Al-Au System. Journal of the American Chemical Society 136(8) (2014) 3108
Space group: R -3 c :H
Cell volume: 1343.2
Cell parameters: 8.4475; 8.4475; 21.735; 90; 90; 120;  

COD ID: 4120620
CIF file Formula: - C18 H18 O3 -
Comments: Xia, Ying; Liu, Zhenxing; Liu, Zhen; Ge, Rui; Ye, Fei; Hossain, Mohammad; Zhang, Yan; Wang, Jianbo Formal Carbene Insertion into C-C Bond: Rh(I)-Catalyzed Reaction of Benzocyclobutenols with Diazoesters. Journal of the American Chemical Society 136(8) (2014) 3013
Space group: P 1 21/c 1
Cell volume: 1476.3
Cell parameters: 13.9757; 14.2207; 7.494; 90; 97.598; 90;  

COD ID: 4120621
CIF file Formula: - C24 H22 O3 -
Comments: Xia, Ying; Liu, Zhenxing; Liu, Zhen; Ge, Rui; Ye, Fei; Hossain, Mohammad; Zhang, Yan; Wang, Jianbo Formal Carbene Insertion into C-C Bond: Rh(I)-Catalyzed Reaction of Benzocyclobutenols with Diazoesters. Journal of the American Chemical Society 136(8) (2014) 3013
Space group: P 1 21/n 1
Cell volume: 1890.8
Cell parameters: 10.7148; 10.3476; 17.2186; 90; 97.936; 90;  

COD ID: 4120622
CIF file Formula: - C21 H22 O3 -
Comments: Xia, Ying; Liu, Zhenxing; Liu, Zhen; Ge, Rui; Ye, Fei; Hossain, Mohammad; Zhang, Yan; Wang, Jianbo Formal Carbene Insertion into C-C Bond: Rh(I)-Catalyzed Reaction of Benzocyclobutenols with Diazoesters. Journal of the American Chemical Society 136(8) (2014) 3013
Space group: P 1 21/c 1
Cell volume: 1725.04
Cell parameters: 11.7262; 10.4463; 14.7106; 90; 106.804; 90;  

COD ID: 4120623
CIF file Formula: - C24 H22 Br N -
Comments: Sevov, Christo S.; Zhou, Jianrong Steve; Hartwig, John F. Iridium-Catalyzed, Intermolecular Hydroamination of Unactivated Alkenes with Indoles. Journal of the American Chemical Society 136(8) (2014) 3200
Space group: P 21 21 21
Cell volume: 1925.76
Cell parameters: 7.7727; 10.1494; 24.4112; 90; 90; 90;  

COD ID: 4120624
CIF file Formula: - C28 H30 N2 O3 -
Comments: Lee, Kiyoun; Boger, Dale L. Total Syntheses of (-)-Kopsifoline D and (-)-Deoxoapodine: Divergent Total Synthesis via Late-Stage Key Strategic Bond Formation. Journal of the American Chemical Society 136(8) (2014) 3312
Space group: P 1 21 1
Cell volume: 1126.7
Cell parameters: 8.306; 6.569; 21.01; 90; 100.631; 90;  

COD ID: 4120625
CIF file Formula: - C28 H30 N2 O2 S -
Comments: Lee, Kiyoun; Boger, Dale L. Total Syntheses of (-)-Kopsifoline D and (-)-Deoxoapodine: Divergent Total Synthesis via Late-Stage Key Strategic Bond Formation. Journal of the American Chemical Society 136(8) (2014) 3312
Space group: P 21 21 21
Cell volume: 2338.5
Cell parameters: 6.6931; 18.67; 18.714; 90; 90; 90;  

COD ID: 4120626
CIF file Formula: - C20 H0 N2 O4 -
Comments: Lee, Kiyoun; Boger, Dale L. Total Syntheses of (-)-Kopsifoline D and (-)-Deoxoapodine: Divergent Total Synthesis via Late-Stage Key Strategic Bond Formation. Journal of the American Chemical Society 136(8) (2014) 3312
Space group: P 21 21 21
Cell volume: 2510.53
Cell parameters: 7.7075; 12.7478; 25.5515; 90; 90; 90;  

COD ID: 4120627
CIF file Formula: - C27 H23 N2 O3 S -
Comments: Gawade, Sagar Ashok; Huple, Deepak B.; Liu, Rai-Shung Zn(II)- or Ag(I)-Catalyzed 1,4-Metathesis Reactions between 3-En-1-ynamides and Nitrosoarenes. Journal of the American Chemical Society 136(8) (2014) 2978
Space group: P 1 21 1
Cell volume: 1123.6
Cell parameters: 9.7575; 10.35; 11.999; 90; 111.993; 90;  

COD ID: 4120628
CIF file Formula: - C37 H59.5 N3.5 Nb O0.5 -
Comments: Obenhuber, Andreas H.; Gianetti, Thomas L.; Berrebi, Xavier; Bergman, Robert G.; Arnold, John Reaction of (Bisimido)niobium(V) Complexes with Organic Azides: [3 + 2] Cycloaddition and Reversible Cleavage of β-Diketiminato Ligands Involving Nitrene Transfer. Journal of the American Chemical Society 136(8) (2014) 2994
Space group: P -1
Cell volume: 1841.2
Cell parameters: 10.4594; 11.0607; 18.1995; 77.313; 85.045; 63.691;  

COD ID: 4120629
CIF file Formula: - C36 H59 N6 Nb Si -
Comments: Obenhuber, Andreas H.; Gianetti, Thomas L.; Berrebi, Xavier; Bergman, Robert G.; Arnold, John Reaction of (Bisimido)niobium(V) Complexes with Organic Azides: [3 + 2] Cycloaddition and Reversible Cleavage of β-Diketiminato Ligands Involving Nitrene Transfer. Journal of the American Chemical Society 136(8) (2014) 2994
Space group: P -1
Cell volume: 3994.3
Cell parameters: 12.5538; 16.438; 19.6288; 89.171; 80.656; 88.005;  

COD ID: 4120630
CIF file Formula: - C37 H59 N6 Nb -
Comments: Obenhuber, Andreas H.; Gianetti, Thomas L.; Berrebi, Xavier; Bergman, Robert G.; Arnold, John Reaction of (Bisimido)niobium(V) Complexes with Organic Azides: [3 + 2] Cycloaddition and Reversible Cleavage of β-Diketiminato Ligands Involving Nitrene Transfer. Journal of the American Chemical Society 136(8) (2014) 2994
Space group: P c a 21
Cell volume: 7575.7
Cell parameters: 24.042; 18.1865; 17.3262; 90; 90; 90;  

COD ID: 4120631
CIF file Formula: - C37 H59 N4 Nb -
Comments: Obenhuber, Andreas H.; Gianetti, Thomas L.; Berrebi, Xavier; Bergman, Robert G.; Arnold, John Reaction of (Bisimido)niobium(V) Complexes with Organic Azides: [3 + 2] Cycloaddition and Reversible Cleavage of β-Diketiminato Ligands Involving Nitrene Transfer. Journal of the American Chemical Society 136(8) (2014) 2994
Space group: P 1 21/n 1
Cell volume: 3713.3
Cell parameters: 12.7024; 21.4305; 13.6706; 90; 93.776; 90;  

COD ID: 4120632
CIF file Formula: - C37 H59 N4 Nb -
Comments: Obenhuber, Andreas H.; Gianetti, Thomas L.; Berrebi, Xavier; Bergman, Robert G.; Arnold, John Reaction of (Bisimido)niobium(V) Complexes with Organic Azides: [3 + 2] Cycloaddition and Reversible Cleavage of β-Diketiminato Ligands Involving Nitrene Transfer. Journal of the American Chemical Society 136(8) (2014) 2994
Space group: P -1
Cell volume: 3593.3
Cell parameters: 11.1687; 17.714; 19.7346; 105.313; 102.083; 98.673;  

COD ID: 4120633
CIF file Formula: - C45 H67 N4 Nb -
Comments: Obenhuber, Andreas H.; Gianetti, Thomas L.; Berrebi, Xavier; Bergman, Robert G.; Arnold, John Reaction of (Bisimido)niobium(V) Complexes with Organic Azides: [3 + 2] Cycloaddition and Reversible Cleavage of β-Diketiminato Ligands Involving Nitrene Transfer. Journal of the American Chemical Society 136(8) (2014) 2994
Space group: P 1 21/c 1
Cell volume: 4329.5
Cell parameters: 11.4761; 17.2593; 21.9265; 90; 94.514; 90;  

COD ID: 4120634
CIF file Formula: - C45 H67 N4 Nb -
Comments: Obenhuber, Andreas H.; Gianetti, Thomas L.; Berrebi, Xavier; Bergman, Robert G.; Arnold, John Reaction of (Bisimido)niobium(V) Complexes with Organic Azides: [3 + 2] Cycloaddition and Reversible Cleavage of β-Diketiminato Ligands Involving Nitrene Transfer. Journal of the American Chemical Society 136(8) (2014) 2994
Space group: P 1 21/n 1
Cell volume: 4267.7
Cell parameters: 12.1424; 22.102; 15.9149; 90; 92.287; 90;  

COD ID: 4120635
CIF file Formula: - C37.5 H34 B F10 P -
Comments: Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society 136(8) (2014) 3293
Space group: P 1 21/c 1
Cell volume: 3321.66
Cell parameters: 8.5881; 20.1695; 19.1928; 90; 92.38; 90;  

COD ID: 4120636
CIF file Formula: - C22 H29 P -
Comments: Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society 136(8) (2014) 3293
Space group: P -1
Cell volume: 1956.39
Cell parameters: 11.3351; 11.4675; 17.6404; 87.588; 77.145; 61.359;  

COD ID: 4120637
CIF file Formula: - C44.5 H44 B F10 P -
Comments: Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society 136(8) (2014) 3293
Space group: P 1 21/n 1
Cell volume: 4153.3
Cell parameters: 14.7877; 14.8191; 18.9752; 90; 92.799; 90;  

COD ID: 4120638
CIF file Formula: - C34 H30 B F10 O P -
Comments: Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society 136(8) (2014) 3293
Space group: P -1
Cell volume: 1539.34
Cell parameters: 10.2513; 10.7475; 14.2965; 91.802; 101.483; 93.419;  

COD ID: 4120639
CIF file Formula: - C36 H22 B F10 Fe P -
Comments: Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society 136(8) (2014) 3293
Space group: P 1 21 1
Cell volume: 1536.08
Cell parameters: 11.0386; 10.5787; 13.2111; 90; 95.315; 90;  

COD ID: 4120640
CIF file Formula: - C34 H41 Fe O3 P -
Comments: Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society 136(8) (2014) 3293
Space group: P 21 21 21
Cell volume: 2913.57
Cell parameters: 11.3753; 14.52; 17.6399; 90; 90; 90;  

COD ID: 4120641
CIF file Formula: - C29 H31 Fe O P -
Comments: Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society 136(8) (2014) 3293
Space group: P 1 21 1
Cell volume: 1214.7
Cell parameters: 7.88; 9.68; 16.237; 90; 101.258; 90;  

COD ID: 4120642
CIF file Formula: - C30 H33 Fe P -
Comments: Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society 136(8) (2014) 3293
Space group: P 21 21 21
Cell volume: 2509.1
Cell parameters: 10.092; 15.3552; 16.1914; 90; 90; 90;  

COD ID: 4120643
CIF file Formula: - C47 H46 B F10 Fe P -
Comments: Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society 136(8) (2014) 3293
Space group: P 21 21 21
Cell volume: 4341.38
Cell parameters: 8.8458; 20.3854; 24.0753; 90; 90; 90;  

COD ID: 4120644
CIF file Formula: - C47 H39 B F10 Fe N P -
Comments: Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society 136(8) (2014) 3293
Space group: P 21 21 21
Cell volume: 4224
Cell parameters: 8.8713; 9.5648; 49.7807; 90; 90; 90;  

COD ID: 4120645
CIF file Formula: - C47 H43 B F10 Fe N P -
Comments: Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society 136(8) (2014) 3293
Space group: P 21 21 21
Cell volume: 13040.2
Cell parameters: 9.9126; 26.8254; 49.04; 90; 90; 90;  

COD ID: 4120646
CIF file Formula: - C58 H50 B F10 Fe P -
Comments: Wang, Xiaowu; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Internal Adduct Formation of Active Intramolecular C4-bridged Frustrated Phosphane/Borane Lewis Pairs. Journal of the American Chemical Society 136(8) (2014) 3293
Space group: P 21 21 21
Cell volume: 4961.07
Cell parameters: 11.5309; 18.6255; 23.0996; 90; 90; 90;  

COD ID: 4120647
CIF file Formula: - C38 H40 N4 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: P 1 21/c 1
Cell volume: 2980.7
Cell parameters: 10.8786; 12.5301; 22.1389; 90; 98.988; 90;  

COD ID: 4120648
CIF file Formula: - C44 H45 Cl F10 N6 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: P 1 21/c 1
Cell volume: 4222.7
Cell parameters: 19.9123; 11.0521; 19.7629; 90; 103.857; 90;  

COD ID: 4120649
CIF file Formula: - C38 H36 N8 O8 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: C 1 2/c 1
Cell volume: 7145.3
Cell parameters: 40.8091; 10.2663; 19.3106; 90; 117.971; 90;  

COD ID: 4120650
CIF file Formula: - C42 H42 N10 O8 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: P 1 21/n 1
Cell volume: 2030.1
Cell parameters: 12.455; 12.1362; 13.8791; 90; 104.608; 90;  

COD ID: 4120651
CIF file Formula: - C15 H15 N3 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: F d d 2
Cell volume: 4958.1
Cell parameters: 26.445; 29.271; 6.4052; 90; 90; 90;  

COD ID: 4120652
CIF file Formula: - C16 H15 Br N2 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: P 1 21/c 1
Cell volume: 2769.9
Cell parameters: 15.485; 17.588; 10.7656; 90; 109.139; 90;  

COD ID: 4120653
CIF file Formula: - C56 H77 Br N8 O4 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: C 1 2/c 1
Cell volume: 5404.3
Cell parameters: 21.282; 17.2226; 15.5673; 90; 108.712; 90;  

COD ID: 4120654
CIF file Formula: - C42 H44 Br2 N6 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: P -1
Cell volume: 1897.6
Cell parameters: 10.9585; 11.1069; 16.6867; 78.438; 77.178; 75.91;  

COD ID: 4120655
CIF file Formula: - C39.8 H33.6 Cl3.6 F10 N4 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: C 1 2/c 1
Cell volume: 3884.3
Cell parameters: 17.3174; 11.0464; 20.6877; 90; 101.035; 90;  

COD ID: 4120656
CIF file Formula: - C42 H36 F10 N6 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: P 1 21/n 1
Cell volume: 1938
Cell parameters: 11.8894; 11.8311; 14.1611; 90; 103.366; 90;  

COD ID: 4120657
CIF file Formula: - C16 H14 N4 O4 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: P 1 21/c 1
Cell volume: 3012.4
Cell parameters: 10.6399; 24.5713; 11.5358; 90; 92.741; 90;  

COD ID: 4120658
CIF file Formula: - C44 H41 Br F10 N6 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: P 1 21/c 1
Cell volume: 4221.7
Cell parameters: 19.684; 11.1411; 19.52; 90; 99.53; 90;  

COD ID: 4120659
CIF file Formula: - C44 H51 Br N10 O8 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: P 1
Cell volume: 1102.7
Cell parameters: 10.0512; 10.709; 11.1899; 109.207; 102.04; 93.042;  

COD ID: 4120660
CIF file Formula: - C46 H56 N4 O4 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: P 1 21/c 1
Cell volume: 4054.3
Cell parameters: 10.4344; 28.1432; 13.8084; 90; 90.98; 90;  

COD ID: 4120661
CIF file Formula: - C46 H59 Cl N6 O2 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: P -1
Cell volume: 4250.9
Cell parameters: 14.492; 15.192; 20.462; 84.139; 71.702; 85.832;  

COD ID: 4120662
CIF file Formula: - C44 H53 Br2 Cl N6 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: P 1 21/n 1
Cell volume: 4212.8
Cell parameters: 12.4523; 19.2145; 17.6399; 90; 93.479; 90;  

COD ID: 4120663
CIF file Formula: - C45 H54 Cl N9 O9 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: P 1 21/n 1
Cell volume: 4486
Cell parameters: 10.7531; 19.8526; 21.1338; 90; 96.105; 90;  

COD ID: 4120664
CIF file Formula: - C44 H45 F10 I N6 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: P 1 21/c 1
Cell volume: 4280.4
Cell parameters: 19.646; 11.2296; 19.645; 90; 99.022; 90;  

COD ID: 4120665
CIF file Formula: - C40 H41 Br2 N5 -
Comments: Adriaenssens, Louis; Gil-Ramírez, Guzmán; Frontera, Antonio; Quiñonero, David; Escudero-Adán, Eduardo C; Ballester, Pablo Thermodynamic Characterization of Halide-π Interactions in Solution Using "Two-Wall" Aryl Extended Calix[4]pyrroles as Model System. Journal of the American Chemical Society 136(8) (2014) 3208
Space group: P 1 21/n 1
Cell volume: 3581.1
Cell parameters: 12.2705; 10.5841; 27.6226; 90; 93.39; 90;  

COD ID: 4120666
CIF file Formula: - C130 H192 Cl2 N43.67 O61.1 P2 Pd6 Pt Si2 -
Comments: Kohyama, Yuh; Murase, Takashi; Fujita, Makoto Metal-Organic Proximity in a Synthetic Pocket. Journal of the American Chemical Society 136(8) (2014) 2966
Space group: P n m a
Cell volume: 20847
Cell parameters: 22.628; 22.198; 41.504; 90; 90; 90;  

COD ID: 4120667
CIF file Formula: - C29 H39 Al Cl2 N2 O2 -
Comments: Pilone, Alessia; Press, Konstantin; Goldberg, Israel; Kol, Moshe; Mazzeo, Mina; Lamberti, Marina Gradient Isotactic Multiblock Polylactides from Aluminum Complexes of Chiral Salalen Ligands. Journal of the American Chemical Society 136(8) (2014) 2940
Space group: P 21 21 21
Cell volume: 2818.2
Cell parameters: 10.136; 10.9801; 25.322; 90; 90; 90;  

COD ID: 4120668
CIF file Formula: - C146 H168 Cu4 F24 Ir8 N16 O54 S8 -
Comments: Li, Hao; Han, Ying-Feng; Lin, Yue-Jian; Guo, Zi-Wei; Jin, Guo-Xin Stepwise Construction of Discrete Heterometallic Coordination Cages Based on Self-Sorting Strategy. Journal of the American Chemical Society 136(8) (2014) 2982
Space group: P 1 21/n 1
Cell volume: 10600
Cell parameters: 18.26; 20.91; 27.801; 90; 93.071; 90;  

COD ID: 4120669
CIF file Formula: - C192 H348 Cu4 F24 Ir8 N16 O114 S8 -
Comments: Li, Hao; Han, Ying-Feng; Lin, Yue-Jian; Guo, Zi-Wei; Jin, Guo-Xin Stepwise Construction of Discrete Heterometallic Coordination Cages Based on Self-Sorting Strategy. Journal of the American Chemical Society 136(8) (2014) 2982
Space group: P -4 n 2
Cell volume: 26059
Cell parameters: 34.111; 34.111; 22.396; 90; 90; 90;  

COD ID: 4120670
CIF file Formula: - C148 H172 Ag2 Cu4 F30 Ir8 N16 O62 S10 -
Comments: Li, Hao; Han, Ying-Feng; Lin, Yue-Jian; Guo, Zi-Wei; Jin, Guo-Xin Stepwise Construction of Discrete Heterometallic Coordination Cages Based on Self-Sorting Strategy. Journal of the American Chemical Society 136(8) (2014) 2982
Space group: P b c a
Cell volume: 22654.8
Cell parameters: 29.4297; 24.1596; 31.8628; 90; 90; 90;  

COD ID: 4120671
CIF file Formula: - C156 H188 F24 Ir8 N20 Ni4 O58 S8 -
Comments: Li, Hao; Han, Ying-Feng; Lin, Yue-Jian; Guo, Zi-Wei; Jin, Guo-Xin Stepwise Construction of Discrete Heterometallic Coordination Cages Based on Self-Sorting Strategy. Journal of the American Chemical Society 136(8) (2014) 2982
Space group: P 1 21/n 1
Cell volume: 10532
Cell parameters: 18.2183; 21.039; 27.5149; 90; 92.989; 90;  

COD ID: 4120672
CIF file Formula: - C162 H206 Ag2 F30 Ir8 N18 O66 S10 Zn4 -
Comments: Li, Hao; Han, Ying-Feng; Lin, Yue-Jian; Guo, Zi-Wei; Jin, Guo-Xin Stepwise Construction of Discrete Heterometallic Coordination Cages Based on Self-Sorting Strategy. Journal of the American Chemical Society 136(8) (2014) 2982
Space group: P 1 21/n 1
Cell volume: 10678
Cell parameters: 15.892; 32.88; 20.486; 90; 94.06; 90;  

COD ID: 4120673
CIF file Formula: - C24 H26 B F4 N5 Pt -
Comments: Krikorian, Markrete; Liu, Shuang; Swager, Timothy M. Columnar Liquid Crystallinity and Mechanochromism in Cationic Platinum(II) Complexes. Journal of the American Chemical Society 136(8) (2014) 2952
Space group: P 1 21/n 1
Cell volume: 2298.3
Cell parameters: 14.6099; 7.1043; 22.2579; 90; 95.823; 90;  

COD ID: 4120674
CIF file Formula: - C22 H28 B N Si2 -
Comments: Ge, Fang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Borole formation by 1,1-carboboration. Journal of the American Chemical Society 136(1) (2014) 68-71
Space group: P -1
Cell volume: 1210
Cell parameters: 10.1495; 10.3634; 12.2788; 92.766; 107.648; 98.821;  

COD ID: 4120675
CIF file Formula: - C45 H33 B2 F15 N2 Si2 -
Comments: Ge, Fang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Borole formation by 1,1-carboboration. Journal of the American Chemical Society 136(1) (2014) 68-71
Space group: P -1
Cell volume: 2277.04
Cell parameters: 11.1344; 11.8923; 17.9487; 91.256; 98.181; 104.156;  

COD ID: 4120676
CIF file Formula: - C40 H28 B2 F15 N Si2 -
Comments: Ge, Fang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Borole formation by 1,1-carboboration. Journal of the American Chemical Society 136(1) (2014) 68-71
Space group: P 1 21/c 1
Cell volume: 4042.83
Cell parameters: 21.0316; 14.0496; 14.0809; 90; 103.671; 90;  

COD ID: 4120677
CIF file Formula: - C40 H33 B2 F15 Si2 -
Comments: Ge, Fang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Borole formation by 1,1-carboboration. Journal of the American Chemical Society 136(1) (2014) 68-71
Space group: P -1
Cell volume: 2443.04
Cell parameters: 11.6645; 12.2645; 18.5329; 108.563; 96.887; 98.819;  

COD ID: 4120678
CIF file Formula: - C34 H23 B2 F15 Si2 -
Comments: Ge, Fang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard Borole formation by 1,1-carboboration. Journal of the American Chemical Society 136(1) (2014) 68-71
Space group: P -1
Cell volume: 1768.26
Cell parameters: 10.8632; 11.8992; 14.8632; 81.215; 84.155; 68.825;  

COD ID: 4120679
CIF file Formula: - C18 H21 O6 P -
Comments: Jang, Ki Po; Hutson, Gerri E.; Johnston, Ryne C.; McCusker, Elizabeth O.; Cheong, Paul H.-Y.; Scheidt, Karl A. Asymmetric Homoenolate Additions to Acyl Phosphonates through Rational Design of a Tailored N-Heterocyclic Carbene Catalyst. Journal of the American Chemical Society 136(1) (2014) 76-79
Space group: P 1
Cell volume: 443.37
Cell parameters: 7.1747; 7.9625; 8.5502; 69.509; 84.347; 75.715;  

COD ID: 4120680
CIF file Formula: - C32 H58 Ge O4 Si3 W -
Comments: Fukuda, Tetsuya; Hashimoto, Hisako; Tobita, Hiromi Reactions of a Tungsten-Germylyne Complex with α,β-Unsaturated Ketones: Complete Cleavage of the W≡Ge Bond and Formation of Two Types of η(3)-Germoxyallyl Tungsten Complexes. Journal of the American Chemical Society 136(1) (2014) 80-83
Space group: P 1 21/a 1
Cell volume: 3777.9
Cell parameters: 16.9057; 10.5686; 21.5417; 90; 101.02; 90;  

COD ID: 4120681
CIF file Formula: - C27 H50 Ge O3 Si3 W -
Comments: Fukuda, Tetsuya; Hashimoto, Hisako; Tobita, Hiromi Reactions of a Tungsten-Germylyne Complex with α,β-Unsaturated Ketones: Complete Cleavage of the W≡Ge Bond and Formation of Two Types of η(3)-Germoxyallyl Tungsten Complexes. Journal of the American Chemical Society 136(1) (2014) 80-83
Space group: P -1
Cell volume: 1636.6
Cell parameters: 8.9578; 9.0925; 21.22; 81.533; 78.365; 76.447;  

COD ID: 4120682
CIF file Formula: - C17 H18 N2 O3 S -
Comments: Chuprakov, Stepan; Worrell, Brady T.; Selander, Nicklas; Sit, Rakesh K.; Fokin, Valery V. Stereoselective 1,3-Insertions of Rhodium(II) Azavinyl Carbenes. Journal of the American Chemical Society 136(1) (2014) 195-202
Space group: P -1
Cell volume: 3310.4
Cell parameters: 9.722; 16.2451; 21.645; 98.61; 100.124; 94.125;  

COD ID: 4120683
CIF file Formula: - C27 H27 Cl2 N O3 S -
Comments: Chuprakov, Stepan; Worrell, Brady T.; Selander, Nicklas; Sit, Rakesh K.; Fokin, Valery V. Stereoselective 1,3-Insertions of Rhodium(II) Azavinyl Carbenes. Journal of the American Chemical Society 136(1) (2014) 195-202
Space group: P -1
Cell volume: 1304.51
Cell parameters: 10.5744; 10.7434; 12.6461; 74.312; 71.548; 79.44;  

COD ID: 4120684
CIF file Formula: - C11 H14 N2 O4 S -
Comments: Chuprakov, Stepan; Worrell, Brady T.; Selander, Nicklas; Sit, Rakesh K.; Fokin, Valery V. Stereoselective 1,3-Insertions of Rhodium(II) Azavinyl Carbenes. Journal of the American Chemical Society 136(1) (2014) 195-202
Space group: P 1 21 1
Cell volume: 612.22
Cell parameters: 5.0497; 9.2653; 13.2307; 90; 98.504; 90;  

COD ID: 4120685
CIF file Formula: - C56 H55 Cl O8 P2 Pd -
Comments: Wang, Xiaoming; Guo, Peihua; Han, Zhaobin; Wang, Xubin; Wang, Zheng; Ding, Kuiling Spiroketal-based diphosphine ligands in pd-catalyzed asymmetric allylic amination of morita-baylis-hillman adducts: exceptionally high efficiency and new mechanism. Journal of the American Chemical Society 136(1) (2014) 405-411
Space group: P 1 21 1
Cell volume: 2628.1
Cell parameters: 11.3703; 18.4887; 13.6456; 90; 113.629; 90;  

COD ID: 4120686
CIF file Formula: - C59 H55 Cl O2 P2 Pd -
Comments: Wang, Xiaoming; Guo, Peihua; Han, Zhaobin; Wang, Xubin; Wang, Zheng; Ding, Kuiling Spiroketal-based diphosphine ligands in pd-catalyzed asymmetric allylic amination of morita-baylis-hillman adducts: exceptionally high efficiency and new mechanism. Journal of the American Chemical Society 136(1) (2014) 405-411
Space group: P 21 21 21
Cell volume: 5046.4
Cell parameters: 9.7484; 19.9815; 25.907; 90; 90; 90;  

COD ID: 4120687
CIF file Formula: - C44 H38 O2 P2 -
Comments: Wang, Xiaoming; Guo, Peihua; Han, Zhaobin; Wang, Xubin; Wang, Zheng; Ding, Kuiling Spiroketal-based diphosphine ligands in pd-catalyzed asymmetric allylic amination of morita-baylis-hillman adducts: exceptionally high efficiency and new mechanism. Journal of the American Chemical Society 136(1) (2014) 405-411
Space group: P 21 21 21
Cell volume: 3557.2
Cell parameters: 7.5337; 17.205; 27.444; 90; 90; 90;  

COD ID: 4120688
CIF file Formula: - C49 H47 Br Cl4 O2 P2 Pd -
Comments: Wang, Xiaoming; Guo, Peihua; Han, Zhaobin; Wang, Xubin; Wang, Zheng; Ding, Kuiling Spiroketal-based diphosphine ligands in pd-catalyzed asymmetric allylic amination of morita-baylis-hillman adducts: exceptionally high efficiency and new mechanism. Journal of the American Chemical Society 136(1) (2014) 405-411
Space group: P 21 21 21
Cell volume: 4558.3
Cell parameters: 9.4609; 21.4594; 22.4518; 90; 90; 90;  

COD ID: 4120689
CIF file Formula: - C58 H54 Cl2 O2 P2 Pd -
Comments: Wang, Xiaoming; Guo, Peihua; Han, Zhaobin; Wang, Xubin; Wang, Zheng; Ding, Kuiling Spiroketal-based diphosphine ligands in pd-catalyzed asymmetric allylic amination of morita-baylis-hillman adducts: exceptionally high efficiency and new mechanism. Journal of the American Chemical Society 136(1) (2014) 405-411
Space group: P 21 21 21
Cell volume: 4759.6
Cell parameters: 9.2918; 20.1508; 25.42; 90; 90; 90;  

COD ID: 4120690
CIF file Formula: - C27 H31 Au N4 O3 S -
Comments: Ball, Liam T.; Lloyd-Jones, Guy C; Russell, Christopher A. Gold-Catalyzed Oxidative Coupling of Arylsilanes and Arenes: Origin of Selectivity and Improved Precatalyst. Journal of the American Chemical Society 136(1) (2014) 254-264
Space group: P 1 21/c 1
Cell volume: 2619.9
Cell parameters: 9.7151; 15.526; 17.882; 90; 103.757; 90;  

COD ID: 4120691
CIF file Formula: - C4 H8 Au Br3 S -
Comments: Ball, Liam T.; Lloyd-Jones, Guy C; Russell, Christopher A. Gold-Catalyzed Oxidative Coupling of Arylsilanes and Arenes: Origin of Selectivity and Improved Precatalyst. Journal of the American Chemical Society 136(1) (2014) 254-264
Space group: P 1 21/c 1
Cell volume: 1897.59
Cell parameters: 17.133; 7.1093; 17.3925; 90; 116.397; 90;  

COD ID: 4120692
CIF file Formula: - C96 H108 Au11 P6 -
Comments: Chen, Jing; Zhang, Qian-Fan; Bonaccorso, Timary A.; Williard, Paul G.; Wang, Lai-Sheng Controlling gold nanoclusters by diphospine ligands. Journal of the American Chemical Society 136(1) (2014) 92-95
Space group: P -1
Cell volume: 4971
Cell parameters: 15.493; 17.157; 21.556; 82.13; 73.244; 64.983;  

COD ID: 4120693
CIF file Formula: - C10 H8 Cu N2 O3 -
Comments: Zhang, Teng; Wang, Cheng; Liu, Shubin; Wang, Jin-Liang; Lin, Wenbin A biomimetic copper water oxidation catalyst with low overpotential. Journal of the American Chemical Society 136(1) (2014) 273-281
Space group: P 21 21 21
Cell volume: 913.9
Cell parameters: 4.3886; 13.3722; 15.5729; 90; 90; 90;  

COD ID: 4120694
CIF file Formula: - Ba3 Cl O10 P3 -
Comments: Yu, Peng; Wu, Li-Ming; Zhou, Liu-Jiang; Chen, Ling Deep-Ultraviolet Nonlinear Optical Crystals: Ba3P3O10X (X = Cl, Br). Journal of the American Chemical Society 136(1) (2014) 480-487
Space group: P c a 21
Cell volume: 1131.41
Cell parameters: 14.2771; 5.5968; 14.1592; 90; 90; 90;  

COD ID: 4120695
CIF file Formula: - Ba3 Br O10 P3 -
Comments: Yu, Peng; Wu, Li-Ming; Zhou, Liu-Jiang; Chen, Ling Deep-Ultraviolet Nonlinear Optical Crystals: Ba3P3O10X (X = Cl, Br). Journal of the American Chemical Society 136(1) (2014) 480-487
Space group: P 21 21 21
Cell volume: 1140.9
Cell parameters: 7.1722; 11.364; 13.998; 90; 90; 90;  

COD ID: 4120696
CIF file Formula: - C184 H160 F48 N40 O8 P8 Ru8 -
Comments: Neudeck, Sven; Maji, Somnath; López, Isidoro; Meyer, Steffen; Meyer, Franc; Llobet, Antoni New powerful and oxidatively rugged dinuclear ru water oxidation catalyst: control of mechanistic pathways by tailored ligand design. Journal of the American Chemical Society 136(1) (2014) 24-27
Space group: C 1 2/c 1
Cell volume: 9723
Cell parameters: 23.329; 18.055; 25.448; 90; 114.892; 90;  

COD ID: 4120697
CIF file Formula: - C30 H78 K N3 O6 S Si6 U -
Comments: Smiles, Danil E.; Wu, Guang; Hayton, Trevor W. Synthesis of uranium-ligand multiple bonds by cleavage of a trityl protecting group. Journal of the American Chemical Society 136(1) (2014) 96-99
Space group: P -1
Cell volume: 5007.7
Cell parameters: 12.7175; 18.84; 21.7489; 91.46; 105.661; 92.752;  

COD ID: 4120698
CIF file Formula: - C38 H95 K N5 O6.5 S Si6 U -
Comments: Smiles, Danil E.; Wu, Guang; Hayton, Trevor W. Synthesis of uranium-ligand multiple bonds by cleavage of a trityl protecting group. Journal of the American Chemical Society 136(1) (2014) 96-99
Space group: P 1 21/c 1
Cell volume: 5946
Cell parameters: 11.2243; 16.4779; 32.1639; 90; 91.774; 90;  

COD ID: 4120699
CIF file Formula: - C30 H78 K N3 O7 Si6 U -
Comments: Smiles, Danil E.; Wu, Guang; Hayton, Trevor W. Synthesis of uranium-ligand multiple bonds by cleavage of a trityl protecting group. Journal of the American Chemical Society 136(1) (2014) 96-99
Space group: P -1
Cell volume: 2480.7
Cell parameters: 11.0235; 12.7783; 18.3992; 91.254; 93.268; 106.365;  

COD ID: 4120700
CIF file Formula: - C41 H79 N3 O2 Si6 U -
Comments: Smiles, Danil E.; Wu, Guang; Hayton, Trevor W. Synthesis of uranium-ligand multiple bonds by cleavage of a trityl protecting group. Journal of the American Chemical Society 136(1) (2014) 96-99
Space group: P -1
Cell volume: 2584.26
Cell parameters: 11.7031; 12.7108; 17.4991; 90.802; 92.647; 96.274;  

COD ID: 4120701
CIF file Formula: - C78 H110 K2 O16 -
Comments: Smiles, Danil E.; Wu, Guang; Hayton, Trevor W. Synthesis of uranium-ligand multiple bonds by cleavage of a trityl protecting group. Journal of the American Chemical Society 136(1) (2014) 96-99
Space group: P -1
Cell volume: 1854.94
Cell parameters: 12.4741; 12.5528; 12.8731; 87.589; 67.196; 86.878;  

COD ID: 4120702
CIF file Formula: - C53 H102 Li N4 O8 Si6 U -
Comments: Smiles, Danil E.; Wu, Guang; Hayton, Trevor W. Synthesis of uranium-ligand multiple bonds by cleavage of a trityl protecting group. Journal of the American Chemical Society 136(1) (2014) 96-99
Space group: P n a 21
Cell volume: 6494.1
Cell parameters: 15.8489; 34.478; 11.8844; 90; 90; 90;  

COD ID: 4120703
CIF file Formula: - C13 H19 N3 O2 -
Comments: Kim, Sung Kuk; Lim, Jong Min; Pradhan, Tuhin; Jung, Hyo Sung; Lynch, Vincent M.; Kim, Jong Seung; Kim, Dongho; Sessler, Jonathan L. Self-association and nitroaromatic-induced deaggregation of pyrene substituted pyridine amides. Journal of the American Chemical Society 136(1) (2014) 495-505
Space group: P b c a
Cell volume: 2672.8
Cell parameters: 17.919; 15.3943; 9.6893; 90; 90; 90;  

COD ID: 4120704
CIF file Formula: - C42 H31 N3 O3 -
Comments: Kim, Sung Kuk; Lim, Jong Min; Pradhan, Tuhin; Jung, Hyo Sung; Lynch, Vincent M.; Kim, Jong Seung; Kim, Dongho; Sessler, Jonathan L. Self-association and nitroaromatic-induced deaggregation of pyrene substituted pyridine amides. Journal of the American Chemical Society 136(1) (2014) 495-505
Space group: I 41/a :2
Cell volume: 12782.4
Cell parameters: 27.8949; 27.8949; 16.4272; 90; 90; 90;  

COD ID: 4120705
CIF file Formula: - C47 H30 N6 O8 -
Comments: Kim, Sung Kuk; Lim, Jong Min; Pradhan, Tuhin; Jung, Hyo Sung; Lynch, Vincent M.; Kim, Jong Seung; Kim, Dongho; Sessler, Jonathan L. Self-association and nitroaromatic-induced deaggregation of pyrene substituted pyridine amides. Journal of the American Chemical Society 136(1) (2014) 495-505
Space group: P -1
Cell volume: 1832.33
Cell parameters: 9.882; 10.053; 21.2051; 81.036; 78.409; 62.916;  

COD ID: 4120706
CIF file Formula: - C14 H20 N2 O2 -
Comments: Kim, Sung Kuk; Lim, Jong Min; Pradhan, Tuhin; Jung, Hyo Sung; Lynch, Vincent M.; Kim, Jong Seung; Kim, Dongho; Sessler, Jonathan L. Self-association and nitroaromatic-induced deaggregation of pyrene substituted pyridine amides. Journal of the American Chemical Society 136(1) (2014) 495-505
Space group: P -1
Cell volume: 1342.8
Cell parameters: 8.4734; 8.5039; 19.304; 79.287; 79.415; 89.781;  

COD ID: 4121401
CIF file Formula: - C211 H152 Dy F9 N40 O45 S3 Zn16 -
Comments: Trivedi, Evan R.; Eliseeva, Svetlana V.; Jankolovits, Joseph; Olmstead, Marilyn M.; Petoud, Stéphane; Pecoraro, Vincent L. Highly emitting near-infrared lanthanide "encapsulated sandwich" metallacrown complexes with excitation shifted toward lower energy. Journal of the American Chemical Society 136(4) (2014) 1526-1534
Space group: P 4
Cell volume: 12388.2
Cell parameters: 30.4975; 30.4975; 13.3192; 90; 90; 90;  

COD ID: 4121402
CIF file Formula: - C21 H23 Cl Ir N O -
Comments: Turlington, Christopher R.; White, Peter S.; Brookhart, Maurice; Templeton, Joseph L. Oxygen atom transfer to a half-sandwich iridium complex: clean oxidation yielding a molecular product. Journal of the American Chemical Society 136(10) (2014) 3981-3994
Space group: P 1 21/c 1
Cell volume: 1834.47
Cell parameters: 7.2221; 14.9351; 17.0443; 90; 93.767; 90;  

COD ID: 4121403
CIF file Formula: - C23 H27 Cl5 Ir N O2 -
Comments: Turlington, Christopher R.; White, Peter S.; Brookhart, Maurice; Templeton, Joseph L. Oxygen atom transfer to a half-sandwich iridium complex: clean oxidation yielding a molecular product. Journal of the American Chemical Society 136(10) (2014) 3981-3994
Space group: P -1
Cell volume: 1279.14
Cell parameters: 9.1491; 10.4209; 14.3917; 75.867; 87.839; 74.111;  

COD ID: 4121404
CIF file Formula: - C54 H37 B Cl2 F24 Ir N O -
Comments: Turlington, Christopher R.; White, Peter S.; Brookhart, Maurice; Templeton, Joseph L. Oxygen atom transfer to a half-sandwich iridium complex: clean oxidation yielding a molecular product. Journal of the American Chemical Society 136(10) (2014) 3981-3994
Space group: P -1
Cell volume: 2767.98
Cell parameters: 12.814; 13.721; 18.1145; 106.177; 110.323; 98.016;  

COD ID: 4121405
CIF file Formula: - C62 H39 B Cl F30 Ir N2 O -
Comments: Turlington, Christopher R.; White, Peter S.; Brookhart, Maurice; Templeton, Joseph L. Oxygen atom transfer to a half-sandwich iridium complex: clean oxidation yielding a molecular product. Journal of the American Chemical Society 136(10) (2014) 3981-3994
Space group: P 1 21/n 1
Cell volume: 6312.9
Cell parameters: 13.1858; 20.15; 24.1403; 90; 100.181; 90;  

COD ID: 4121407
CIF file Formula: - C27 H33 N4 O9 -
Comments: Parker, Matthew F. L.; Osuna, Sílvia; Bollot, Guillaume; Vaddypally, Shivaiah; Zdilla, Michael J.; Houk, K. N.; Schafmeister, Christian E. Acceleration of an Aromatic Claisen Rearrangement via a Designed Spiroligozyme Catalyst that Mimics the Ketosteroid Isomerase Catalytic Dyad. Journal of the American Chemical Society 136(10) (2014) 3817-3827
Space group: P 21 21 21
Cell volume: 2708.4
Cell parameters: 6.1661; 15.0421; 29.201; 90; 90; 90;  

COD ID: 4121408
CIF file Formula: - C37.9 H29.1 N3.3 O9.3 Zn2 -
Comments: Aggarwal, Himanshu; Bhatt, Prashant M.; Bezuidenhout, Charl X.; Barbour, Leonard J. Direct evidence for single-crystal to single-crystal switching of degree of interpenetration in a metal-organic framework. Journal of the American Chemical Society 136(10) (2014) 3776-3779
Space group: P -1
Cell volume: 2206.08
Cell parameters: 13.0126; 13.1146; 13.9071; 84.956; 69.273; 84.608;  

COD ID: 4121409
CIF file Formula: - C52.2 H32.8 N3.4 O12.4 Zn3 -
Comments: Aggarwal, Himanshu; Bhatt, Prashant M.; Bezuidenhout, Charl X.; Barbour, Leonard J. Direct evidence for single-crystal to single-crystal switching of degree of interpenetration in a metal-organic framework. Journal of the American Chemical Society 136(10) (2014) 3776-3779
Space group: C 1 2 1
Cell volume: 4761.36
Cell parameters: 17.0963; 19.9054; 14.0678; 90; 95.978; 90;  

COD ID: 4121410
CIF file Formula: - C51.96 H32.24 N3.32 O12.32 Zn3 -
Comments: Aggarwal, Himanshu; Bhatt, Prashant M.; Bezuidenhout, Charl X.; Barbour, Leonard J. Direct evidence for single-crystal to single-crystal switching of degree of interpenetration in a metal-organic framework. Journal of the American Chemical Society 136(10) (2014) 3776-3779
Space group: C 1 2 1
Cell volume: 4753.4
Cell parameters: 17.1323; 19.8444; 14.0625; 90; 96.159; 90;  

COD ID: 4121411
CIF file Formula: - C180 H0 B6 N6 O0 S12 -
Comments: Wang, Xiao-Ye; Zhuang, Fang-Dong; Wang, Rui-Bo; Wang, Xin-Chang; Cao, Xiao-Yu; Wang, Jie-Yu; Pei, Jian A Straightforward Strategy toward Large BN-Embedded π-Systems: Synthesis, Structure, and Optoelectronic Properties of Extended BN Heterosuperbenzenes. Journal of the American Chemical Society 136(10) (2014) 3764-3767
Space group: P -1
Cell volume: 7468.4
Cell parameters: 17.574; 20.2877; 21.8764; 76.155; 80.617; 86.112;  

COD ID: 4121412
CIF file Formula: - F10 Hg O2 Te2 -
Comments: Debackere, John R.; Mercier, Hélène P A; Schrobilgen, Gary J. Noble-Gas Difluoride Complexes of Mercury(II): The Syntheses and Structures of Hg(OTeF5)2·1.5NgF2 (Ng = Xe, Kr) and Hg(OTeF5)2. Journal of the American Chemical Society 136(10) (2014) 3888-3903
Space group: C 1 2/c 1
Cell volume: 931.74
Cell parameters: 18.6813; 8.6489; 5.8008; 90; 96.215; 90;  

COD ID: 4121413
CIF file Formula: - F13 Hg O2 Te2 Xe1.5 -
Comments: Debackere, John R.; Mercier, Hélène P A; Schrobilgen, Gary J. Noble-Gas Difluoride Complexes of Mercury(II): The Syntheses and Structures of Hg(OTeF5)2·1.5NgF2 (Ng = Xe, Kr) and Hg(OTeF5)2. Journal of the American Chemical Society 136(10) (2014) 3888-3903
Space group: P 1 21/n 1
Cell volume: 1345.78
Cell parameters: 9.0574; 17.8943; 9.1285; 90; 114.548; 90;  

COD ID: 4121414
CIF file Formula: - F13 Hg Kr1.5 O2 Te2 -
Comments: Debackere, John R.; Mercier, Hélène P A; Schrobilgen, Gary J. Noble-Gas Difluoride Complexes of Mercury(II): The Syntheses and Structures of Hg(OTeF5)2·1.5NgF2 (Ng = Xe, Kr) and Hg(OTeF5)2. Journal of the American Chemical Society 136(10) (2014) 3888-3903
Space group: P 1 21/n 1
Cell volume: 1293.44
Cell parameters: 8.7981; 17.4159; 9.2247; 90; 113.783; 90;  

COD ID: 4121415
CIF file Formula: - C20 H16 Cl2 N6 -
Comments: Pochorovski, Igor; Milić, Jovana; Kolarski, Dušan; Gropp, Cornelius; Schweizer, W. Bernd; Diederich, François Evaluation of Hydrogen-Bond Acceptors for Redox-Switchable Resorcin[4]arene Cavitands. Journal of the American Chemical Society 136(10) (2014) 3852-3858
Space group: P n m a
Cell volume: 1678.44
Cell parameters: 16.288; 19.2991; 5.3395; 90; 90; 90;  

COD ID: 4121416
CIF file Formula: - C113 H100 Cl2 N10 O12 -
Comments: Pochorovski, Igor; Milić, Jovana; Kolarski, Dušan; Gropp, Cornelius; Schweizer, W. Bernd; Diederich, François Evaluation of Hydrogen-Bond Acceptors for Redox-Switchable Resorcin[4]arene Cavitands. Journal of the American Chemical Society 136(10) (2014) 3852-3858
Space group: P 1 21/n 1
Cell volume: 10841
Cell parameters: 18.289; 31.753; 19.041; 90; 101.35; 90;  

COD ID: 4121417
CIF file Formula: - C15 H18 Cl N O2 -
Comments: Wu, Hao; Haeffner, Fredrik; Hoveyda, Amir H. An efficient, practical, and enantioselective method for synthesis of homoallenylamides catalyzed by an aminoalcohol-derived, boron-based catalyst. Journal of the American Chemical Society 136(10) (2014) 3780-3783
Space group: P 1 21 1
Cell volume: 1465.03
Cell parameters: 10.1012; 9.8645; 14.7218; 90; 92.917; 90;  

COD ID: 4121418
CIF file Formula: - C12 H13 N O3 -
Comments: Wu, Hao; Haeffner, Fredrik; Hoveyda, Amir H. An efficient, practical, and enantioselective method for synthesis of homoallenylamides catalyzed by an aminoalcohol-derived, boron-based catalyst. Journal of the American Chemical Society 136(10) (2014) 3780-3783
Space group: P 21 21 21
Cell volume: 1117.4
Cell parameters: 5.6723; 12.279; 16.043; 90; 90; 90;  


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