Crystallography Open Database

Search results

Result : There are 1840 entries in the selection

You can download the COD numbers of the selection as a text file

You can download all files as a single ZIP archive

We are displaying first 300 results.

Searching journal of publication like 'Journal of the American Chemical Society' volume of publication is 138

Formula: - C39 H56 Cu N6 O7 -
Comments: Dhar, Debanjan; Yee, Gereon M.; Spaeth, Andrew D.; Boyce, David W.; Zhang, Hongtu; Dereli, Büsra; Cramer, Christopher J.; Tolman, William B. Perturbing the Copper(III)-Hydroxide Unit through Ligand Structural Variation. Journal of the American Chemical Society 138(1) (2016) 356-368
Space group: P 1 21/n 1
Cell volume: 3934.6
Cell parameters: 8.5387; 30.5348; 15.3867; 90; 101.251; 90;

COD ID: 4124757

CIF file

Formula: - C35 H41 Cu N7 O6 -
Comments: Dhar, Debanjan; Yee, Gereon M.; Spaeth, Andrew D.; Boyce, David W.; Zhang, Hongtu; Dereli, Büsra; Cramer, Christopher J.; Tolman, William B. Perturbing the Copper(III)-Hydroxide Unit through Ligand Structural Variation. Journal of the American Chemical Society 138(1) (2016) 356-368
Space group: P 1 21/c 1
Cell volume: 3637.6
Cell parameters: 10.0248; 14.0793; 26.1018; 90; 99.111; 90;

COD ID: 4124758

CIF file

Formula: - C35 H47 Cu N5 O9 -
Comments: Dhar, Debanjan; Yee, Gereon M.; Spaeth, Andrew D.; Boyce, David W.; Zhang, Hongtu; Dereli, Büsra; Cramer, Christopher J.; Tolman, William B. Perturbing the Copper(III)-Hydroxide Unit through Ligand Structural Variation. Journal of the American Chemical Society 138(1) (2016) 356-368
Space group: P 1 21/c 1
Cell volume: 3541.16
Cell parameters: 10.2606; 13.1441; 26.477; 90; 97.3942; 90;

COD ID: 4124759

CIF file

Formula: - C74 H94 Cu2 N10 O15 -
Comments: Dhar, Debanjan; Yee, Gereon M.; Spaeth, Andrew D.; Boyce, David W.; Zhang, Hongtu; Dereli, Büsra; Cramer, Christopher J.; Tolman, William B. Perturbing the Copper(III)-Hydroxide Unit through Ligand Structural Variation. Journal of the American Chemical Society 138(1) (2016) 356-368
Space group: P -1
Cell volume: 3630.4
Cell parameters: 12.8711; 16.7852; 17.7561; 92.71; 108.615; 90.375;

COD ID: 4124760

CIF file

Formula: - C67 H108 Cu2 N6 Na2 O11 -
Comments: Dhar, Debanjan; Yee, Gereon M.; Spaeth, Andrew D.; Boyce, David W.; Zhang, Hongtu; Dereli, Büsra; Cramer, Christopher J.; Tolman, William B. Perturbing the Copper(III)-Hydroxide Unit through Ligand Structural Variation. Journal of the American Chemical Society 138(1) (2016) 356-368
Space group: C 1 2/c 1
Cell volume: 7208.9
Cell parameters: 28.2007; 10.4931; 24.5728; 90; 97.5196; 90;

COD ID: 4124761

CIF file

Formula: - C34 H54 Cu N3 Na O5 -
Comments: Dhar, Debanjan; Yee, Gereon M.; Spaeth, Andrew D.; Boyce, David W.; Zhang, Hongtu; Dereli, Büsra; Cramer, Christopher J.; Tolman, William B. Perturbing the Copper(III)-Hydroxide Unit through Ligand Structural Variation. Journal of the American Chemical Society 138(1) (2016) 356-368
Space group: P 1
Cell volume: 1857.31
Cell parameters: 10.565; 13.5339; 14.0295; 94.545; 106.021; 102.985;

COD ID: 4124762
CIF file	Formula: - C42 H68 N7 Nb - Comments: Kriegel, Benjamin M.; Bergman, Robert G.; Arnold, John Nitrene Metathesis and Catalytic Nitrene Transfer Promoted by Niobium Bis(imido) Complexes. Journal of the American Chemical Society 138(1) (2016) 52-55 Space group: P 1 21/n 1 Cell volume: 4274.9 Cell parameters: 13.1917; 16.322; 19.9519; 90; 95.67; 90;

COD ID: 4124763
CIF file	Formula: - C56 H72 N5 Nb - Comments: Kriegel, Benjamin M.; Bergman, Robert G.; Arnold, John Nitrene Metathesis and Catalytic Nitrene Transfer Promoted by Niobium Bis(imido) Complexes. Journal of the American Chemical Society 138(1) (2016) 52-55 Space group: P 1 21/c 1 Cell volume: 10055.4 Cell parameters: 32.2869; 13.8363; 24.0429; 90; 110.578; 90;

COD ID: 4124764
CIF file	Formula: - C58 H95 N8 Nb - Comments: Kriegel, Benjamin M.; Bergman, Robert G.; Arnold, John Nitrene Metathesis and Catalytic Nitrene Transfer Promoted by Niobium Bis(imido) Complexes. Journal of the American Chemical Society 138(1) (2016) 52-55 Space group: P 1 21/n 1 Cell volume: 5662.8 Cell parameters: 13.0963; 20.4362; 21.6295; 90; 101.979; 90;

COD ID: 4124765
CIF file	Formula: - C45 H66 N5 Nb O - Comments: Kriegel, Benjamin M.; Bergman, Robert G.; Arnold, John Nitrene Metathesis and Catalytic Nitrene Transfer Promoted by Niobium Bis(imido) Complexes. Journal of the American Chemical Society 138(1) (2016) 52-55 Space group: P 1 21/n 1 Cell volume: 4367.6 Cell parameters: 18.8907; 11.1261; 21.1544; 90; 100.794; 90;

COD ID: 4124766
CIF file	Formula: - C49.75 H76.75 N5 Nb - Comments: Kriegel, Benjamin M.; Bergman, Robert G.; Arnold, John Nitrene Metathesis and Catalytic Nitrene Transfer Promoted by Niobium Bis(imido) Complexes. Journal of the American Chemical Society 138(1) (2016) 52-55 Space group: P 1 21/n 1 Cell volume: 4928.4 Cell parameters: 11.1908; 17.8757; 24.6374; 90; 90.4053; 90;

COD ID: 4124767
CIF file	Formula: - C46 H68 N5 Nb - Comments: Kriegel, Benjamin M.; Bergman, Robert G.; Arnold, John Nitrene Metathesis and Catalytic Nitrene Transfer Promoted by Niobium Bis(imido) Complexes. Journal of the American Chemical Society 138(1) (2016) 52-55 Space group: P 1 21/n 1 Cell volume: 4338.6 Cell parameters: 12.2648; 20.8147; 17.2712; 90; 100.263; 90;

COD ID: 4124768
CIF file	Formula: - C54 H80 N5 Nb - Comments: Kriegel, Benjamin M.; Bergman, Robert G.; Arnold, John Nitrene Metathesis and Catalytic Nitrene Transfer Promoted by Niobium Bis(imido) Complexes. Journal of the American Chemical Society 138(1) (2016) 52-55 Space group: P 1 21/c 1 Cell volume: 5111 Cell parameters: 19.7899; 15.6263; 17.021; 90; 103.833; 90;

COD ID: 4124769
CIF file	Formula: - C36 H59 N4 Nb Si - Comments: Kriegel, Benjamin M.; Bergman, Robert G.; Arnold, John Nitrene Metathesis and Catalytic Nitrene Transfer Promoted by Niobium Bis(imido) Complexes. Journal of the American Chemical Society 138(1) (2016) 52-55 Space group: P -1 Cell volume: 1886.49 Cell parameters: 11.0636; 13.0724; 13.4439; 92.209; 102.071; 96.205;

COD ID: 4124770

CIF file

Formula: - C126.5 H54.5 Cl N4 Ni Sc2 V -
Comments: Wei, Tao; Wang, Song; Lu, Xing; Tan, Yuanzhi; Huang, Jing; Liu, Fupin; Li, Qunxiang; Xie, Suyuan; Yang, Shangfeng Entrapping a Group-VB Transition Metal, Vanadium, within an Endohedral Metallofullerene: VxSc3-xN@Ih-C80 (x = 1, 2). Journal of the American Chemical Society 138(1) (2016) 207-214
Space group: C 1 2/m 1
Cell volume: 7486
Cell parameters: 25.273; 15.103; 19.695; 90; 95.233; 90;

COD ID: 4124771

CIF file

Formula: - C128.5 H56 N5 Ni Sc V2 -
Comments: Wei, Tao; Wang, Song; Lu, Xing; Tan, Yuanzhi; Huang, Jing; Liu, Fupin; Li, Qunxiang; Xie, Suyuan; Yang, Shangfeng Entrapping a Group-VB Transition Metal, Vanadium, within an Endohedral Metallofullerene: VxSc3-xN@Ih-C80 (x = 1, 2). Journal of the American Chemical Society 138(1) (2016) 207-214
Space group: C 1 2/m 1
Cell volume: 7538.1
Cell parameters: 25.2821; 15.1254; 19.7824; 90; 94.822; 90;

COD ID: 4124839

CIF file

Formula: - C64 H34 O20 Zn4 -
Comments: Spanopoulos, Ioannis; Tsangarakis, Constantinos; Klontzas, Emmanuel; Tylianakis, Emmanuel; Froudakis, George; Adil, Karim; Belmabkhout, Youssef; Eddaoudi, Mohamed; Trikalitis, Pantelis N. Reticular Synthesis of HKUST-like tbo-MOFs with Enhanced CH4 Storage. Journal of the American Chemical Society 138(5) (2016) 1568-1574
Space group: F m m m
Cell volume: 29811
Cell parameters: 25.92; 28.56; 40.27; 90; 90; 90;

COD ID: 4124840

CIF file

Formula: - C64 H34 Cu4 O20 -
Comments: Spanopoulos, Ioannis; Tsangarakis, Constantinos; Klontzas, Emmanuel; Tylianakis, Emmanuel; Froudakis, George; Adil, Karim; Belmabkhout, Youssef; Eddaoudi, Mohamed; Trikalitis, Pantelis N. Reticular Synthesis of HKUST-like tbo-MOFs with Enhanced CH4 Storage. Journal of the American Chemical Society 138(5) (2016) 1568-1574
Space group: F m m m
Cell volume: 29247
Cell parameters: 25.616; 28.157; 40.549; 90; 90; 90;

COD ID: 4124841

CIF file

Formula: - C52 H55 N3 O -
Comments: Rajamalli, Pachaiyappan; Senthilkumar, Natarajan; Gandeepan, Parthasarathy; Huang, Pei-Yun; Huang, Min-Jie; Ren-Wu, Chen-Zheng; Yang, Chi-Yu; Chiu, Ming-Jui; Chu, Li-Kang; Lin, Hao-Wu; Cheng, Chien-Hong A New Molecular Design Based on Thermally Activated Delayed Fluorescence for Highly Efficient Organic Light Emitting Diodes. Journal of the American Chemical Society 138(2) (2016) 628-634
Space group: P 1 21/c 1
Cell volume: 4380.94
Cell parameters: 16.3143; 19.5553; 13.7512; 90; 93.026; 90;

COD ID: 4124871
CIF file	Formula: - C49 H42 N2 O - Comments: Yamaguchi, Tetsuo; Kobayashi, Yoichi; Abe, Jiro Fast Negative Photochromism of 1,1'-Binaphthyl-Bridged Phenoxyl-Imidazolyl Radical Complex. Journal of the American Chemical Society 138(3) (2016) 906-913 Space group: P 1 21/c 1 Cell volume: 3710 Cell parameters: 19.913; 10.816; 17.349; 90; 96.843; 90;

COD ID: 4124872
CIF file	Formula: - C51 H45 N3 O - Comments: Yamaguchi, Tetsuo; Kobayashi, Yoichi; Abe, Jiro Fast Negative Photochromism of 1,1'-Binaphthyl-Bridged Phenoxyl-Imidazolyl Radical Complex. Journal of the American Chemical Society 138(3) (2016) 906-913 Space group: P -1 Cell volume: 4043.1 Cell parameters: 11.619; 18.416; 19.597; 77.068; 81.666; 89.163;

COD ID: 4124873
CIF file	Formula: - C53 H48 N2 O3 - Comments: Yamaguchi, Tetsuo; Kobayashi, Yoichi; Abe, Jiro Fast Negative Photochromism of 1,1'-Binaphthyl-Bridged Phenoxyl-Imidazolyl Radical Complex. Journal of the American Chemical Society 138(3) (2016) 906-913 Space group: P 1 21/n 1 Cell volume: 4116 Cell parameters: 10.089; 18.21; 22.72; 90; 99.557; 90;

COD ID: 4124874
CIF file	Formula: - C41 H27 B Br2 O5 - Comments: Qi, Chao; Xiong, Yuan; Eschenbrenner-Lux, Vincent; Cong, Huan; Porco, Jr, John A Asymmetric Syntheses of the Flavonoid Diels-Alder Natural Products Sanggenons C and O. Journal of the American Chemical Society 138(3) (2016) 798-801 Space group: P 1 21 1 Cell volume: 2070.39 Cell parameters: 10.2781; 12.6985; 15.9497; 90; 95.976; 90;

COD ID: 4124875
CIF file	Formula: - C26 H23 Br O2 - Comments: Qi, Chao; Xiong, Yuan; Eschenbrenner-Lux, Vincent; Cong, Huan; Porco, Jr, John A Asymmetric Syntheses of the Flavonoid Diels-Alder Natural Products Sanggenons C and O. Journal of the American Chemical Society 138(3) (2016) 798-801 Space group: P 21 21 21 Cell volume: 2129.8 Cell parameters: 11.8799; 12.0496; 14.8783; 90; 90; 90;

COD ID: 4124876

CIF file

Formula: - C132 H210 Cl6 Mn19 N66 O54 -
Comments: Deng, Yong-Kai; Su, Hai-Feng; Xu, Jia-Heng; Wang, Wen-Guang; Kurmoo, Mohamedally; Lin, Shui-Chao; Tan, Yuan-Zhi; Jia, Jiong; Sun, Di; Zheng, Lan-Sun Hierarchical Assembly of a {Mn(II)15Mn(III)4} Brucite Disc: Step-by-Step Formation and Ferrimagnetism. Journal of the American Chemical Society 138(4) (2016) 1328-1334
Space group: R -3 :H
Cell volume: 15135
Cell parameters: 35.95; 35.95; 13.522; 90; 90; 120;

COD ID: 4124877

CIF file

Formula: - C120 H220 Au28 S20 -
Comments: Chen, Yuxiang; Liu, Chong; Tang, Qing; Zeng, Chenjie; Higaki, Tatsuya; Das, Anindita; Jiang, De-En; Rosi, Nathaniel L.; Jin, Rongchao Isomerism in Au28(SR)20 Nanocluster and Stable Structures. Journal of the American Chemical Society 138(5) (2016) 1482-1485
Space group: P 1 2/c 1
Cell volume: 9901
Cell parameters: 17.156; 26.5424; 21.8954; 90; 96.76; 90;

COD ID: 4124878

CIF file

Formula: - C15 H18 F6 O Si -
Comments: Martinez-Solorio, Dionicio; Melillo, Bruno; Sanchez, Luis; Liang, Yong; Lam, Erwin; Houk, K. N.; Smith, 3rd, Amos B Design, Synthesis, and Validation of an Effective, Reusable Silicon-Based Transfer Agent for Room-Temperature Pd-Catalyzed Cross-Coupling Reactions of Aryl and Heteroaryl Chlorides with Readily Available Aryl Lithium Reagents. Journal of the American Chemical Society 138(6) (2016) 1836-1839
Space group: P 1 21/c 1
Cell volume: 3266.55
Cell parameters: 21.2586; 8.5005; 20.4725; 90; 117.999; 90;

COD ID: 4124879

CIF file

Formula: - C399 H382.5 Cd8 F48 N63.5 O72 S16 -
Comments: Mosquera, Jesús; Ronson, Tanya K.; Nitschke, Jonathan R. Subcomponent Flexibility Enables Conversion between D4-Symmetric Cd(II)8L8 and T-Symmetric Cd(II)4L4 Assemblies. Journal of the American Chemical Society 138(6) (2016) 1812-1815
Space group: C 1 2/c 1
Cell volume: 106323
Cell parameters: 90.538; 27.809; 48.343; 90; 119.129; 90;

COD ID: 4124880
CIF file	Formula: - C190 H177 F24 N27 O36 S8 Zn4 - Comments: Mosquera, Jesús; Ronson, Tanya K.; Nitschke, Jonathan R. Subcomponent Flexibility Enables Conversion between D4-Symmetric Cd(II)8L8 and T-Symmetric Cd(II)4L4 Assemblies. Journal of the American Chemical Society 138(6) (2016) 1812-1815 Space group: P 63 Cell volume: 23780 Cell parameters: 27.046; 27.046; 37.5383; 90; 90; 120;

COD ID: 4124881
CIF file	Formula: - C23 H27 F3 N O P - Comments: Yang, Youqing; Qiu, Xiaodong; Zhao, Yue; Mu, Yucheng; Shi, Zhuangzhi Palladium-Catalyzed C-H Arylation of Indoles at the C7 Position. Journal of the American Chemical Society 138(2) (2016) 495-498 Space group: P n a 21 Cell volume: 2212.5 Cell parameters: 15.285; 17.908; 8.083; 90; 90; 90;

COD ID: 4124882
CIF file	Formula: - C16 H24 N O P - Comments: Yang, Youqing; Qiu, Xiaodong; Zhao, Yue; Mu, Yucheng; Shi, Zhuangzhi Palladium-Catalyzed C-H Arylation of Indoles at the C7 Position. Journal of the American Chemical Society 138(2) (2016) 495-498 Space group: P 1 21/c 1 Cell volume: 3170.1 Cell parameters: 17.5398; 14.2278; 12.7212; 90; 93.043; 90;

COD ID: 4124883
CIF file	Formula: - C22 H28 N O P - Comments: Yang, Youqing; Qiu, Xiaodong; Zhao, Yue; Mu, Yucheng; Shi, Zhuangzhi Palladium-Catalyzed C-H Arylation of Indoles at the C7 Position. Journal of the American Chemical Society 138(2) (2016) 495-498 Space group: P 1 21/c 1 Cell volume: 3995 Cell parameters: 12.662; 16.276; 19.793; 90; 101.671; 90;

COD ID: 4124884
CIF file	Formula: - C22 H27 F N O P - Comments: Yang, Youqing; Qiu, Xiaodong; Zhao, Yue; Mu, Yucheng; Shi, Zhuangzhi Palladium-Catalyzed C-H Arylation of Indoles at the C7 Position. Journal of the American Chemical Society 138(2) (2016) 495-498 Space group: P 1 21/n 1 Cell volume: 2026.2 Cell parameters: 7.771; 19.1; 14.003; 90; 102.865; 90;

COD ID: 4124885
CIF file	Formula: - C12 H16 N O P - Comments: Yang, Youqing; Qiu, Xiaodong; Zhao, Yue; Mu, Yucheng; Shi, Zhuangzhi Palladium-Catalyzed C-H Arylation of Indoles at the C7 Position. Journal of the American Chemical Society 138(2) (2016) 495-498 Space group: P 1 21/c 1 Cell volume: 1163.22 Cell parameters: 13.9522; 7.8417; 11.3721; 90; 110.787; 90;

COD ID: 4124886
CIF file	Formula: - C24 H30 N O3 P - Comments: Yang, Youqing; Qiu, Xiaodong; Zhao, Yue; Mu, Yucheng; Shi, Zhuangzhi Palladium-Catalyzed C-H Arylation of Indoles at the C7 Position. Journal of the American Chemical Society 138(2) (2016) 495-498 Space group: P -1 Cell volume: 1140.7 Cell parameters: 8.3302; 9.3214; 16.577; 76.866; 76.336; 67.324;

COD ID: 4124887

CIF file

Formula: - C35 H65 N9 O9 Si -
Comments: Jones, Jennifer E.; Diemer, Vincent; Adam, Catherine; Raftery, James; Ruscoe, Rebecca E.; Sengel, Jason T.; Wallace, Mark I.; Bader, Antoine; Cockroft, Scott L.; Clayden, Jonathan; Webb, Simon J. Length-Dependent Formation of Transmembrane Pores by 310-Helical α-Aminoisobutyric Acid Foldamers. Journal of the American Chemical Society 138(2) (2016) 688-695
Space group: P 21 21 2
Cell volume: 4635.47
Cell parameters: 21.8742; 23.4736; 9.0278; 90; 90; 90;

COD ID: 4124888

CIF file

Formula: - C39 H71 N11 O9 Si -
Comments: Jones, Jennifer E.; Diemer, Vincent; Adam, Catherine; Raftery, James; Ruscoe, Rebecca E.; Sengel, Jason T.; Wallace, Mark I.; Bader, Antoine; Cockroft, Scott L.; Clayden, Jonathan; Webb, Simon J. Length-Dependent Formation of Transmembrane Pores by 310-Helical α-Aminoisobutyric Acid Foldamers. Journal of the American Chemical Society 138(2) (2016) 688-695
Space group: P -1
Cell volume: 2547.7
Cell parameters: 9.3622; 16.3312; 17.9089; 88.577; 75.902; 73.812;

COD ID: 4124889

CIF file

Formula: - C49 H89 N13 O12 Si -
Comments: Jones, Jennifer E.; Diemer, Vincent; Adam, Catherine; Raftery, James; Ruscoe, Rebecca E.; Sengel, Jason T.; Wallace, Mark I.; Bader, Antoine; Cockroft, Scott L.; Clayden, Jonathan; Webb, Simon J. Length-Dependent Formation of Transmembrane Pores by 310-Helical α-Aminoisobutyric Acid Foldamers. Journal of the American Chemical Society 138(2) (2016) 688-695
Space group: C 1 c 1
Cell volume: 52111
Cell parameters: 39.3342; 18.0326; 73.883; 90; 96.068; 90;

COD ID: 4124890

CIF file

Formula: - C16 H3 F20 I O2 -
Comments: Imada, Yasuyuki; Nakano, Hideyuki; Furukawa, Ko; Kishi, Ryohei; Nakano, Masayoshi; Maruyama, Hitoshi; Nakamoto, Masaaki; Sekiguchi, Akira; Ogawa, Masahiro; Ohta, Toshiaki; Yamamoto, Yohsuke Isolation of Hypervalent Group-16 Radicals and Their Application in Organic-Radical Batteries. Journal of the American Chemical Society 138(2) (2016) 479-482
Space group: P -1
Cell volume: 1015.7
Cell parameters: 8.495; 9.151; 13.099; 94.05; 90.403; 90.57;

COD ID: 4124891

CIF file

Formula: - C24 H23 F20 N O2 S -
Comments: Imada, Yasuyuki; Nakano, Hideyuki; Furukawa, Ko; Kishi, Ryohei; Nakano, Masayoshi; Maruyama, Hitoshi; Nakamoto, Masaaki; Sekiguchi, Akira; Ogawa, Masahiro; Ohta, Toshiaki; Yamamoto, Yohsuke Isolation of Hypervalent Group-16 Radicals and Their Application in Organic-Radical Batteries. Journal of the American Chemical Society 138(2) (2016) 479-482
Space group: C 2 2 21
Cell volume: 2884.8
Cell parameters: 11.9982; 15.44; 15.5724; 90; 90; 90;

COD ID: 4124892

CIF file

Formula: - C16 H11 F20 Li O6 S -
Comments: Imada, Yasuyuki; Nakano, Hideyuki; Furukawa, Ko; Kishi, Ryohei; Nakano, Masayoshi; Maruyama, Hitoshi; Nakamoto, Masaaki; Sekiguchi, Akira; Ogawa, Masahiro; Ohta, Toshiaki; Yamamoto, Yohsuke Isolation of Hypervalent Group-16 Radicals and Their Application in Organic-Radical Batteries. Journal of the American Chemical Society 138(2) (2016) 479-482
Space group: P -1
Cell volume: 2445
Cell parameters: 11.4151; 14.6893; 16.2421; 70.277; 78.78; 73.648;

COD ID: 4124893

CIF file

Formula: - C24 H23 F20 N O2 Se -
Comments: Imada, Yasuyuki; Nakano, Hideyuki; Furukawa, Ko; Kishi, Ryohei; Nakano, Masayoshi; Maruyama, Hitoshi; Nakamoto, Masaaki; Sekiguchi, Akira; Ogawa, Masahiro; Ohta, Toshiaki; Yamamoto, Yohsuke Isolation of Hypervalent Group-16 Radicals and Their Application in Organic-Radical Batteries. Journal of the American Chemical Society 138(2) (2016) 479-482
Space group: P 1 21/n 1
Cell volume: 2980.7
Cell parameters: 11.6841; 15.377; 17.5469; 90; 109.009; 90;

COD ID: 4124894

CIF file

Formula: - C24 H23 F20 Li O6 Se -
Comments: Imada, Yasuyuki; Nakano, Hideyuki; Furukawa, Ko; Kishi, Ryohei; Nakano, Masayoshi; Maruyama, Hitoshi; Nakamoto, Masaaki; Sekiguchi, Akira; Ogawa, Masahiro; Ohta, Toshiaki; Yamamoto, Yohsuke Isolation of Hypervalent Group-16 Radicals and Their Application in Organic-Radical Batteries. Journal of the American Chemical Society 138(2) (2016) 479-482
Space group: P -1
Cell volume: 3242.6
Cell parameters: 11.526; 16.241; 18.58; 88.205; 80.618; 70.946;

COD ID: 4124895

CIF file

Formula: - C16 H3 F20 O2 S -
Comments: Imada, Yasuyuki; Nakano, Hideyuki; Furukawa, Ko; Kishi, Ryohei; Nakano, Masayoshi; Maruyama, Hitoshi; Nakamoto, Masaaki; Sekiguchi, Akira; Ogawa, Masahiro; Ohta, Toshiaki; Yamamoto, Yohsuke Isolation of Hypervalent Group-16 Radicals and Their Application in Organic-Radical Batteries. Journal of the American Chemical Society 138(2) (2016) 479-482
Space group: P 1 21/n 1
Cell volume: 2088.8
Cell parameters: 11.8746; 11.499; 15.7717; 90; 104.091; 90;

COD ID: 4124896

CIF file

Formula: - C16 H3 F20 O2 Se -
Comments: Imada, Yasuyuki; Nakano, Hideyuki; Furukawa, Ko; Kishi, Ryohei; Nakano, Masayoshi; Maruyama, Hitoshi; Nakamoto, Masaaki; Sekiguchi, Akira; Ogawa, Masahiro; Ohta, Toshiaki; Yamamoto, Yohsuke Isolation of Hypervalent Group-16 Radicals and Their Application in Organic-Radical Batteries. Journal of the American Chemical Society 138(2) (2016) 479-482
Space group: P 1 21 1
Cell volume: 2123
Cell parameters: 11.7263; 11.8526; 15.8755; 90; 105.809; 90;

COD ID: 4124897
CIF file	Formula: - C21 H17 Cl N2 O2 - Comments: Qiu, Huang; Srinivas, Harathi D.; Zavalij, Peter Y.; Doyle, Michael P. Unprecedented Intramolecular [4 + 2]-Cycloaddition between a 1,3-Diene and a Diazo Ester. Journal of the American Chemical Society 138(6) (2016) 1808-1811 Space group: P -1 Cell volume: 867.15 Cell parameters: 8.8629; 9.8568; 11.5901; 64.8401; 72.8123; 89.6362;

COD ID: 4124898
CIF file	Formula: - C21 H17 Br N2 O2 - Comments: Qiu, Huang; Srinivas, Harathi D.; Zavalij, Peter Y.; Doyle, Michael P. Unprecedented Intramolecular [4 + 2]-Cycloaddition between a 1,3-Diene and a Diazo Ester. Journal of the American Chemical Society 138(6) (2016) 1808-1811 Space group: C 1 2/c 1 Cell volume: 3643.9 Cell parameters: 37.08; 5.9219; 16.7844; 90; 98.6252; 90;

COD ID: 4124899
CIF file	Formula: - C32 H26 Br Cl2 N3 O4 - Comments: Qiu, Huang; Srinivas, Harathi D.; Zavalij, Peter Y.; Doyle, Michael P. Unprecedented Intramolecular [4 + 2]-Cycloaddition between a 1,3-Diene and a Diazo Ester. Journal of the American Chemical Society 138(6) (2016) 1808-1811 Space group: P 1 21/c 1 Cell volume: 2867.4 Cell parameters: 11.0904; 8.9712; 29.184; 90; 99.062; 90;

COD ID: 4124900

CIF file

Formula: - C23.5 H27 F6 N O2 -
Comments: Zuo, Zhiwei; Cong, Huan; Li, Wei; Choi, Junwon; Fu, Gregory C.; MacMillan, David W. C. Enantioselective Decarboxylative Arylation of α-Amino Acids via the Merger of Photoredox and Nickel Catalysis. Journal of the American Chemical Society 138(6) (2016) 1832-1835
Space group: P 21 21 21
Cell volume: 2285.36
Cell parameters: 5.171; 17.976; 24.5859; 90; 90; 90;

COD ID: 4124901

CIF file

Formula: - C28 H38 B2 Fe N8 O6 -
Comments: Jansze, Suzanne M.; Cecot, Giacomo; Wise, Matthew D.; Zhurov, Konstantin O.; Ronson, Tanya K.; Castilla, Ana M.; Finelli, Alba; Pattison, Philip; Solari, Euro; Scopelliti, Rosario; Zelinskii, Genrikh E.; Vologzhanina, Anna V.; Voloshin, Yan Z.; Nitschke, Jonathan R.; Severin, Kay Ligand Aspect Ratio as a Decisive Factor for the Self-Assembly of Coordination Cages. Journal of the American Chemical Society 138(6) (2016) 2046-2054
Space group: C 1 2/c 1
Cell volume: 3643.7
Cell parameters: 24.958; 8.872; 16.619; 90; 98.044; 90;

COD ID: 4124902

CIF file

Formula: - C140 H141 B24 F32 Fe8 N68 O52.5 Pd4 -
Comments: Jansze, Suzanne M.; Cecot, Giacomo; Wise, Matthew D.; Zhurov, Konstantin O.; Ronson, Tanya K.; Castilla, Ana M.; Finelli, Alba; Pattison, Philip; Solari, Euro; Scopelliti, Rosario; Zelinskii, Genrikh E.; Vologzhanina, Anna V.; Voloshin, Yan Z.; Nitschke, Jonathan R.; Severin, Kay Ligand Aspect Ratio as a Decisive Factor for the Self-Assembly of Coordination Cages. Journal of the American Chemical Society 138(6) (2016) 2046-2054
Space group: P -1
Cell volume: 15604.9
Cell parameters: 23.5385; 24.5623; 29.7285; 86.548; 83.135; 66.14;

COD ID: 4124903

CIF file

Formula: - C352 H480 B32 F32 Fe12 N104 O72 Pd6 -
Comments: Jansze, Suzanne M.; Cecot, Giacomo; Wise, Matthew D.; Zhurov, Konstantin O.; Ronson, Tanya K.; Castilla, Ana M.; Finelli, Alba; Pattison, Philip; Solari, Euro; Scopelliti, Rosario; Zelinskii, Genrikh E.; Vologzhanina, Anna V.; Voloshin, Yan Z.; Nitschke, Jonathan R.; Severin, Kay Ligand Aspect Ratio as a Decisive Factor for the Self-Assembly of Coordination Cages. Journal of the American Chemical Society 138(6) (2016) 2046-2054
Space group: C 1 2/c 1
Cell volume: 57649
Cell parameters: 40.4082; 31.9967; 48.1377; 90; 112.142; 90;

COD ID: 4124904

CIF file

Formula: - C24 H26 B2 Fe N8 O8 -
Comments: Jansze, Suzanne M.; Cecot, Giacomo; Wise, Matthew D.; Zhurov, Konstantin O.; Ronson, Tanya K.; Castilla, Ana M.; Finelli, Alba; Pattison, Philip; Solari, Euro; Scopelliti, Rosario; Zelinskii, Genrikh E.; Vologzhanina, Anna V.; Voloshin, Yan Z.; Nitschke, Jonathan R.; Severin, Kay Ligand Aspect Ratio as a Decisive Factor for the Self-Assembly of Coordination Cages. Journal of the American Chemical Society 138(6) (2016) 2046-2054
Space group: C 1 2/c 1
Cell volume: 2667
Cell parameters: 23.908; 8.0758; 16.326; 90; 122.21; 90;

COD ID: 4124905

CIF file

Formula: - C244 H244 B12 F48 Fe10 N69 O70.5 S16 -
Comments: Jansze, Suzanne M.; Cecot, Giacomo; Wise, Matthew D.; Zhurov, Konstantin O.; Ronson, Tanya K.; Castilla, Ana M.; Finelli, Alba; Pattison, Philip; Solari, Euro; Scopelliti, Rosario; Zelinskii, Genrikh E.; Vologzhanina, Anna V.; Voloshin, Yan Z.; Nitschke, Jonathan R.; Severin, Kay Ligand Aspect Ratio as a Decisive Factor for the Self-Assembly of Coordination Cages. Journal of the American Chemical Society 138(6) (2016) 2046-2054
Space group: P -1
Cell volume: 19222.6
Cell parameters: 28.113; 28.7242; 29.266; 96.234; 114.116; 110.958;

COD ID: 4124906

CIF file

Formula: - C16 H14 B2 Fe N8 O6 -
Comments: Jansze, Suzanne M.; Cecot, Giacomo; Wise, Matthew D.; Zhurov, Konstantin O.; Ronson, Tanya K.; Castilla, Ana M.; Finelli, Alba; Pattison, Philip; Solari, Euro; Scopelliti, Rosario; Zelinskii, Genrikh E.; Vologzhanina, Anna V.; Voloshin, Yan Z.; Nitschke, Jonathan R.; Severin, Kay Ligand Aspect Ratio as a Decisive Factor for the Self-Assembly of Coordination Cages. Journal of the American Chemical Society 138(6) (2016) 2046-2054
Space group: P -1
Cell volume: 924.3
Cell parameters: 6.6568; 12.4735; 13.0553; 61.706; 85.502; 75.77;

COD ID: 4124907

CIF file

Formula: - C270 H288 B12 F48 Fe10 N60 O42 Sb8 -
Comments: Jansze, Suzanne M.; Cecot, Giacomo; Wise, Matthew D.; Zhurov, Konstantin O.; Ronson, Tanya K.; Castilla, Ana M.; Finelli, Alba; Pattison, Philip; Solari, Euro; Scopelliti, Rosario; Zelinskii, Genrikh E.; Vologzhanina, Anna V.; Voloshin, Yan Z.; Nitschke, Jonathan R.; Severin, Kay Ligand Aspect Ratio as a Decisive Factor for the Self-Assembly of Coordination Cages. Journal of the American Chemical Society 138(6) (2016) 2046-2054
Space group: R 3 c :H
Cell volume: 125880
Cell parameters: 28.0944; 28.0944; 184.156; 90; 90; 120;

COD ID: 4124908

CIF file

Formula: - C32 H46 B2 Cl2 Fe N8 O8 -
Comments: Jansze, Suzanne M.; Cecot, Giacomo; Wise, Matthew D.; Zhurov, Konstantin O.; Ronson, Tanya K.; Castilla, Ana M.; Finelli, Alba; Pattison, Philip; Solari, Euro; Scopelliti, Rosario; Zelinskii, Genrikh E.; Vologzhanina, Anna V.; Voloshin, Yan Z.; Nitschke, Jonathan R.; Severin, Kay Ligand Aspect Ratio as a Decisive Factor for the Self-Assembly of Coordination Cages. Journal of the American Chemical Society 138(6) (2016) 2046-2054
Space group: P 1 n 1
Cell volume: 4280.52
Cell parameters: 9.51433; 30.7713; 14.62555; 90; 91.4555; 90;

COD ID: 4124909

CIF file

Formula: - C26.5 H42 B2 Cl2 Fe N8 O8.5 -
Comments: Jansze, Suzanne M.; Cecot, Giacomo; Wise, Matthew D.; Zhurov, Konstantin O.; Ronson, Tanya K.; Castilla, Ana M.; Finelli, Alba; Pattison, Philip; Solari, Euro; Scopelliti, Rosario; Zelinskii, Genrikh E.; Vologzhanina, Anna V.; Voloshin, Yan Z.; Nitschke, Jonathan R.; Severin, Kay Ligand Aspect Ratio as a Decisive Factor for the Self-Assembly of Coordination Cages. Journal of the American Chemical Society 138(6) (2016) 2046-2054
Space group: P 1 21 1
Cell volume: 3784.01
Cell parameters: 14.61747; 12.39563; 20.8854; 90; 90.6913; 90;

COD ID: 4124910

CIF file

Formula: - C26 H16 -
Comments: Uchida, Kazuyuki; Ito, Soichi; Nakano, Masayoshi; Abe, Manabu; Kubo, Takashi Biphenalenylidene: Isolation and Characterization of the Reactive Intermediate on the Decomposition Pathway of Phenalenyl Radical. Journal of the American Chemical Society 138(7) (2016) 2399-2410
Space group: P 1 21 1
Cell volume: 1664.8
Cell parameters: 11.958; 9.5891; 14.538; 90; 92.944; 90;

COD ID: 4124911

CIF file

Formula: - C16 H15 Cl4 N O4 -
Comments: Cornella, Josep; Edwards, Jacob T.; Qin, Tian; Kawamura, Shuhei; Wang, Jie; Pan, Chung-Mao; Gianatassio, Ryan; Schmidt, Michael; Eastgate, Martin D.; Baran, Phil S. Practical Ni-Catalyzed Aryl-Alkyl Cross-Coupling of Secondary Redox-Active Esters. Journal of the American Chemical Society 138(7) (2016) 2174-2177
Space group: P -1
Cell volume: 910.54
Cell parameters: 8.87; 9.1094; 12.6095; 104.489; 90.358; 111.767;

COD ID: 4124912
CIF file	Formula: - C134 H108 F42 N35 O32 Re S14 Zn4 - Comments: Castilla, Ana M.; Ronson, Tanya K.; Nitschke, Jonathan R. Sequence-Dependent Guest Release Triggered by Orthogonal Chemical Signals. Journal of the American Chemical Society 138(7) (2016) 2342-2351 Space group: P -1 Cell volume: 19161 Cell parameters: 22.866; 25.495; 35.966; 88.15; 84.817; 66.58;

COD ID: 4124913
CIF file	Formula: - C200 H150 F48 N34 O32 S16 Zn4 - Comments: Castilla, Ana M.; Ronson, Tanya K.; Nitschke, Jonathan R. Sequence-Dependent Guest Release Triggered by Orthogonal Chemical Signals. Journal of the American Chemical Society 138(7) (2016) 2342-2351 Space group: P -1 Cell volume: 25115 Cell parameters: 24.768; 30.452; 33.974; 79.78; 85.57; 86.58;

COD ID: 4124914
CIF file	Formula: - C136 H108 F48 N36 O32 S16 Zn4 - Comments: Castilla, Ana M.; Ronson, Tanya K.; Nitschke, Jonathan R. Sequence-Dependent Guest Release Triggered by Orthogonal Chemical Signals. Journal of the American Chemical Society 138(7) (2016) 2342-2351 Space group: C 1 2/c 1 Cell volume: 21549.5 Cell parameters: 32.4651; 31.6257; 23.6124; 90; 117.268; 90;

COD ID: 4124915
CIF file	Formula: - C27 H37 I O4 Si - Comments: Hari, Durga Prasad; Waser, Jerome Copper-Catalyzed Oxy-Alkynylation of Diazo Compounds with Hypervalent Iodine Reagents. Journal of the American Chemical Society 138(7) (2016) 2190-2193 Space group: P 1 21/n 1 Cell volume: 2820 Cell parameters: 15.4542; 11.4011; 16.302; 90; 100.951; 90;

COD ID: 4124916
CIF file	Formula: - C15 H18 N2 O2 - Comments: Kong, Wei-Jun; Liu, Yue-Jin; Xu, Hui; Chen, Yan-Qiao; Dai, Hui-Xiong; Yu, Jin-Quan Pd-Catalyzed α-Selective C-H Functionalization of Olefins: En Route to 4-Imino-β-Lactams. Journal of the American Chemical Society 138(7) (2016) 2146-2149 Space group: P 1 21/m 1 Cell volume: 691 Cell parameters: 10.31; 7.0317; 10.73; 90; 117.339; 90;

COD ID: 4124917
CIF file	Formula: - C15 H18 N2 O2 - Comments: Kong, Wei-Jun; Liu, Yue-Jin; Xu, Hui; Chen, Yan-Qiao; Dai, Hui-Xiong; Yu, Jin-Quan Pd-Catalyzed α-Selective C-H Functionalization of Olefins: En Route to 4-Imino-β-Lactams. Journal of the American Chemical Society 138(7) (2016) 2146-2149 Space group: P 1 21/c 1 Cell volume: 1448.6 Cell parameters: 10.6579; 18.645; 7.3052; 90; 93.729; 90;

COD ID: 4124918
CIF file	Formula: - C15 H18 N2 O2 - Comments: Kong, Wei-Jun; Liu, Yue-Jin; Xu, Hui; Chen, Yan-Qiao; Dai, Hui-Xiong; Yu, Jin-Quan Pd-Catalyzed α-Selective C-H Functionalization of Olefins: En Route to 4-Imino-β-Lactams. Journal of the American Chemical Society 138(7) (2016) 2146-2149 Space group: P 1 21/n 1 Cell volume: 1405 Cell parameters: 7.237; 11.544; 16.87; 90; 94.546; 90;

COD ID: 4124919

CIF file

Formula: - C35 H51 Cl2 F6 Fe N5 O6 S2 Si -
Comments: Cussó, Olaf; Cianfanelli, Marco; Ribas, Xavi; Klein Gebbink, Robertus J. M.; Costas, Miquel Iron Catalyzed Highly Enantioselective Epoxidation of Cyclic Aliphatic Enones with Aqueous H2O2. Journal of the American Chemical Society 138(8) (2016) 2732-2738
Space group: P 1 21 1
Cell volume: 2247.4
Cell parameters: 9.2394; 15.092; 16.25; 90; 97.337; 90;

COD ID: 4124920

CIF file

Formula: - C72 H142 Br3 Dy0.05 O9 P4 Y0.95 -
Comments: Chen, Yan-Cong; Liu, Jun-Liang; Ungur, Liviu; Liu, Jiang; Li, Quan-Wen; Wang, Long-Fei; Ni, Zhao-Ping; Chibotaru, Liviu F.; Chen, Xiao-Ming; Tong, Ming-Liang Symmetry-Supported Magnetic Blocking at 20 K in Pentagonal Bipyramidal Dy(III) Single-Ion Magnets. Journal of the American Chemical Society 138(8) (2016) 2829-2837
Space group: C 1 2/c 1
Cell volume: 18765
Cell parameters: 40.347; 14.3228; 33.253; 90; 102.448; 90;

COD ID: 4124921

CIF file

Formula: - C72 H142 Br3 Dy O9 P4 -
Comments: Chen, Yan-Cong; Liu, Jun-Liang; Ungur, Liviu; Liu, Jiang; Li, Quan-Wen; Wang, Long-Fei; Ni, Zhao-Ping; Chibotaru, Liviu F.; Chen, Xiao-Ming; Tong, Ming-Liang Symmetry-Supported Magnetic Blocking at 20 K in Pentagonal Bipyramidal Dy(III) Single-Ion Magnets. Journal of the American Chemical Society 138(8) (2016) 2829-2837
Space group: C 1 2/c 1
Cell volume: 18528.5
Cell parameters: 40.4082; 14.2356; 33.0134; 90; 102.663; 90;

COD ID: 4124922

CIF file

Formula: - C56 H117 Cl3 Dy O10 P3 -
Comments: Chen, Yan-Cong; Liu, Jun-Liang; Ungur, Liviu; Liu, Jiang; Li, Quan-Wen; Wang, Long-Fei; Ni, Zhao-Ping; Chibotaru, Liviu F.; Chen, Xiao-Ming; Tong, Ming-Liang Symmetry-Supported Magnetic Blocking at 20 K in Pentagonal Bipyramidal Dy(III) Single-Ion Magnets. Journal of the American Chemical Society 138(8) (2016) 2829-2837
Space group: P 1 21/n 1
Cell volume: 6698
Cell parameters: 11.7472; 29.5882; 19.4338; 90; 97.434; 90;

COD ID: 4124923

CIF file

Formula: - C56 H117 Cl3 Dy0.05 O10 P3 Y0.95 -
Comments: Chen, Yan-Cong; Liu, Jun-Liang; Ungur, Liviu; Liu, Jiang; Li, Quan-Wen; Wang, Long-Fei; Ni, Zhao-Ping; Chibotaru, Liviu F.; Chen, Xiao-Ming; Tong, Ming-Liang Symmetry-Supported Magnetic Blocking at 20 K in Pentagonal Bipyramidal Dy(III) Single-Ion Magnets. Journal of the American Chemical Society 138(8) (2016) 2829-2837
Space group: P 1 21/n 1
Cell volume: 6707.7
Cell parameters: 11.7525; 29.615; 19.4336; 90; 97.389; 90;

COD ID: 4124924

CIF file

Formula: - As2 Ca0.9 Co1.906 Eu0.1 -
Comments: Tan, Xiaoyan; Fabbris, Gilberto; Haskel, Daniel; Yaroslavtsev, Alexander A.; Cao, Huibo; Thompson, Corey M.; Kovnir, Kirill; Menushenkov, Alexey P.; Chernikov, Roman V.; Garlea, V. Ovidiu; Shatruk, Michael A Transition from Localized to Strongly Correlated Electron Behavior and Mixed Valence Driven by Physical or Chemical Pressure in ACo2As2 (A = Eu and Ca). Journal of the American Chemical Society 138(8) (2016) 2724-2731
Space group: I 4/m m m
Cell volume: 165.781
Cell parameters: 3.9984; 3.9984; 10.3696; 90; 90; 90;

COD ID: 4124925

CIF file

Formula: - As2 Ca Co1.87 -
Comments: Tan, Xiaoyan; Fabbris, Gilberto; Haskel, Daniel; Yaroslavtsev, Alexander A.; Cao, Huibo; Thompson, Corey M.; Kovnir, Kirill; Menushenkov, Alexey P.; Chernikov, Roman V.; Garlea, V. Ovidiu; Shatruk, Michael A Transition from Localized to Strongly Correlated Electron Behavior and Mixed Valence Driven by Physical or Chemical Pressure in ACo2As2 (A = Eu and Ca). Journal of the American Chemical Society 138(8) (2016) 2724-2731
Space group: I 4/m m m
Cell volume: 164.411
Cell parameters: 3.9927; 3.9927; 10.3133; 90; 90; 90;

COD ID: 4124926

CIF file

Formula: - As2 Ca0.845 Co1.888 La0.155 -
Comments: Tan, Xiaoyan; Fabbris, Gilberto; Haskel, Daniel; Yaroslavtsev, Alexander A.; Cao, Huibo; Thompson, Corey M.; Kovnir, Kirill; Menushenkov, Alexey P.; Chernikov, Roman V.; Garlea, V. Ovidiu; Shatruk, Michael A Transition from Localized to Strongly Correlated Electron Behavior and Mixed Valence Driven by Physical or Chemical Pressure in ACo2As2 (A = Eu and Ca). Journal of the American Chemical Society 138(8) (2016) 2724-2731
Space group: I 4/m m m
Cell volume: 166.111
Cell parameters: 4.0018; 4.0018; 10.3726; 90; 90; 90;

COD ID: 4124927

CIF file

Formula: - As2 Co2 Eu -
Comments: Tan, Xiaoyan; Fabbris, Gilberto; Haskel, Daniel; Yaroslavtsev, Alexander A.; Cao, Huibo; Thompson, Corey M.; Kovnir, Kirill; Menushenkov, Alexey P.; Chernikov, Roman V.; Garlea, V. Ovidiu; Shatruk, Michael A Transition from Localized to Strongly Correlated Electron Behavior and Mixed Valence Driven by Physical or Chemical Pressure in ACo2As2 (A = Eu and Ca). Journal of the American Chemical Society 138(8) (2016) 2724-2731
Space group: I 4/m m m
Cell volume: 177.71
Cell parameters: 3.929; 3.929; 11.512; 90; 90; 90;

COD ID: 4124928
CIF file	Formula: - C13.5 H16 Cu F6 N6 S2 - Comments: Xie, Da; King, Tyler L.; Banerjee, Arnab; Kohli, Vikraant; Que, Emily L. Exploiting Copper Redox for (19)F Magnetic Resonance-Based Detection of Cellular Hypoxia. Journal of the American Chemical Society 138(9) (2016) 2937-2940 Space group: P -1 Cell volume: 997.44 Cell parameters: 8.7222; 9.0474; 13.4007; 72.361; 82.014; 89.406;

COD ID: 4124929
CIF file	Formula: - C9 H13 Cu F3 N6 S2 - Comments: Xie, Da; King, Tyler L.; Banerjee, Arnab; Kohli, Vikraant; Que, Emily L. Exploiting Copper Redox for (19)F Magnetic Resonance-Based Detection of Cellular Hypoxia. Journal of the American Chemical Society 138(9) (2016) 2937-2940 Space group: P 1 21/n 1 Cell volume: 1491.45 Cell parameters: 18.3804; 4.2514; 19.3037; 90; 98.606; 90;

COD ID: 4124930

CIF file

Formula: - C48.25 H77 N5 O P Si2 -
Comments: Troadec, Thibault; Lopez Reyes, Morelia; Rodriguez, Ricardo; Baceiredo, Antoine; Saffon-Merceron, Nathalie; Branchadell, Vicenç; Kato, Tsuyoshi Donor-Stabilized Silacyclobutanone: A Precursor of 1-Silaketene via Retro-[2 + 2]-Cycloaddition Reaction at Room Temperature. Journal of the American Chemical Society 138(9) (2016) 2965-2968
Space group: P -1
Cell volume: 4842.1
Cell parameters: 10.043; 21.568; 22.489; 90.129; 90.63; 96.237;

COD ID: 4124931

CIF file

Formula: - C60.5 H78 N3 O P Si2 -
Comments: Troadec, Thibault; Lopez Reyes, Morelia; Rodriguez, Ricardo; Baceiredo, Antoine; Saffon-Merceron, Nathalie; Branchadell, Vicenç; Kato, Tsuyoshi Donor-Stabilized Silacyclobutanone: A Precursor of 1-Silaketene via Retro-[2 + 2]-Cycloaddition Reaction at Room Temperature. Journal of the American Chemical Society 138(9) (2016) 2965-2968
Space group: P 1 21/n 1
Cell volume: 5913.2
Cell parameters: 12.4232; 26.8031; 18.2009; 90; 102.66; 90;

COD ID: 4124932

CIF file

Formula: - C84 H132 N6 O5 P2 Si4 -
Comments: Troadec, Thibault; Lopez Reyes, Morelia; Rodriguez, Ricardo; Baceiredo, Antoine; Saffon-Merceron, Nathalie; Branchadell, Vicenç; Kato, Tsuyoshi Donor-Stabilized Silacyclobutanone: A Precursor of 1-Silaketene via Retro-[2 + 2]-Cycloaddition Reaction at Room Temperature. Journal of the American Chemical Society 138(9) (2016) 2965-2968
Space group: P 31 2 1
Cell volume: 6283.1
Cell parameters: 15.3555; 15.3555; 30.769; 90; 90; 120;

COD ID: 4124933

CIF file

Formula: - C62 H78 N3 O P Si3 -
Comments: Troadec, Thibault; Lopez Reyes, Morelia; Rodriguez, Ricardo; Baceiredo, Antoine; Saffon-Merceron, Nathalie; Branchadell, Vicenç; Kato, Tsuyoshi Donor-Stabilized Silacyclobutanone: A Precursor of 1-Silaketene via Retro-[2 + 2]-Cycloaddition Reaction at Room Temperature. Journal of the American Chemical Society 138(9) (2016) 2965-2968
Space group: P 1 21/c 1
Cell volume: 5557
Cell parameters: 19.603; 13.44; 22.585; 90; 110.951; 90;

COD ID: 4124934

CIF file

Formula: - C44 H30 Cl2 N2 S -
Comments: Hong, Jung-Ho; Aslam, Adil S.; Ishida, Masatoshi; Mori, Shigeki; Furuta, Hiroyuki; Cho, Dong-Gyu 2-(Naphthalen-1-yl)thiophene as a New Motif for Porphyrinoids: Meso-Fused Carbaporphyrin. Journal of the American Chemical Society 138(15) (2016) 4992-4995
Space group: P -1
Cell volume: 1622.3
Cell parameters: 9.26; 13.682; 14.851; 108.401; 98.141; 109.143;

COD ID: 4124935

CIF file

Formula: - C47 H36 N2 O Pd S -
Comments: Hong, Jung-Ho; Aslam, Adil S.; Ishida, Masatoshi; Mori, Shigeki; Furuta, Hiroyuki; Cho, Dong-Gyu 2-(Naphthalen-1-yl)thiophene as a New Motif for Porphyrinoids: Meso-Fused Carbaporphyrin. Journal of the American Chemical Society 138(15) (2016) 4992-4995
Space group: P -1
Cell volume: 1743.5
Cell parameters: 9.169; 13.469; 15.617; 107.223; 100.014; 102.029;

COD ID: 4124936

CIF file

Formula: - C280 H364 Au44 S28 -
Comments: Zeng, Chenjie; Chen, Yuxiang; Iida, Kenji; Nobusada, Katsuyuki; Kirschbaum, Kristin; Lambright, Kelly J.; Jin, Rongchao Gold Quantum Boxes: On the Periodicities and the Quantum Confinement in the Au28, Au36, Au44, and Au52 Magic Series. Journal of the American Chemical Society 138(12) (2016) 3950
Space group: C 1 2/c 1
Cell volume: 34842
Cell parameters: 42.258; 20.861; 43.42; 90; 114.457; 90;

COD ID: 4124937

CIF file

Formula: - C28 H59 Lu O Si4 -
Comments: Conley, Matthew P.; Lapadula, Giuseppe; Sanders, Kevin; Gajan, David; Lesage, Anne; Del Rosal, Iker; Maron, Laurent; Lukens, Wayne W.; Copéret, Christophe; Andersen, Richard A. The Nature of Secondary Interactions at Electrophilic Metal Sites of Molecular and Silica-Supported Organolutetium Complexes from Solid-State NMR Spectroscopy. Journal of the American Chemical Society 138(11) (2016) 3831-3843
Space group: P -1
Cell volume: 3561.7
Cell parameters: 12.802; 13.5388; 20.551; 89.663; 89.314; 89.923;

COD ID: 4124938

CIF file

Formula: - C24 H57 Lu Si6.73 -
Comments: Conley, Matthew P.; Lapadula, Giuseppe; Sanders, Kevin; Gajan, David; Lesage, Anne; Del Rosal, Iker; Maron, Laurent; Lukens, Wayne W.; Copéret, Christophe; Andersen, Richard A. The Nature of Secondary Interactions at Electrophilic Metal Sites of Molecular and Silica-Supported Organolutetium Complexes from Solid-State NMR Spectroscopy. Journal of the American Chemical Society 138(11) (2016) 3831-3843
Space group: P 3 1 c
Cell volume: 1939.69
Cell parameters: 16.1659; 16.1659; 8.57041; 90; 90; 120;

COD ID: 4124939

CIF file

Formula: - C140 H244 Lu4 O8 Si8 -
Comments: Conley, Matthew P.; Lapadula, Giuseppe; Sanders, Kevin; Gajan, David; Lesage, Anne; Del Rosal, Iker; Maron, Laurent; Lukens, Wayne W.; Copéret, Christophe; Andersen, Richard A. The Nature of Secondary Interactions at Electrophilic Metal Sites of Molecular and Silica-Supported Organolutetium Complexes from Solid-State NMR Spectroscopy. Journal of the American Chemical Society 138(11) (2016) 3831-3843
Space group: P -1
Cell volume: 3739.6
Cell parameters: 12.6449; 14.338; 22.5972; 69.3403; 77.9753; 89.5638;

COD ID: 4124940

CIF file

Formula: - C19 H20 N2 O3 -
Comments: Izquierdo, Joseba; Landa, Aitor; Bastida, Iñaki; López, Rosa; Oiarbide, Mikel; Palomo, Claudio Base-Catalyzed Asymmetric α-Functionalization of 2-(Cyanomethyl)azaarene N-Oxides Leading to Quaternary Stereocenters. Journal of the American Chemical Society 138(10) (2016) 3282-3285
Space group: P 1 21 1
Cell volume: 837.31
Cell parameters: 6.47304; 15.3437; 8.7824; 90; 106.276; 90;

COD ID: 4124941

CIF file

Formula: - C30 H31 N5 O8 -
Comments: Izquierdo, Joseba; Landa, Aitor; Bastida, Iñaki; López, Rosa; Oiarbide, Mikel; Palomo, Claudio Base-Catalyzed Asymmetric α-Functionalization of 2-(Cyanomethyl)azaarene N-Oxides Leading to Quaternary Stereocenters. Journal of the American Chemical Society 138(10) (2016) 3282-3285
Space group: P 1 21 1
Cell volume: 1526.06
Cell parameters: 10.8427; 11.51906; 12.7877; 90; 107.159; 90;

COD ID: 4124942
CIF file	Formula: - C20 H20 Br N Si - Comments: Ma, Yuanhong; Wang, Baoli; Zhang, Liang; Hou, Zhaomin Boron-Catalyzed Aromatic C-H Bond Silylation with Hydrosilanes. Journal of the American Chemical Society 138(11) (2016) 3663-3666 Space group: P 1 21/n 1 Cell volume: 1879.16 Cell parameters: 10.2159; 9.57; 19.2612; 90; 93.705; 90;

COD ID: 4124943
CIF file	Formula: - C32 H33 Co2 F18 N6 O6.88 P3 - Comments: Ullman, Andrew M.; Brodsky, Casey N.; Li, Nancy; Zheng, Shao-Liang; Nocera, Daniel G. Probing Edge Site Reactivity of Oxidic Cobalt Water Oxidation Catalysts. Journal of the American Chemical Society 138(12) (2016) 4229 Space group: C 1 2/c 1 Cell volume: 8528.9 Cell parameters: 16.8026; 26.903; 18.9027; 90; 93.495; 90;

COD ID: 4124944
CIF file	Formula: - C160 H146 Cl11 Co10 N30 O102 P5 - Comments: Ullman, Andrew M.; Brodsky, Casey N.; Li, Nancy; Zheng, Shao-Liang; Nocera, Daniel G. Probing Edge Site Reactivity of Oxidic Cobalt Water Oxidation Catalysts. Journal of the American Chemical Society 138(12) (2016) 4229 Space group: P 1 21/m 1 Cell volume: 11318 Cell parameters: 13.602; 34.516; 24.963; 90; 105.046; 90;

COD ID: 4124945
CIF file	Formula: - C29 H25 N3 O7 S2 - Comments: Li, Yong; Zhu, Shugao; Li, Jian; Li, Ang Asymmetric Total Syntheses of Aspidodasycarpine, Lonicerine, and the Proposed Structure of Lanciferine. Journal of the American Chemical Society 138(12) (2016) 3982 Space group: P 21 21 21 Cell volume: 2724.4 Cell parameters: 10.458; 10.973; 23.741; 90; 90; 90;

COD ID: 4124946
CIF file	Formula: - C32 H34 N2 O4 S - Comments: Li, Yong; Zhu, Shugao; Li, Jian; Li, Ang Asymmetric Total Syntheses of Aspidodasycarpine, Lonicerine, and the Proposed Structure of Lanciferine. Journal of the American Chemical Society 138(12) (2016) 3982 Space group: P 1 21/n 1 Cell volume: 2800.1 Cell parameters: 9.9032; 16.5182; 17.4642; 90; 101.444; 90;

COD ID: 4124947
CIF file	Formula: - C35 H36 N2 O8 S - Comments: Li, Yong; Zhu, Shugao; Li, Jian; Li, Ang Asymmetric Total Syntheses of Aspidodasycarpine, Lonicerine, and the Proposed Structure of Lanciferine. Journal of the American Chemical Society 138(12) (2016) 3982 Space group: P -1 Cell volume: 1731.3 Cell parameters: 7.9051; 12.8088; 17.3521; 93.167; 98.943; 92.014;

COD ID: 4124948

CIF file

Formula: - C27 H46 B F3 N6 O3 S Zn -
Comments: Hayes, Ellen C.; Porter, Thomas R.; Barrows, Charles J.; Kaminsky, Werner; Mayer, James M.; Stoll, Stefan Electronic Structure of a Cu(II)-Alkoxide Complex Modeling Intermediates in Copper-Catalyzed Alcohol Oxidations. Journal of the American Chemical Society 138(12) (2016) 4132
Space group: P 1 21/n 1
Cell volume: 3290
Cell parameters: 10.4203; 20.5076; 15.4032; 90; 91.771; 90;

COD ID: 4124949

CIF file

Formula: - C40 H63 Fe K N2 O P3 Si -
Comments: Rittle, Jonathan; Peters, Jonas C. An Fe-N2 Complex That Generates Hydrazine and Ammonia via Fe═NNH2: Demonstrating a Hybrid Distal-to-Alternating Pathway for N2 Reduction. Journal of the American Chemical Society 138(12) (2016) 4243
Space group: P -1
Cell volume: 2129.46
Cell parameters: 10.364; 10.9643; 18.9571; 88.362; 84.43; 83.401;

COD ID: 4124950

CIF file

Formula: - C76.3 H85 B F24 Fe N2 O2 P3 Si -
Comments: Rittle, Jonathan; Peters, Jonas C. An Fe-N2 Complex That Generates Hydrazine and Ammonia via Fe═NNH2: Demonstrating a Hybrid Distal-to-Alternating Pathway for N2 Reduction. Journal of the American Chemical Society 138(12) (2016) 4243
Space group: P -1
Cell volume: 3930.1
Cell parameters: 12.9079; 16.5462; 19.6878; 75.755; 77.192; 78.758;

COD ID: 4124951

CIF file

Formula: - C45.5 H67.35 F3 Fe N2 O5 P3 S Si -
Comments: Rittle, Jonathan; Peters, Jonas C. An Fe-N2 Complex That Generates Hydrazine and Ammonia via Fe═NNH2: Demonstrating a Hybrid Distal-to-Alternating Pathway for N2 Reduction. Journal of the American Chemical Society 138(12) (2016) 4243
Space group: C 1 2/c 1
Cell volume: 10394.4
Cell parameters: 27.371; 12.5437; 31.967; 90; 108.726; 90;

COD ID: 4124952

CIF file

Formula: - C39 H60 F3 Fe N2 O3 P3 S Si -
Comments: Rittle, Jonathan; Peters, Jonas C. An Fe-N2 Complex That Generates Hydrazine and Ammonia via Fe═NNH2: Demonstrating a Hybrid Distal-to-Alternating Pathway for N2 Reduction. Journal of the American Chemical Society 138(12) (2016) 4243
Space group: P n a 21
Cell volume: 4236.2
Cell parameters: 20.9744; 14.6729; 13.7649; 90; 90; 90;

COD ID: 4124953

CIF file

Formula: - C38 H60 Fe N2 P3 Si -
Comments: Rittle, Jonathan; Peters, Jonas C. An Fe-N2 Complex That Generates Hydrazine and Ammonia via Fe═NNH2: Demonstrating a Hybrid Distal-to-Alternating Pathway for N2 Reduction. Journal of the American Chemical Society 138(12) (2016) 4243
Space group: P -1
Cell volume: 1863.1
Cell parameters: 10.3195; 10.8239; 19.347; 78.665; 78.078; 62.522;

COD ID: 4124954

CIF file

HKL data

Formula: - Ca1.44 Mg1.44 Na2.56 O24 Sc2.56 Si8 -
Comments: Zhiguo Xia; Guokui Liu; Jianguo Wen; Zhigang Mei; Mahalingam Balasubramanian; Maxim S. Molokeev; Licong Peng; Lin Gu; Dean J. Miller; Quanlin Liu; Kenneth R. Poeppelmeier Tuning of Photoluminescence by Cation Nanosegregation in the (CaMg)x(NaSc)1-xSi2O6 Solid Solution Journal of the American Chemical Society 138(4) (2016) 1158-1161
Space group: C 1 2/c 1
Cell volume: 450.61
Cell parameters: 9.8048; 9.0206; 5.31486; 90; 106.544; 90;

COD ID: 4124955

CIF file

Formula: - C40 H48 N0.68 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8244
Cell parameters: 23.873; 8.3386; 42.097; 90; 100.33; 90;

COD ID: 4124956

CIF file

Formula: - C40 H48 O8 Si4 Xe0.79 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8273.9
Cell parameters: 23.804; 8.3344; 42.266; 90; 99.346; 90;

COD ID: 4124957

CIF file

Formula: - C40.8 H50.4 F0.8 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8223.7
Cell parameters: 23.828; 8.3065; 42.146; 90; 99.653; 90;

COD ID: 4124958

CIF file

Formula: - C40.84 H51.36 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8252
Cell parameters: 23.834; 8.3285; 42.189; 90; 99.798; 90;

COD ID: 4124959

CIF file

Formula: - C40 H48 Kr0.51 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8233.5
Cell parameters: 23.823; 8.3369; 42.087; 90; 99.935; 90;

COD ID: 4124960

CIF file

Formula: - C40.83 H51.32 O8 S0.83 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8277.6
Cell parameters: 23.8489; 8.3186; 42.289; 90; 99.377; 90;

COD ID: 4124961

CIF file

Formula: - C40 H48 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8395.6
Cell parameters: 23.909; 8.4216; 42.409; 90; 100.522; 90;

COD ID: 4124962

CIF file

Formula: - C40 H48.58 O8.29 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8218.4
Cell parameters: 23.8634; 8.3296; 42.051; 90; 100.508; 90;

COD ID: 4124963

CIF file

Formula: - C40 H48.42 O8.21 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8245.6
Cell parameters: 23.896; 8.3362; 42.099; 90; 100.506; 90;

COD ID: 4124964

CIF file

Formula: - C41 H51 Cl O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8279.8
Cell parameters: 23.819; 8.3375; 42.216; 90; 99.032; 90;

COD ID: 4124965

CIF file

Formula: - C40 H48 Kr0.52 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8224.6
Cell parameters: 23.806; 8.3338; 42.087; 90; 99.934; 90;

COD ID: 4124966

CIF file

Formula: - C40.36 H48 O8.72 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8212
Cell parameters: 23.891; 8.3191; 41.994; 90; 100.294; 90;

COD ID: 4124967

CIF file

Formula: - C40.74 H49.48 Br0.74 Cl0.74 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8404
Cell parameters: 23.765; 8.4219; 42.791; 90; 101.108; 90;

COD ID: 4124968

CIF file

Formula: - C41 H51 Br O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8307.2
Cell parameters: 23.781; 8.3577; 42.317; 90; 98.998; 90;

COD ID: 4124969

CIF file

Formula: - C40 H48 N0.28 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8228.4
Cell parameters: 23.87; 8.3289; 42.091; 90; 100.485; 90;

COD ID: 4124970

CIF file

Formula: - C40 H48 N0.46 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8284
Cell parameters: 23.925; 8.351; 42.16; 90; 100.429; 90;

COD ID: 4124971

CIF file

Formula: - C40 H48 O8 Si4 Xe0.77 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8252.2
Cell parameters: 23.785; 8.3252; 42.237; 90; 99.359; 90;

COD ID: 4124972

CIF file

Formula: - C41.16 H51.48 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8270.7
Cell parameters: 23.8264; 8.3413; 42.248; 90; 99.931; 90;

COD ID: 4124973

CIF file

Formula: - C41 H51 I O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8370.9
Cell parameters: 23.7418; 8.3761; 42.667; 90; 99.403; 90;

COD ID: 4124974

CIF file

Formula: - C41.44 H52.32 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8270.5
Cell parameters: 23.7918; 8.3456; 42.268; 90; 99.785; 90;

COD ID: 4124975

CIF file

Formula: - C42 H53 Cl O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8445.9
Cell parameters: 23.598; 8.4762; 42.844; 90; 99.75; 90;

COD ID: 4124976

CIF file

Formula: - C40.85 H49.7 Cl1.7 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8377.7
Cell parameters: 23.844; 8.3749; 42.788; 90; 101.337; 90;

COD ID: 4124977

CIF file

Formula: - C41.22 H50.44 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8244.7
Cell parameters: 23.8542; 8.3297; 42.074; 90; 99.53; 90;

COD ID: 4124978

CIF file

Formula: - C40.23 H48.69 F0.23 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8211
Cell parameters: 23.835; 8.3212; 42.075; 90; 100.274; 90;

COD ID: 4124979

CIF file

Formula: - C40 H49.7 O8 S0.85 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8216
Cell parameters: 23.828; 8.3023; 42.093; 90; 99.374; 90;

COD ID: 4124980

CIF file

Formula: - C40.46 H48 O8.92 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8213.5
Cell parameters: 23.901; 8.3164; 41.986; 90; 100.205; 90;

COD ID: 4124981

CIF file

Formula: - C41 H51 N O10 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8276.8
Cell parameters: 23.922; 8.283; 42.467; 90; 100.387; 90;

COD ID: 4124982

CIF file

Formula: - C41.16 H51.48 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8284.2
Cell parameters: 23.8337; 8.349; 42.261; 90; 99.898; 90;

COD ID: 4124983

CIF file

Formula: - C40.67 H50.68 O8.67 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8230.1
Cell parameters: 23.906; 8.3015; 42.15; 90; 100.301; 90;

COD ID: 4124984

CIF file

Formula: - C40.37 H49.39 F0.37 O8.14 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8218.1
Cell parameters: 23.851; 8.3122; 42.101; 90; 100.069; 90;

COD ID: 4124985

CIF file

Formula: - C40 H48 Ar0.61 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8219
Cell parameters: 23.804; 8.3353; 42.068; 90; 100.038; 90;

COD ID: 4124986

CIF file

Formula: - C40 H48 O8 Si4 Xe0.79 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8271
Cell parameters: 23.797; 8.333; 42.275; 90; 99.38; 90;

COD ID: 4124987

CIF file

Formula: - C40 H48 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8238.7
Cell parameters: 23.878; 8.3377; 42.105; 90; 100.631; 90;

COD ID: 4124988

CIF file

Formula: - C40 H48 I0.12 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8242.4
Cell parameters: 23.86; 8.3389; 42.135; 90; 100.525; 90;

COD ID: 4124989

CIF file

Formula: - C41.64 H52.92 O8.82 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8348.6
Cell parameters: 23.811; 8.3707; 42.646; 90; 100.829; 90;

COD ID: 4124990

CIF file

Formula: - C40 H48 Kr0.07 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8219.6
Cell parameters: 23.8513; 8.3338; 42.06; 90; 100.528; 90;

COD ID: 4124991

CIF file

Formula: - C41.3 H50.6 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8235.9
Cell parameters: 23.842; 8.3261; 42.069; 90; 99.529; 90;

COD ID: 4124992

CIF file

Formula: - C41 H51 Cl O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8270.1
Cell parameters: 23.782; 8.3354; 42.228; 90; 98.903; 90;

COD ID: 4124993

CIF file

Formula: - C40.26 H48.78 O8.13 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8240.6
Cell parameters: 23.867; 8.3297; 42.143; 90; 100.399; 90;

COD ID: 4124994

CIF file

Formula: - C40.79 H51.16 O8 Si4 -
Comments: Kane, Christopher M.; Banisafar, Arash; Dougherty, Timothy P.; Barbour, Leonard J.; Holman, K. Travis Enclathration and Confinement of Small Gases by the Intrinsically 0D Porous Molecular Solid, Me,H,SiMe2. Journal of the American Chemical Society 138(13) (2016) 4377-4392
Space group: C 1 2/c 1
Cell volume: 8253.7
Cell parameters: 23.839; 8.3267; 42.192; 90; 99.767; 90;

COD ID: 4124995

CIF file

Formula: - C86 H85 B F24 N4 Si2 -
Comments: Arz, Marius I.; Straßmann, Martin; Geiß, Daniel; Schnakenburg, Gregor; Filippou, Alexander C. Addition of Small Electrophiles to N-Heterocyclic-Carbene-Stabilized Disilicon(0): A Revisit of the Isolobal Concept in Low-Valent Silicon Chemistry. Journal of the American Chemical Society 138(13) (2016) 4589-4600
Space group: P -1
Cell volume: 4315.3
Cell parameters: 12.6179; 16.9418; 21.2119; 80.997; 74.486; 87.144;

COD ID: 4124996

CIF file

Formula: - C84 H86 B F20 Li N4 Si2 -
Comments: Arz, Marius I.; Straßmann, Martin; Geiß, Daniel; Schnakenburg, Gregor; Filippou, Alexander C. Addition of Small Electrophiles to N-Heterocyclic-Carbene-Stabilized Disilicon(0): A Revisit of the Isolobal Concept in Low-Valent Silicon Chemistry. Journal of the American Chemical Society 138(13) (2016) 4589-4600
Space group: A e a 2
Cell volume: 16523.1
Cell parameters: 21.7127; 29.2279; 26.0364; 90; 90; 90;

COD ID: 4124997

CIF file

Formula: - C86 H84 B F24 N4 Na Si2 -
Comments: Arz, Marius I.; Straßmann, Martin; Geiß, Daniel; Schnakenburg, Gregor; Filippou, Alexander C. Addition of Small Electrophiles to N-Heterocyclic-Carbene-Stabilized Disilicon(0): A Revisit of the Isolobal Concept in Low-Valent Silicon Chemistry. Journal of the American Chemical Society 138(13) (2016) 4589-4600
Space group: I 1 2/a 1
Cell volume: 8604
Cell parameters: 17.9849; 22.4945; 21.353; 90; 95.132; 90;

COD ID: 4124998

CIF file

Formula: - C87 H87 B F24 N4 Si2 -
Comments: Arz, Marius I.; Straßmann, Martin; Geiß, Daniel; Schnakenburg, Gregor; Filippou, Alexander C. Addition of Small Electrophiles to N-Heterocyclic-Carbene-Stabilized Disilicon(0): A Revisit of the Isolobal Concept in Low-Valent Silicon Chemistry. Journal of the American Chemical Society 138(13) (2016) 4589-4600
Space group: P -1
Cell volume: 4342.8
Cell parameters: 12.5317; 16.8752; 21.5506; 81.388; 74.544; 87.162;

COD ID: 4124999

CIF file

Formula: - C88 H89 B F24 N4 Si2 -
Comments: Arz, Marius I.; Straßmann, Martin; Geiß, Daniel; Schnakenburg, Gregor; Filippou, Alexander C. Addition of Small Electrophiles to N-Heterocyclic-Carbene-Stabilized Disilicon(0): A Revisit of the Isolobal Concept in Low-Valent Silicon Chemistry. Journal of the American Chemical Society 138(13) (2016) 4589-4600
Space group: P -1
Cell volume: 4326.1
Cell parameters: 12.6984; 16.103; 21.2179; 86.027; 88.262; 89.457;

COD ID: 4125000

CIF file

Formula: - C50.5 H79 Br2 Cl P4 Pt2 -
Comments: Yan, Xuzhou; Wang, Ming; Cook, Timothy R.; Zhang, Mingming; Saha, Manik Lal; Zhou, Zhixuan; Li, Xiaopeng; Huang, Feihe; Stang, Peter J. Light-Emitting Superstructures with Anion Effect: Coordination-Driven Self-Assembly of Pure Tetraphenylethylene Metallacycles and Metallacages. Journal of the American Chemical Society 138(13) (2016) 4580-4588
Space group: P 1 21/n 1
Cell volume: 5530.4
Cell parameters: 22.2131; 10.9141; 24.0009; 90; 108.11; 90;

COD ID: 4125001

CIF file

Formula: - C50 H78 N2 O6 P4 Pt2 -
Comments: Yan, Xuzhou; Wang, Ming; Cook, Timothy R.; Zhang, Mingming; Saha, Manik Lal; Zhou, Zhixuan; Li, Xiaopeng; Huang, Feihe; Stang, Peter J. Light-Emitting Superstructures with Anion Effect: Coordination-Driven Self-Assembly of Pure Tetraphenylethylene Metallacycles and Metallacages. Journal of the American Chemical Society 138(13) (2016) 4580-4588
Space group: P -1
Cell volume: 16795.6
Cell parameters: 24.1826; 24.3191; 29.0112; 83.595; 83.303; 85.177;

COD ID: 4125002

CIF file

Formula: - C52 H74 B2 N5 Sn -
Comments: Protchenko, Andrey V.; Bates, Joshua I.; Saleh, Liban M. A.; Blake, Matthew P.; Schwarz, Andrew D.; Kolychev, Eugene L.; Thompson, Amber L.; Jones, Cameron; Mountford, Philip; Aldridge, Simon Enabling and Probing Oxidative Addition and Reductive Elimination at a Group 14 Metal Center: Cleavage and Functionalization of E-H Bonds by a Bis(boryl)stannylene. Journal of the American Chemical Society 138(13) (2016) 4555-4564
Space group: P 1 21/c 1
Cell volume: 5108.04
Cell parameters: 19.4712; 14.5386; 18.715; 90; 105.386; 90;

COD ID: 4125003

CIF file

Formula: - C57.5 H86.5 B2 N5 Sn -
Comments: Protchenko, Andrey V.; Bates, Joshua I.; Saleh, Liban M. A.; Blake, Matthew P.; Schwarz, Andrew D.; Kolychev, Eugene L.; Thompson, Amber L.; Jones, Cameron; Mountford, Philip; Aldridge, Simon Enabling and Probing Oxidative Addition and Reductive Elimination at a Group 14 Metal Center: Cleavage and Functionalization of E-H Bonds by a Bis(boryl)stannylene. Journal of the American Chemical Society 138(13) (2016) 4555-4564
Space group: P 1 21/c 1
Cell volume: 5811.51
Cell parameters: 20.3402; 12.8395; 22.829; 90; 102.9; 90;

COD ID: 4125004

CIF file

Formula: - C52 H74 B2 N4 Sn -
Comments: Protchenko, Andrey V.; Bates, Joshua I.; Saleh, Liban M. A.; Blake, Matthew P.; Schwarz, Andrew D.; Kolychev, Eugene L.; Thompson, Amber L.; Jones, Cameron; Mountford, Philip; Aldridge, Simon Enabling and Probing Oxidative Addition and Reductive Elimination at a Group 14 Metal Center: Cleavage and Functionalization of E-H Bonds by a Bis(boryl)stannylene. Journal of the American Chemical Society 138(13) (2016) 4555-4564
Space group: P 1 21/c 1
Cell volume: 5166.49
Cell parameters: 12.6324; 20.8368; 19.7169; 90; 95.4397; 90;

COD ID: 4125005

CIF file

Formula: - C58 H80 B2 N4 Si Sn -
Comments: Protchenko, Andrey V.; Bates, Joshua I.; Saleh, Liban M. A.; Blake, Matthew P.; Schwarz, Andrew D.; Kolychev, Eugene L.; Thompson, Amber L.; Jones, Cameron; Mountford, Philip; Aldridge, Simon Enabling and Probing Oxidative Addition and Reductive Elimination at a Group 14 Metal Center: Cleavage and Functionalization of E-H Bonds by a Bis(boryl)stannylene. Journal of the American Chemical Society 138(13) (2016) 4555-4564
Space group: P -1
Cell volume: 2858.2
Cell parameters: 12.527; 12.6173; 21.1768; 79.505; 89.404; 60.709;

COD ID: 4125006

CIF file

Formula: - C55 H84 B3 N5 Sn -
Comments: Protchenko, Andrey V.; Bates, Joshua I.; Saleh, Liban M. A.; Blake, Matthew P.; Schwarz, Andrew D.; Kolychev, Eugene L.; Thompson, Amber L.; Jones, Cameron; Mountford, Philip; Aldridge, Simon Enabling and Probing Oxidative Addition and Reductive Elimination at a Group 14 Metal Center: Cleavage and Functionalization of E-H Bonds by a Bis(boryl)stannylene. Journal of the American Chemical Society 138(13) (2016) 4555-4564
Space group: P 1 21/c 1
Cell volume: 6108.48
Cell parameters: 14.136; 16.8914; 25.9133; 90; 99.1667; 90;

COD ID: 4125007

CIF file

Formula: - C52 H74 B2 N4 O Sn -
Comments: Protchenko, Andrey V.; Bates, Joshua I.; Saleh, Liban M. A.; Blake, Matthew P.; Schwarz, Andrew D.; Kolychev, Eugene L.; Thompson, Amber L.; Jones, Cameron; Mountford, Philip; Aldridge, Simon Enabling and Probing Oxidative Addition and Reductive Elimination at a Group 14 Metal Center: Cleavage and Functionalization of E-H Bonds by a Bis(boryl)stannylene. Journal of the American Chemical Society 138(13) (2016) 4555-4564
Space group: P 1 21/c 1
Cell volume: 5176.39
Cell parameters: 21.22087; 12.54026; 19.63737; 90; 97.8858; 90;

COD ID: 4125008

CIF file

Formula: - C52 H75 B2 N5 Sn -
Comments: Protchenko, Andrey V.; Bates, Joshua I.; Saleh, Liban M. A.; Blake, Matthew P.; Schwarz, Andrew D.; Kolychev, Eugene L.; Thompson, Amber L.; Jones, Cameron; Mountford, Philip; Aldridge, Simon Enabling and Probing Oxidative Addition and Reductive Elimination at a Group 14 Metal Center: Cleavage and Functionalization of E-H Bonds by a Bis(boryl)stannylene. Journal of the American Chemical Society 138(13) (2016) 4555-4564
Space group: P 1 21/c 1
Cell volume: 5206.73
Cell parameters: 21.2882; 12.5521; 19.6851; 90; 98.1681; 90;

COD ID: 4125009

CIF file

Formula: - C52 H75 B2 N6 Sn2 -
Comments: Protchenko, Andrey V.; Bates, Joshua I.; Saleh, Liban M. A.; Blake, Matthew P.; Schwarz, Andrew D.; Kolychev, Eugene L.; Thompson, Amber L.; Jones, Cameron; Mountford, Philip; Aldridge, Simon Enabling and Probing Oxidative Addition and Reductive Elimination at a Group 14 Metal Center: Cleavage and Functionalization of E-H Bonds by a Bis(boryl)stannylene. Journal of the American Chemical Society 138(13) (2016) 4555-4564
Space group: P 1 21/n 1
Cell volume: 2716.17
Cell parameters: 14.0818; 12.3113; 15.8745; 90; 99.2666; 90;

COD ID: 4125010

CIF file

Formula: - C55 H77 B2 K N5 Sn -
Comments: Protchenko, Andrey V.; Bates, Joshua I.; Saleh, Liban M. A.; Blake, Matthew P.; Schwarz, Andrew D.; Kolychev, Eugene L.; Thompson, Amber L.; Jones, Cameron; Mountford, Philip; Aldridge, Simon Enabling and Probing Oxidative Addition and Reductive Elimination at a Group 14 Metal Center: Cleavage and Functionalization of E-H Bonds by a Bis(boryl)stannylene. Journal of the American Chemical Society 138(13) (2016) 4555-4564
Space group: P 1 21/a 1
Cell volume: 13288
Cell parameters: 17.8585; 43.5512; 19.1937; 90; 117.11; 90;

COD ID: 4125011

CIF file

Formula: - C108 H144 N8 Sn10.81 -
Comments: Protchenko, Andrey V.; Bates, Joshua I.; Saleh, Liban M. A.; Blake, Matthew P.; Schwarz, Andrew D.; Kolychev, Eugene L.; Thompson, Amber L.; Jones, Cameron; Mountford, Philip; Aldridge, Simon Enabling and Probing Oxidative Addition and Reductive Elimination at a Group 14 Metal Center: Cleavage and Functionalization of E-H Bonds by a Bis(boryl)stannylene. Journal of the American Chemical Society 138(13) (2016) 4555-4564
Space group: P 1 21/c 1
Cell volume: 12203.2
Cell parameters: 24.6958; 14.9348; 33.1882; 90; 94.4855; 90;

COD ID: 4125012

CIF file

Formula: - C52 H72 B2 Cl2 N4 Sn -
Comments: Protchenko, Andrey V.; Bates, Joshua I.; Saleh, Liban M. A.; Blake, Matthew P.; Schwarz, Andrew D.; Kolychev, Eugene L.; Thompson, Amber L.; Jones, Cameron; Mountford, Philip; Aldridge, Simon Enabling and Probing Oxidative Addition and Reductive Elimination at a Group 14 Metal Center: Cleavage and Functionalization of E-H Bonds by a Bis(boryl)stannylene. Journal of the American Chemical Society 138(13) (2016) 4555-4564
Space group: P 21 21 21
Cell volume: 5261.39
Cell parameters: 11.3674; 18.7715; 24.657; 90; 90; 90;

COD ID: 4125013

CIF file

Formula: - C24 H56 N2 Si6 -
Comments: Protchenko, Andrey V.; Bates, Joshua I.; Saleh, Liban M. A.; Blake, Matthew P.; Schwarz, Andrew D.; Kolychev, Eugene L.; Thompson, Amber L.; Jones, Cameron; Mountford, Philip; Aldridge, Simon Enabling and Probing Oxidative Addition and Reductive Elimination at a Group 14 Metal Center: Cleavage and Functionalization of E-H Bonds by a Bis(boryl)stannylene. Journal of the American Chemical Society 138(13) (2016) 4555-4564
Space group: P 1 21/n 1
Cell volume: 3432.71
Cell parameters: 15.5841; 12.2901; 18.1568; 90; 99.2133; 90;

COD ID: 4125014

CIF file

Formula: - C24 B F20 K -
Comments: Protchenko, Andrey V.; Bates, Joshua I.; Saleh, Liban M. A.; Blake, Matthew P.; Schwarz, Andrew D.; Kolychev, Eugene L.; Thompson, Amber L.; Jones, Cameron; Mountford, Philip; Aldridge, Simon Enabling and Probing Oxidative Addition and Reductive Elimination at a Group 14 Metal Center: Cleavage and Functionalization of E-H Bonds by a Bis(boryl)stannylene. Journal of the American Chemical Society 138(13) (2016) 4555-4564
Space group: P 1 21 1
Cell volume: 2362.01
Cell parameters: 14.7357; 9.6701; 18.1354; 90; 113.934; 90;

COD ID: 4125015

CIF file

Formula: - C47 H72 B N3 Si Sn -
Comments: Protchenko, Andrey V.; Bates, Joshua I.; Saleh, Liban M. A.; Blake, Matthew P.; Schwarz, Andrew D.; Kolychev, Eugene L.; Thompson, Amber L.; Jones, Cameron; Mountford, Philip; Aldridge, Simon Enabling and Probing Oxidative Addition and Reductive Elimination at a Group 14 Metal Center: Cleavage and Functionalization of E-H Bonds by a Bis(boryl)stannylene. Journal of the American Chemical Society 138(13) (2016) 4555-4564
Space group: P 1 21 1
Cell volume: 4706.48
Cell parameters: 11.3662; 19.9462; 20.7654; 90; 91.3439; 90;

COD ID: 4125016

CIF file

Formula: - C90 H74 I4 -
Comments: Dumslaff, Tim; Yang, Bo; Maghsoumi, Ali; Velpula, Gangamallaiah; Mali, Kunal S.; Castiglioni, Chiara; De Feyter, Steven; Tommasini, Matteo; Narita, Akimitsu; Feng, Xinliang; Müllen, Klaus Adding Four Extra K-Regions to Hexa-peri-hexabenzocoronene. Journal of the American Chemical Society 138(14) (2016) 4726-4729
Space group: P -1
Cell volume: 1883.2
Cell parameters: 9.893; 12.1163; 16.2448; 96.775; 101.149; 95.448;

COD ID: 4125017
CIF file	Formula: - C23 H25 Br O3 - Comments: Amador, Adrian G.; Sherbrook, Evan M.; Yoon, Tehshik P. Enantioselective Photocatalytic [3 + 2] Cycloadditions of Aryl Cyclopropyl Ketones. Journal of the American Chemical Society 138(14) (2016) 4722-4725 Space group: P 21 21 21 Cell volume: 2071.3 Cell parameters: 5.633; 16.777; 21.917; 90; 90; 90;

COD ID: 4125018

CIF file

Formula: - C24 H20 F N5 O4 -
Comments: Piotrowski, David W.; Kamlet, Adam S.; Dechert-Schmitt, Anne-Marie R; Yan, Jiangli; Brandt, Thomas A.; Xiao, Jun; Wei, Liuqing; Barrila, Mark T. Regio- and Enantioselective Synthesis of Azole Hemiaminal Esters by Lewis Base Catalyzed Dynamic Kinetic Resolution. Journal of the American Chemical Society 138(14) (2016) 4818-4823
Space group: P 31 2 1
Cell volume: 3270.83
Cell parameters: 11.7388; 11.7388; 27.4082; 90; 90; 120;

COD ID: 4125019

CIF file

Formula: - C12 H14 N4 O3 -
Comments: Piotrowski, David W.; Kamlet, Adam S.; Dechert-Schmitt, Anne-Marie R; Yan, Jiangli; Brandt, Thomas A.; Xiao, Jun; Wei, Liuqing; Barrila, Mark T. Regio- and Enantioselective Synthesis of Azole Hemiaminal Esters by Lewis Base Catalyzed Dynamic Kinetic Resolution. Journal of the American Chemical Society 138(14) (2016) 4818-4823
Space group: P -1
Cell volume: 653.65
Cell parameters: 7.9189; 8.9993; 9.5359; 86.5842; 82.182; 76.2332;

COD ID: 4125020

CIF file

Formula: - C10 H13 I N6 O3 -
Comments: Piotrowski, David W.; Kamlet, Adam S.; Dechert-Schmitt, Anne-Marie R; Yan, Jiangli; Brandt, Thomas A.; Xiao, Jun; Wei, Liuqing; Barrila, Mark T. Regio- and Enantioselective Synthesis of Azole Hemiaminal Esters by Lewis Base Catalyzed Dynamic Kinetic Resolution. Journal of the American Chemical Society 138(14) (2016) 4818-4823
Space group: P 1 21 1
Cell volume: 744.42
Cell parameters: 4.5885; 10.0115; 16.2053; 90; 90.413; 90;

COD ID: 4125021

CIF file

Formula: - O14 P2 Sr3 Te Zn3 -
Comments: Yu, Hongwei; Young, Joshua; Wu, Hongping; Zhang, Weiguo; Rondinelli, James M.; Halasyamani, P. Shiv Electronic, Crystal Chemistry, and Nonlinear Optical Property Relationships in the Dugganite A3B3CD2O14 Family. Journal of the American Chemical Society 138(14) (2016) 4984-4989
Space group: P 3 2 1
Cell volume: 307.09
Cell parameters: 8.2767; 8.2767; 5.1763; 90; 90; 120;

COD ID: 4125022

CIF file

Formula: - Ba3 O14 P2 Te Zn3 -
Comments: Yu, Hongwei; Young, Joshua; Wu, Hongping; Zhang, Weiguo; Rondinelli, James M.; Halasyamani, P. Shiv Electronic, Crystal Chemistry, and Nonlinear Optical Property Relationships in the Dugganite A3B3CD2O14 Family. Journal of the American Chemical Society 138(14) (2016) 4984-4989
Space group: P 3 2 1
Cell volume: 328.5
Cell parameters: 8.4744; 8.4744; 5.2818; 90; 90; 120;

COD ID: 4125023

CIF file

Formula: - O14 P2 Pb3 Te Zn3 -
Comments: Yu, Hongwei; Young, Joshua; Wu, Hongping; Zhang, Weiguo; Rondinelli, James M.; Halasyamani, P. Shiv Electronic, Crystal Chemistry, and Nonlinear Optical Property Relationships in the Dugganite A3B3CD2O14 Family. Journal of the American Chemical Society 138(14) (2016) 4984-4989
Space group: P 3 2 1
Cell volume: 316.05
Cell parameters: 8.3831; 8.3831; 5.193; 90; 90; 120;

COD ID: 4125024

CIF file

Formula: - Mg3 O14 P2 Pb3 Te -
Comments: Yu, Hongwei; Young, Joshua; Wu, Hongping; Zhang, Weiguo; Rondinelli, James M.; Halasyamani, P. Shiv Electronic, Crystal Chemistry, and Nonlinear Optical Property Relationships in the Dugganite A3B3CD2O14 Family. Journal of the American Chemical Society 138(14) (2016) 4984-4989
Space group: P 3 2 1
Cell volume: 319.27
Cell parameters: 8.4072; 8.4072; 5.2158; 90; 90; 120;

COD ID: 4125025

CIF file

Formula: - O14 P2 Pb3 W Zn3 -
Comments: Yu, Hongwei; Young, Joshua; Wu, Hongping; Zhang, Weiguo; Rondinelli, James M.; Halasyamani, P. Shiv Electronic, Crystal Chemistry, and Nonlinear Optical Property Relationships in the Dugganite A3B3CD2O14 Family. Journal of the American Chemical Society 138(14) (2016) 4984-4989
Space group: P 3 2 1
Cell volume: 317.06
Cell parameters: 8.4151; 8.4151; 5.17; 90; 90; 120;

COD ID: 4125026

CIF file

Formula: - O14 Pb3 Te V2 Zn3 -
Comments: Yu, Hongwei; Young, Joshua; Wu, Hongping; Zhang, Weiguo; Rondinelli, James M.; Halasyamani, P. Shiv Electronic, Crystal Chemistry, and Nonlinear Optical Property Relationships in the Dugganite A3B3CD2O14 Family. Journal of the American Chemical Society 138(14) (2016) 4984-4989
Space group: P 3 2 1
Cell volume: 332.8
Cell parameters: 8.608; 8.608; 5.186; 90; 90; 120;

COD ID: 4125027
CIF file	Formula: - C25 H22 S - Comments: Wang, Yi-Ming; Buchwald, Stephen L. Enantioselective CuH-Catalyzed Hydroallylation of Vinylarenes. Journal of the American Chemical Society 138(15) (2016) 5024-5027 Space group: P 1 21 1 Cell volume: 955.68 Cell parameters: 6.4872; 18.0297; 8.1708; 90; 90.0076; 90;

COD ID: 4125028

CIF file

Formula: - C30 H16 B2 O4 -
Comments: Katayama, Takazumi; Nakatsuka, Soichiro; Hirai, Hiroki; Yasuda, Nobuhiro; Kumar, Jatish; Kawai, Tsuyoshi; Hatakeyama, Takuji Two-Step Synthesis of Boron-Fused Double Helicenes. Journal of the American Chemical Society 138(16) (2016) 5210-5213
Space group: P 1 21/a 1
Cell volume: 2121.84
Cell parameters: 8.3686; 25.6303; 9.8925; 90; 90.036; 90;

COD ID: 4125029

CIF file

Formula: - C17 H24 O Si -
Comments: Nguyen, Khoa D.; Herkommer, Daniel; Krische, Michael J. Ruthenium-BINAP Catalyzed Alcohol C-H tert-Prenylation via 1,3-Enyne Transfer Hydrogenation: Beyond Stoichiometric Carbanions in Enantioselective Carbonyl Propargylation. Journal of the American Chemical Society 138(16) (2016) 5238-5241
Space group: P 1 21 1
Cell volume: 1722.46
Cell parameters: 6.0162; 17.8089; 16.1195; 90; 94.191; 90;

COD ID: 4125030

CIF file

Formula: - C16 H24 O2 Si -
Comments: Nguyen, Khoa D.; Herkommer, Daniel; Krische, Michael J. Ruthenium-BINAP Catalyzed Alcohol C-H tert-Prenylation via 1,3-Enyne Transfer Hydrogenation: Beyond Stoichiometric Carbanions in Enantioselective Carbonyl Propargylation. Journal of the American Chemical Society 138(16) (2016) 5238-5241
Space group: P 21 21 21
Cell volume: 1624.34
Cell parameters: 6.0238; 8.4261; 32.0021; 90; 90; 90;

COD ID: 4125031

CIF file

Formula: - C240 H0 I0 O28 Zn10 -
Comments: Zhang, Qiongqiong; Zhang, Cankun; Cao, Lingyun; Wang, Zi; An, Bing; Lin, Zekai; Huang, Ruiyun; Zhang, Zhiming; Wang, Cheng; Lin, Wenbin Förster Energy Transport in Metal-Organic Frameworks Is Beyond Step-by-Step Hopping. Journal of the American Chemical Society 138(16) (2016) 5308-5315
Space group: F -4 3 m
Cell volume: 53694
Cell parameters: 37.726; 37.726; 37.726; 90; 90; 90;

COD ID: 4125032

CIF file

Formula: - C60 O13 Zn4 -
Comments: Zhang, Qiongqiong; Zhang, Cankun; Cao, Lingyun; Wang, Zi; An, Bing; Lin, Zekai; Huang, Ruiyun; Zhang, Zhiming; Wang, Cheng; Lin, Wenbin Förster Energy Transport in Metal-Organic Frameworks Is Beyond Step-by-Step Hopping. Journal of the American Chemical Society 138(16) (2016) 5308-5315
Space group: I 21 3
Cell volume: 45710
Cell parameters: 35.755; 35.755; 35.755; 90; 90; 90;

COD ID: 4125033
CIF file	Formula: - C12 H20 Ag3 N5 - Comments: Hill, Joshua A.; Thompson, Amber L.; Goodwin, Andrew L. Dicyanometallates as Model Extended Frameworks. Journal of the American Chemical Society 138(18) (2016) 5886-5896 Space group: P n m a Cell volume: 1739.98 Cell parameters: 16.6101; 11.2973; 9.2725; 90; 90; 90;

COD ID: 4125034
CIF file	Formula: - C26 H36 Ag5 Cd2 N11 - Comments: Hill, Joshua A.; Thompson, Amber L.; Goodwin, Andrew L. Dicyanometallates as Model Extended Frameworks. Journal of the American Chemical Society 138(18) (2016) 5886-5896 Space group: C 1 2/c 1 Cell volume: 3930.35 Cell parameters: 16.2798; 13.9248; 18.0439; 90; 106.082; 90;

COD ID: 4125035
CIF file	Formula: - C50 H42 Au5 Cu2 N11 O2 P2 - Comments: Hill, Joshua A.; Thompson, Amber L.; Goodwin, Andrew L. Dicyanometallates as Model Extended Frameworks. Journal of the American Chemical Society 138(18) (2016) 5886-5896 Space group: C 1 2/c 1 Cell volume: 5647.5 Cell parameters: 27.9505; 15.0898; 13.4803; 90; 96.629; 90;

COD ID: 4125036
CIF file	Formula: - C50 H42 Ag5 Mn2 N11 O2 P2 - Comments: Hill, Joshua A.; Thompson, Amber L.; Goodwin, Andrew L. Dicyanometallates as Model Extended Frameworks. Journal of the American Chemical Society 138(18) (2016) 5886-5896 Space group: C 1 2/c 1 Cell volume: 6105.94 Cell parameters: 28.37; 15.6843; 13.9176; 90; 99.6092; 90;

COD ID: 4125037
CIF file	Formula: - C50 H42 Ag5 Cd2 N11 O2 P2 - Comments: Hill, Joshua A.; Thompson, Amber L.; Goodwin, Andrew L. Dicyanometallates as Model Extended Frameworks. Journal of the American Chemical Society 138(18) (2016) 5886-5896 Space group: C 1 2/c 1 Cell volume: 6226.6 Cell parameters: 28.5577; 15.835; 13.9531; 90; 99.31; 90;

COD ID: 4125038
CIF file	Formula: - C48 H48.87 Ag3 Cd N7 O3.44 P2 - Comments: Hill, Joshua A.; Thompson, Amber L.; Goodwin, Andrew L. Dicyanometallates as Model Extended Frameworks. Journal of the American Chemical Society 138(18) (2016) 5886-5896 Space group: P a -3 Cell volume: 10274.1 Cell parameters: 21.7394; 21.7394; 21.7394; 90; 90; 90;

COD ID: 4125039
CIF file	Formula: - C42 H30 Au3 Mn N7 P2 - Comments: Hill, Joshua A.; Thompson, Amber L.; Goodwin, Andrew L. Dicyanometallates as Model Extended Frameworks. Journal of the American Chemical Society 138(18) (2016) 5886-5896 Space group: I 1 2/a 1 Cell volume: 4338.48 Cell parameters: 16.7035; 12.5777; 20.6707; 90; 92.5382; 90;

COD ID: 4125040
CIF file	Formula: - C42 H30 Au3 Cd N7 P2 - Comments: Hill, Joshua A.; Thompson, Amber L.; Goodwin, Andrew L. Dicyanometallates as Model Extended Frameworks. Journal of the American Chemical Society 138(18) (2016) 5886-5896 Space group: I 1 2/a 1 Cell volume: 4480.19 Cell parameters: 16.8455; 12.7383; 20.8965; 90; 92.3725; 90;

COD ID: 4125041
CIF file	Formula: - C38 H30 Au N3 P2 - Comments: Hill, Joshua A.; Thompson, Amber L.; Goodwin, Andrew L. Dicyanometallates as Model Extended Frameworks. Journal of the American Chemical Society 138(18) (2016) 5886-5896 Space group: P -1 Cell volume: 1712.6 Cell parameters: 9.7335; 11.0381; 17.0129; 73.058; 81.926; 79.666;

COD ID: 4125042
CIF file	Formula: - C38 H30 Ag N3 P2 - Comments: Hill, Joshua A.; Thompson, Amber L.; Goodwin, Andrew L. Dicyanometallates as Model Extended Frameworks. Journal of the American Chemical Society 138(18) (2016) 5886-5896 Space group: P -1 Cell volume: 1721.6 Cell parameters: 9.7325; 10.9975; 17.099; 73.5; 82.138; 80.19;

COD ID: 4125043

CIF file

Formula: - C64 H102 Cl2 P2 Pd -
Comments: Reid, William B.; Spillane, Jesse J.; Krause, Sarah B.; Watson, Donald A. Direct Synthesis of Alkenyl Boronic Esters from Unfunctionalized Alkenes: A Boryl-Heck Reaction. Journal of the American Chemical Society 138(17) (2016) 5539-5542
Space group: P -1
Cell volume: 1590.7
Cell parameters: 9.2263; 12.2376; 15.729; 67.311; 76.135; 84.352;

COD ID: 4125044

CIF file

Formula: - C16 H18 N4 O2 -
Comments: Zha, R. Helen; de Waal, Bas F. M.; Lutz, Martin; Teunissen, Abraham J. P.; Meijer, E. W. End Groups of Functionalized Siloxane Oligomers Direct Block-Copolymeric or Liquid-Crystalline Self-Assembly Behavior. Journal of the American Chemical Society 138(17) (2016) 5693-5698
Space group: P -1
Cell volume: 771.76
Cell parameters: 7.7614; 7.9275; 12.9954; 88.676; 77.819; 80.925;

COD ID: 4125045

CIF file

Formula: - C235 H215 N33 O57 -
Comments: Nalluri, Siva Krishna Mohan; Liu, Zhichang; Wu, Yilei; Hermann, Keith R.; Samanta, Avik; Kim, Dong Jun; Krzyaniak, Matthew D.; Wasielewski, Michael R.; Stoddart, J. Fraser Chiral Redox-Active Isosceles Triangles. Journal of the American Chemical Society 138(18) (2016) 5968-5977
Space group: P 1 21 1
Cell volume: 11736.9
Cell parameters: 18.6699; 18.7951; 33.5586; 90; 94.656; 90;

COD ID: 4125046

CIF file

Formula: - C64 H56 Br8 N6 O12 -
Comments: Nalluri, Siva Krishna Mohan; Liu, Zhichang; Wu, Yilei; Hermann, Keith R.; Samanta, Avik; Kim, Dong Jun; Krzyaniak, Matthew D.; Wasielewski, Michael R.; Stoddart, J. Fraser Chiral Redox-Active Isosceles Triangles. Journal of the American Chemical Society 138(18) (2016) 5968-5977
Space group: P 21 21 21
Cell volume: 6325.7
Cell parameters: 9.2311; 18.4418; 37.1578; 90; 90; 90;

COD ID: 4125047

CIF file

Formula: - C18 H30 O2 Si -
Comments: Johnson, Trevor C.; Chin, Matthew R.; Han, Tianxu; Shen, John Paul; Rana, Tariq; Siegel, Dionicio Synthesis of Eupalinilide E, a Promoter of Human Hematopoietic Stem and Progenitor Cell Expansion. Journal of the American Chemical Society 138(18) (2016) 6068-6073
Space group: P 1 21 1
Cell volume: 899.2
Cell parameters: 10.9429; 6.4395; 13.07; 90; 102.48; 90;

COD ID: 4125048

CIF file

Formula: - C41 H74 Ce N3 O2 Si2 -
Comments: Yin, Haolin; Carroll, Patrick J.; Manor, Brian C.; Anna, Jessica M.; Schelter, Eric J. Cerium Photosensitizers: Structure-Function Relationships and Applications in Photocatalytic Aryl Coupling Reactions. Journal of the American Chemical Society 138(18) (2016) 5984-5993
Space group: P -1
Cell volume: 2200.1
Cell parameters: 10.8442; 10.9095; 19.879; 76.875; 76.263; 78.772;

COD ID: 4125049

CIF file

Formula: - C57 H140 Ce2 I2 N12 Si8 -
Comments: Yin, Haolin; Carroll, Patrick J.; Manor, Brian C.; Anna, Jessica M.; Schelter, Eric J. Cerium Photosensitizers: Structure-Function Relationships and Applications in Photocatalytic Aryl Coupling Reactions. Journal of the American Chemical Society 138(18) (2016) 5984-5993
Space group: P -1
Cell volume: 2180.2
Cell parameters: 12.4517; 13.3196; 15.2765; 97.319; 102.877; 114.368;

COD ID: 4125050

CIF file

Formula: - C32 H82 Ce N7 Si6 -
Comments: Yin, Haolin; Carroll, Patrick J.; Manor, Brian C.; Anna, Jessica M.; Schelter, Eric J. Cerium Photosensitizers: Structure-Function Relationships and Applications in Photocatalytic Aryl Coupling Reactions. Journal of the American Chemical Society 138(18) (2016) 5984-5993
Space group: P -1
Cell volume: 2716.95
Cell parameters: 13.6334; 14.3685; 16.3214; 111.454; 93.753; 110.532;

COD ID: 4125051

CIF file

Formula: - C40 H85 Ce N6 O Si4 -
Comments: Yin, Haolin; Carroll, Patrick J.; Manor, Brian C.; Anna, Jessica M.; Schelter, Eric J. Cerium Photosensitizers: Structure-Function Relationships and Applications in Photocatalytic Aryl Coupling Reactions. Journal of the American Chemical Society 138(18) (2016) 5984-5993
Space group: P 1 21/c 1
Cell volume: 5144.2
Cell parameters: 14.627; 21.5464; 16.9923; 90; 106.141; 90;

COD ID: 4125052

CIF file

Formula: - C39 H96 Ce N9 Si6 -
Comments: Yin, Haolin; Carroll, Patrick J.; Manor, Brian C.; Anna, Jessica M.; Schelter, Eric J. Cerium Photosensitizers: Structure-Function Relationships and Applications in Photocatalytic Aryl Coupling Reactions. Journal of the American Chemical Society 138(18) (2016) 5984-5993
Space group: P 1 21/n 1
Cell volume: 5601.7
Cell parameters: 14.4193; 22.9467; 17.0665; 90; 97.255; 90;

COD ID: 4125053

CIF file

Formula: - C73 H112 B Ce Cl4 F24 N9 Si6 -
Comments: Yin, Haolin; Carroll, Patrick J.; Manor, Brian C.; Anna, Jessica M.; Schelter, Eric J. Cerium Photosensitizers: Structure-Function Relationships and Applications in Photocatalytic Aryl Coupling Reactions. Journal of the American Chemical Society 138(18) (2016) 5984-5993
Space group: P 1 21/n 1
Cell volume: 9540.4
Cell parameters: 23.2747; 18.2692; 24.82; 90; 115.313; 90;

COD ID: 4125054

CIF file

Formula: - C27 H76 Ce Cl3 N4 Si6 -
Comments: Yin, Haolin; Carroll, Patrick J.; Manor, Brian C.; Anna, Jessica M.; Schelter, Eric J. Cerium Photosensitizers: Structure-Function Relationships and Applications in Photocatalytic Aryl Coupling Reactions. Journal of the American Chemical Society 138(18) (2016) 5984-5993
Space group: P 1 21/n 1
Cell volume: 4663.6
Cell parameters: 15.9152; 15.6395; 18.7462; 90; 91.845; 90;

COD ID: 4125055

CIF file

Formula: - Nd9.553 O25.776 Si6 -
Comments: An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J. Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes. Journal of the American Chemical Society 138(13) (2016) 4468-4483
Space group: P 63/m
Cell volume: 554.191
Cell parameters: 9.5507; 9.5507; 7.0155; 90; 90; 120;

COD ID: 4125056

CIF file

Formula: - Nd9.606 O25.924 Si6 -
Comments: An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J. Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes. Journal of the American Chemical Society 138(13) (2016) 4468-4483
Space group: P 63/m
Cell volume: 554.191
Cell parameters: 9.5507; 9.5507; 7.0155; 90; 90; 120;

COD ID: 4125057

CIF file

Formula: - Al1.5 Nd9.959 O26 Si4.5 -
Comments: An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J. Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes. Journal of the American Chemical Society 138(13) (2016) 4468-4483
Space group: P 63/m
Cell volume: 558.977
Cell parameters: 9.5611; 9.5611; 7.0607; 90; 90; 120;

COD ID: 4125058

CIF file

Formula: - Nd9.605 O25.789 Si6 -
Comments: An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J. Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes. Journal of the American Chemical Society 138(13) (2016) 4468-4483
Space group: P 63/m
Cell volume: 554.191
Cell parameters: 9.5507; 9.5507; 7.0155; 90; 90; 120;

COD ID: 4125059

CIF file

Formula: - Nd9.58 O25.84 Si6 -
Comments: An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J. Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes. Journal of the American Chemical Society 138(13) (2016) 4468-4483
Space group: P 63/m
Cell volume: 554.191
Cell parameters: 9.5507; 9.5507; 7.0155; 90; 90; 120;

COD ID: 4125060

CIF file

Formula: - Al Nd9.906 O26 Si5 -
Comments: An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J. Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes. Journal of the American Chemical Society 138(13) (2016) 4468-4483
Space group: P 63/m
Cell volume: 557.153
Cell parameters: 9.553; 9.553; 7.0496; 90; 90; 120;

COD ID: 4125061

CIF file

Formula: - Al0.5 Nd9.652 O26 Si5.5 -
Comments: An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J. Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes. Journal of the American Chemical Society 138(13) (2016) 4468-4483
Space group: P 63/m
Cell volume: 556.378
Cell parameters: 9.5515; 9.5515; 7.042; 90; 90; 120;

COD ID: 4125062

CIF file

Formula: - Nd9.569 O25.905 Si6 -
Comments: An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J. Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes. Journal of the American Chemical Society 138(13) (2016) 4468-4483
Space group: P 63/m
Cell volume: 554.191
Cell parameters: 9.5507; 9.5507; 7.0155; 90; 90; 120;

COD ID: 4125063

CIF file

Formula: - C24 H24 B F10 N -
Comments: Wang, Tongdao; Kehr, Gerald; Liu, Lei; Grimme, Stefan; Daniliuc, Constantin G.; Erker, Gerhard Selective Oxidation of an Active Intramolecular Amine/Borane Frustrated Lewis Pair with Dioxygen. Journal of the American Chemical Society 138(13) (2016) 4302-4305
Space group: P -1
Cell volume: 1144.1
Cell parameters: 6.0559; 12.211; 16.663; 104.66; 95.819; 103.157;

COD ID: 4125064

CIF file

Formula: - C24 H26 B F10 N O -
Comments: Wang, Tongdao; Kehr, Gerald; Liu, Lei; Grimme, Stefan; Daniliuc, Constantin G.; Erker, Gerhard Selective Oxidation of an Active Intramolecular Amine/Borane Frustrated Lewis Pair with Dioxygen. Journal of the American Chemical Society 138(13) (2016) 4302-4305
Space group: P -1
Cell volume: 1223.73
Cell parameters: 10.9865; 11.3039; 12.1268; 111.608; 90.925; 116.464;

COD ID: 4125065

CIF file

Formula: - C29 H30 B F10 N -
Comments: Wang, Tongdao; Kehr, Gerald; Liu, Lei; Grimme, Stefan; Daniliuc, Constantin G.; Erker, Gerhard Selective Oxidation of an Active Intramolecular Amine/Borane Frustrated Lewis Pair with Dioxygen. Journal of the American Chemical Society 138(13) (2016) 4302-4305
Space group: P 1 21/n 1
Cell volume: 2783.52
Cell parameters: 9.3348; 18.8671; 15.8074; 90; 91.077; 90;

COD ID: 4125066

CIF file

Formula: - C36 H25 B2 F20 N -
Comments: Wang, Tongdao; Kehr, Gerald; Liu, Lei; Grimme, Stefan; Daniliuc, Constantin G.; Erker, Gerhard Selective Oxidation of an Active Intramolecular Amine/Borane Frustrated Lewis Pair with Dioxygen. Journal of the American Chemical Society 138(13) (2016) 4302-4305
Space group: P 1 21/n 1
Cell volume: 4215.7
Cell parameters: 12.3941; 19.3768; 17.7912; 90; 99.37; 90;

COD ID: 4125067

CIF file

Formula: - C24 H26 B F10 N -
Comments: Wang, Tongdao; Kehr, Gerald; Liu, Lei; Grimme, Stefan; Daniliuc, Constantin G.; Erker, Gerhard Selective Oxidation of an Active Intramolecular Amine/Borane Frustrated Lewis Pair with Dioxygen. Journal of the American Chemical Society 138(13) (2016) 4302-4305
Space group: C 1 2/c 1
Cell volume: 4804.1
Cell parameters: 36.0335; 8.0228; 19.5293; 90; 121.688; 90;

COD ID: 4125068

CIF file

Formula: - C48 H48 B2 F20 N2 O2 -
Comments: Wang, Tongdao; Kehr, Gerald; Liu, Lei; Grimme, Stefan; Daniliuc, Constantin G.; Erker, Gerhard Selective Oxidation of an Active Intramolecular Amine/Borane Frustrated Lewis Pair with Dioxygen. Journal of the American Chemical Society 138(13) (2016) 4302-4305
Space group: P 1 21/n 1
Cell volume: 4756.6
Cell parameters: 12.633; 22.0052; 17.6449; 90; 104.135; 90;

COD ID: 4125069

CIF file

Formula: - C22 H23 F3 N O5 P -
Comments: Morisaki, Kazuhiro; Sawa, Masanao; Yonesaki, Ryohei; Morimoto, Hiroyuki; Mashima, Kazushi; Ohshima, Takashi Mechanistic Studies and Expansion of the Substrate Scope of Direct Enantioselective Alkynylation of α-Ketiminoesters Catalyzed by Adaptable (Phebox)Rhodium(III) Complexes. Journal of the American Chemical Society 138(19) (2016) 6194-6203
Space group: P 1
Cell volume: 1133.1
Cell parameters: 9.548; 10.705; 12.059; 87.745; 67.638; 83.773;

COD ID: 4125070

CIF file

Formula: - C34 H27 N2 O4 Rh -
Comments: Morisaki, Kazuhiro; Sawa, Masanao; Yonesaki, Ryohei; Morimoto, Hiroyuki; Mashima, Kazushi; Ohshima, Takashi Mechanistic Studies and Expansion of the Substrate Scope of Direct Enantioselective Alkynylation of α-Ketiminoesters Catalyzed by Adaptable (Phebox)Rhodium(III) Complexes. Journal of the American Chemical Society 138(19) (2016) 6194-6203
Space group: P 21 21 21
Cell volume: 2799.7
Cell parameters: 10.73; 14.3916; 18.13; 90; 90; 90;

COD ID: 4125071

CIF file

Formula: - C24 H20 N2 O4 S -
Comments: Morisaki, Kazuhiro; Sawa, Masanao; Yonesaki, Ryohei; Morimoto, Hiroyuki; Mashima, Kazushi; Ohshima, Takashi Mechanistic Studies and Expansion of the Substrate Scope of Direct Enantioselective Alkynylation of α-Ketiminoesters Catalyzed by Adaptable (Phebox)Rhodium(III) Complexes. Journal of the American Chemical Society 138(19) (2016) 6194-6203
Space group: P 1 21 1
Cell volume: 1005
Cell parameters: 5.73; 20.761; 8.5902; 90; 100.442; 90;

COD ID: 4125072

CIF file

Formula: - Ba Hg Se2 -
Comments: Li, Chao; Yin, Wenlong; Gong, Pifu; Li, Xiaoshuang; Zhou, Molin; Mar, Arthur; Lin, Zheshuai; Yao, Jiyong; Wu, Yicheng; Chen, Chuangtian Trigonal Planar [HgSe3](4-) Unit: A New Kind of Basic Functional Group in IR Nonlinear Optical Materials with Large Susceptibility and Physicochemical Stability. Journal of the American Chemical Society 138(19) (2016) 6135-6138
Space group: P m c 21
Cell volume: 492.22
Cell parameters: 4.358; 14.881; 7.59; 90; 90; 90;

COD ID: 4125073
CIF file	Formula: - C32 H40 B2 O2 - Comments: Kojima, Chiemi; Lee, Ka-Ho; Lin, Zhenyang; Yamashita, Makoto Direct and Base-Catalyzed Diboration of Alkynes Using the Unsymmetrical Diborane(4), pinB-BMes2. Journal of the American Chemical Society 138(20) (2016) 6662-6669 Space group: C 1 2/c 1 Cell volume: 5563 Cell parameters: 21.179; 18.427; 14.466; 90; 99.82; 90;

COD ID: 4125074
CIF file	Formula: - C32 H40 B2 O2 - Comments: Kojima, Chiemi; Lee, Ka-Ho; Lin, Zhenyang; Yamashita, Makoto Direct and Base-Catalyzed Diboration of Alkynes Using the Unsymmetrical Diborane(4), pinB-BMes2. Journal of the American Chemical Society 138(20) (2016) 6662-6669 Space group: P 21 21 21 Cell volume: 2859.1 Cell parameters: 9.147; 9.787; 31.937; 90; 90; 90;

COD ID: 4125075
CIF file	Formula: - C32 H40 B2 O2 - Comments: Kojima, Chiemi; Lee, Ka-Ho; Lin, Zhenyang; Yamashita, Makoto Direct and Base-Catalyzed Diboration of Alkynes Using the Unsymmetrical Diborane(4), pinB-BMes2. Journal of the American Chemical Society 138(20) (2016) 6662-6669 Space group: P 1 21/n 1 Cell volume: 2814 Cell parameters: 8.818; 36.059; 8.85; 90; 90.252; 90;

COD ID: 4125076
CIF file	Formula: - C32 H39 B2 Br O2 - Comments: Kojima, Chiemi; Lee, Ka-Ho; Lin, Zhenyang; Yamashita, Makoto Direct and Base-Catalyzed Diboration of Alkynes Using the Unsymmetrical Diborane(4), pinB-BMes2. Journal of the American Chemical Society 138(20) (2016) 6662-6669 Space group: P 1 21/c 1 Cell volume: 2916.2 Cell parameters: 15.857; 10.022; 19.656; 90; 111.004; 90;

COD ID: 4125077
CIF file	Formula: - C32 H39 B2 Br O2 - Comments: Kojima, Chiemi; Lee, Ka-Ho; Lin, Zhenyang; Yamashita, Makoto Direct and Base-Catalyzed Diboration of Alkynes Using the Unsymmetrical Diborane(4), pinB-BMes2. Journal of the American Chemical Society 138(20) (2016) 6662-6669 Space group: P 1 21/c 1 Cell volume: 2873.2 Cell parameters: 11.783; 15.689; 15.773; 90; 99.815; 90;

COD ID: 4125078
CIF file	Formula: - C32 H39 B2 Br O2 - Comments: Kojima, Chiemi; Lee, Ka-Ho; Lin, Zhenyang; Yamashita, Makoto Direct and Base-Catalyzed Diboration of Alkynes Using the Unsymmetrical Diborane(4), pinB-BMes2. Journal of the American Chemical Society 138(20) (2016) 6662-6669 Space group: C 1 2/c 1 Cell volume: 5808.3 Cell parameters: 23.103; 16.332; 15.614; 90; 99.64; 90;

COD ID: 4125079
CIF file	Formula: - C32 H39 B2 Br O2 - Comments: Kojima, Chiemi; Lee, Ka-Ho; Lin, Zhenyang; Yamashita, Makoto Direct and Base-Catalyzed Diboration of Alkynes Using the Unsymmetrical Diborane(4), pinB-BMes2. Journal of the American Chemical Society 138(20) (2016) 6662-6669 Space group: P 1 21/c 1 Cell volume: 2960.9 Cell parameters: 11.801; 15.554; 16.698; 90; 104.974; 90;

COD ID: 4125080
CIF file	Formula: - C34 H45 B2 N O2 - Comments: Kojima, Chiemi; Lee, Ka-Ho; Lin, Zhenyang; Yamashita, Makoto Direct and Base-Catalyzed Diboration of Alkynes Using the Unsymmetrical Diborane(4), pinB-BMes2. Journal of the American Chemical Society 138(20) (2016) 6662-6669 Space group: P 1 n 1 Cell volume: 1572 Cell parameters: 9.667; 11.589; 14.115; 90; 96.22; 90;

COD ID: 4125081
CIF file	Formula: - C32 H39 B2 F O2 - Comments: Kojima, Chiemi; Lee, Ka-Ho; Lin, Zhenyang; Yamashita, Makoto Direct and Base-Catalyzed Diboration of Alkynes Using the Unsymmetrical Diborane(4), pinB-BMes2. Journal of the American Chemical Society 138(20) (2016) 6662-6669 Space group: C 1 2/c 1 Cell volume: 5666 Cell parameters: 21.448; 18.667; 14.378; 90; 100.147; 90;

COD ID: 4125082
CIF file	Formula: - C32 H39 B2 F O2 - Comments: Kojima, Chiemi; Lee, Ka-Ho; Lin, Zhenyang; Yamashita, Makoto Direct and Base-Catalyzed Diboration of Alkynes Using the Unsymmetrical Diborane(4), pinB-BMes2. Journal of the American Chemical Society 138(20) (2016) 6662-6669 Space group: P 1 21/n 1 Cell volume: 2830.5 Cell parameters: 8.705; 35.874; 9.064; 90; 90.276; 90;

COD ID: 4125083
CIF file	Formula: - C33 H39 B2 F3 O2 - Comments: Kojima, Chiemi; Lee, Ka-Ho; Lin, Zhenyang; Yamashita, Makoto Direct and Base-Catalyzed Diboration of Alkynes Using the Unsymmetrical Diborane(4), pinB-BMes2. Journal of the American Chemical Society 138(20) (2016) 6662-6669 Space group: P -1 Cell volume: 3052.3 Cell parameters: 14.316; 14.506; 15.944; 90.042; 112.231; 94.799;

COD ID: 4125084
CIF file	Formula: - C33 H39 B2 F3 O2 - Comments: Kojima, Chiemi; Lee, Ka-Ho; Lin, Zhenyang; Yamashita, Makoto Direct and Base-Catalyzed Diboration of Alkynes Using the Unsymmetrical Diborane(4), pinB-BMes2. Journal of the American Chemical Society 138(20) (2016) 6662-6669 Space group: P -1 Cell volume: 1479.9 Cell parameters: 8.4771; 12.1269; 16.329; 70.166; 81.088; 69.721;

COD ID: 4125085

CIF file

Formula: - C41 H37 Au N O P -
Comments: Hong, Eugene Yau-Hin; Poon, Chun-Ting; Yam, Vivian Wing-Wah A Phosphole Oxide-Containing Organogold(III) Complex for Solution-Processable Resistive Memory Devices with Ternary Memory Performances. Journal of the American Chemical Society 138(20) (2016) 6368-6371
Space group: P 1 21/c 1
Cell volume: 3449.6
Cell parameters: 15.935; 13.013; 17.978; 90; 112.28; 90;

COD ID: 4125086
CIF file	Formula: - C10 H11 N O3 S - Comments: Huang, Yuan; Huang, Rui-Zhi; Zhao, Yu Cobalt-Catalyzed Enantioselective Vinylation of Activated Ketones and Imines. Journal of the American Chemical Society 138(20) (2016) 6571-6576 Space group: P 1 21 1 Cell volume: 2108.5 Cell parameters: 9.1983; 16.7173; 13.7123; 90; 90.549; 90;

COD ID: 4125087
CIF file	Formula: - C19 H17 Cl O3 - Comments: Huang, Yuan; Huang, Rui-Zhi; Zhao, Yu Cobalt-Catalyzed Enantioselective Vinylation of Activated Ketones and Imines. Journal of the American Chemical Society 138(20) (2016) 6571-6576 Space group: P 1 21 1 Cell volume: 804.82 Cell parameters: 5.9854; 7.5004; 18.085; 90; 97.565; 90;

COD ID: 4125088
CIF file	Formula: - C11 H12 O3 - Comments: Huang, Yuan; Huang, Rui-Zhi; Zhao, Yu Cobalt-Catalyzed Enantioselective Vinylation of Activated Ketones and Imines. Journal of the American Chemical Society 138(20) (2016) 6571-6576 Space group: P 21 21 21 Cell volume: 2924.86 Cell parameters: 5.8398; 21.5974; 23.1903; 90; 90; 90;

COD ID: 4125091

CIF file

Formula: - C45 H38 P2 -
Comments: Transue, Wesley J.; Velian, Alexandra; Nava, Matthew; Martin-Drumel, Marie-Aline; Womack, Caroline C.; Jiang, Jun; Hou, Gao-Lei; Wang, Xue-Bin; McCarthy, Michael C.; Field, Robert W.; Cummins, Christopher C. A Molecular Precursor to Phosphaethyne and Its Application in Synthesis of the Aromatic 1,2,3,4-Phosphatriazolate Anion. Journal of the American Chemical Society 138(21) (2016) 6731-6734
Space group: P 1 21/c 1
Cell volume: 3431.2
Cell parameters: 14.8855; 11.3406; 20.3764; 90; 94.041; 90;

COD ID: 4125092

CIF file

Formula: - C33 H59 K N5 O7 P -
Comments: Transue, Wesley J.; Velian, Alexandra; Nava, Matthew; Martin-Drumel, Marie-Aline; Womack, Caroline C.; Jiang, Jun; Hou, Gao-Lei; Wang, Xue-Bin; McCarthy, Michael C.; Field, Robert W.; Cummins, Christopher C. A Molecular Precursor to Phosphaethyne and Its Application in Synthesis of the Aromatic 1,2,3,4-Phosphatriazolate Anion. Journal of the American Chemical Society 138(21) (2016) 6731-6734
Space group: P -1
Cell volume: 1820.8
Cell parameters: 11.0044; 12.0737; 13.946; 83.904; 82.249; 85.085;

COD ID: 4125093

CIF file

Formula: - C7 H19 N6 P S -
Comments: Transue, Wesley J.; Velian, Alexandra; Nava, Matthew; Martin-Drumel, Marie-Aline; Womack, Caroline C.; Jiang, Jun; Hou, Gao-Lei; Wang, Xue-Bin; McCarthy, Michael C.; Field, Robert W.; Cummins, Christopher C. A Molecular Precursor to Phosphaethyne and Its Application in Synthesis of the Aromatic 1,2,3,4-Phosphatriazolate Anion. Journal of the American Chemical Society 138(21) (2016) 6731-6734
Space group: P -1
Cell volume: 623.29
Cell parameters: 6.0072; 10.1348; 10.3082; 90.002; 89.996; 83.296;

COD ID: 4125094
CIF file	Formula: - C29 H36 Cl2 O8 - Comments: Kaplan, Will; Khatri, Hem Raj; Nagorny, Pavel Concise Enantioselective Total Synthesis of Cardiotonic Steroids 19-Hydroxysarmentogenin and Trewianin Aglycone. Journal of the American Chemical Society 138(22) (2016) 7194-7198 Space group: P -1 Cell volume: 1366.1 Cell parameters: 10.1108; 12.5567; 12.7249; 91.518; 110.105; 113.487;

COD ID: 4125095

CIF file

Formula: - C28 H19 Br4 N O6 -
Comments: Quint, Valentin; Morlet-Savary, Fabrice; Lohier, Jean-François; Lalevée, Jacques; Gaumont, Annie-Claude; Lakhdar, Sami Metal-Free, Visible Light-Photocatalyzed Synthesis of Benzo[b]phosphole Oxides: Synthetic and Mechanistic Investigations. Journal of the American Chemical Society 138(23) (2016) 7436-7441
Space group: C 1 2/c 1
Cell volume: 5650.2
Cell parameters: 26.4265; 11.8821; 19.8835; 90; 115.18; 90;

COD ID: 4125096

CIF file

Formula: - C10 H14 O5 -
Comments: Li, Gang; Kuo, Jonathan L.; Han, Arthur; Abuyuan, Janine M.; Young, Lily C.; Norton, Jack R.; Palmer, Joshua H. Radical Isomerization and Cycloisomerization Initiated by H• Transfer. Journal of the American Chemical Society 138(24) (2016) 7698-7704
Space group: P 1 21/c 1
Cell volume: 1061
Cell parameters: 3.9342; 27.324; 9.9305; 90; 96.314; 90;

COD ID: 4125097

CIF file

Formula: - C22 H18 Br2 N S7 Si2 -
Comments: Wang, Ying; Zhang, Hui; Pink, Maren; Olankitwanit, Arnon; Rajca, Suchada; Rajca, Andrzej Radical Cation and Neutral Radical of Aza-thia[7]helicene with SOMO-HOMO Energy Level Inversion. Journal of the American Chemical Society 138(23) (2016) 7298-7304
Space group: C 1 2/c 1
Cell volume: 2742.7
Cell parameters: 21.1775; 18.3158; 7.0825; 90; 93.269; 90;

COD ID: 4125098

CIF file

Formula: - C14 H32 N6 O5 -
Comments: Kim, Byoungmoo; Chinn, Alex J.; Fandrick, Daniel R.; Senanayake, Chris H.; Singer, Robert A.; Miller, Scott J. Distal Stereocontrol Using Guanidinylated Peptides as Multifunctional Ligands: Desymmetrization of Diarylmethanes via Ullman Cross-Coupling. Journal of the American Chemical Society 138(25) (2016) 7939-7945
Space group: P b c n
Cell volume: 1954.32
Cell parameters: 8.8452; 16.0629; 13.7551; 90; 90; 90;

COD ID: 4125099

CIF file

Formula: - C18 H40 Li N5 O11 -
Comments: Kim, Byoungmoo; Chinn, Alex J.; Fandrick, Daniel R.; Senanayake, Chris H.; Singer, Robert A.; Miller, Scott J. Distal Stereocontrol Using Guanidinylated Peptides as Multifunctional Ligands: Desymmetrization of Diarylmethanes via Ullman Cross-Coupling. Journal of the American Chemical Society 138(25) (2016) 7939-7945
Space group: P 1 21 1
Cell volume: 1242.64
Cell parameters: 11.543; 7.5993; 14.3503; 90; 99.189; 90;

COD ID: 4125100

CIF file

Formula: - C21 H18 Br2 F6 N2 O2 -
Comments: Kim, Byoungmoo; Chinn, Alex J.; Fandrick, Daniel R.; Senanayake, Chris H.; Singer, Robert A.; Miller, Scott J. Distal Stereocontrol Using Guanidinylated Peptides as Multifunctional Ligands: Desymmetrization of Diarylmethanes via Ullman Cross-Coupling. Journal of the American Chemical Society 138(25) (2016) 7939-7945
Space group: P 1 21/c 1
Cell volume: 2264.9
Cell parameters: 12.3264; 13.9962; 13.345; 90; 100.34; 90;

COD ID: 4125101

CIF file

Formula: - C10 H23 N3 O3 -
Comments: Kim, Byoungmoo; Chinn, Alex J.; Fandrick, Daniel R.; Senanayake, Chris H.; Singer, Robert A.; Miller, Scott J. Distal Stereocontrol Using Guanidinylated Peptides as Multifunctional Ligands: Desymmetrization of Diarylmethanes via Ullman Cross-Coupling. Journal of the American Chemical Society 138(25) (2016) 7939-7945
Space group: P 21 21 21
Cell volume: 1293.9
Cell parameters: 8.1091; 9.773; 16.327; 90; 90; 90;

COD ID: 4125102

CIF file

Formula: - C8 H18 F6 N3 O2 P -
Comments: Kim, Byoungmoo; Chinn, Alex J.; Fandrick, Daniel R.; Senanayake, Chris H.; Singer, Robert A.; Miller, Scott J. Distal Stereocontrol Using Guanidinylated Peptides as Multifunctional Ligands: Desymmetrization of Diarylmethanes via Ullman Cross-Coupling. Journal of the American Chemical Society 138(25) (2016) 7939-7945
Space group: P 1 21/n 1
Cell volume: 1433.78
Cell parameters: 10.8788; 8.3292; 15.9771; 90; 97.955; 90;

COD ID: 4125103

CIF file

Formula: - C12 H15 B F4 N2 O -
Comments: Lau, Genevieve P. S.; Schreier, Marcel; Vasilyev, Dmitry; Scopelliti, Rosario; Grätzel, Michael; Dyson, Paul J. New Insights Into the Role of Imidazolium-Based Promoters for the Electroreduction of CO2 on a Silver Electrode. Journal of the American Chemical Society 138(25) (2016) 7820-7823
Space group: P 1 21/n 1
Cell volume: 1351.23
Cell parameters: 11.6467; 10.9394; 11.9902; 90; 117.808; 90;

COD ID: 4125104

CIF file

Formula: - C12 H12 B F4 N3 -
Comments: Lau, Genevieve P. S.; Schreier, Marcel; Vasilyev, Dmitry; Scopelliti, Rosario; Grätzel, Michael; Dyson, Paul J. New Insights Into the Role of Imidazolium-Based Promoters for the Electroreduction of CO2 on a Silver Electrode. Journal of the American Chemical Society 138(25) (2016) 7820-7823
Space group: P -1
Cell volume: 651.6
Cell parameters: 6.6104; 9.5196; 10.5103; 93.681; 98.829; 91.89;

COD ID: 4125105

CIF file

Formula: - C11 H12 B F5 N2 -
Comments: Lau, Genevieve P. S.; Schreier, Marcel; Vasilyev, Dmitry; Scopelliti, Rosario; Grätzel, Michael; Dyson, Paul J. New Insights Into the Role of Imidazolium-Based Promoters for the Electroreduction of CO2 on a Silver Electrode. Journal of the American Chemical Society 138(25) (2016) 7820-7823
Space group: P -1
Cell volume: 1244.1
Cell parameters: 10.4842; 10.524; 12.4159; 114.73; 90.775; 90.061;

COD ID: 4125106

CIF file

Formula: - C11 H13 B F4 N2 -
Comments: Lau, Genevieve P. S.; Schreier, Marcel; Vasilyev, Dmitry; Scopelliti, Rosario; Grätzel, Michael; Dyson, Paul J. New Insights Into the Role of Imidazolium-Based Promoters for the Electroreduction of CO2 on a Silver Electrode. Journal of the American Chemical Society 138(25) (2016) 7820-7823
Space group: P -1
Cell volume: 1210.4
Cell parameters: 10.153; 10.7563; 12.182; 88.021; 65.88; 85.439;

COD ID: 4125107

CIF file

Formula: - C20 H30 Cl Cu I N -
Comments: Chu, Jiaxiang; Munz, Dominik; Jazzar, Rodolphe; Melaimi, Mohand; Bertrand, Guy Synthesis of Hemilabile Cyclic (Alkyl)(amino)carbenes (CAACs) and Applications in Organometallic Chemistry. Journal of the American Chemical Society 138(25) (2016) 7884-7887
Space group: P 1 21/c 1
Cell volume: 2179.7
Cell parameters: 10.0336; 9.9876; 21.8458; 90; 95.333; 90;

COD ID: 4125108

CIF file

Formula: - C78 H68 Au B F20 N2 -
Comments: Chu, Jiaxiang; Munz, Dominik; Jazzar, Rodolphe; Melaimi, Mohand; Bertrand, Guy Synthesis of Hemilabile Cyclic (Alkyl)(amino)carbenes (CAACs) and Applications in Organometallic Chemistry. Journal of the American Chemical Society 138(25) (2016) 7884-7887
Space group: P -1
Cell volume: 3392.9
Cell parameters: 13.7142; 15.7707; 15.8385; 88.698; 87.417; 82.569;

COD ID: 4125109

CIF file

Formula: - C36 H54 Au Cl N2 -
Comments: Chu, Jiaxiang; Munz, Dominik; Jazzar, Rodolphe; Melaimi, Mohand; Bertrand, Guy Synthesis of Hemilabile Cyclic (Alkyl)(amino)carbenes (CAACs) and Applications in Organometallic Chemistry. Journal of the American Chemical Society 138(25) (2016) 7884-7887
Space group: P -1
Cell volume: 3458.6
Cell parameters: 10.0911; 18.5601; 19.6959; 106.828; 94.902; 98.618;

COD ID: 4125110

CIF file

Formula: - C22 H36 Cl Cu N2 -
Comments: Chu, Jiaxiang; Munz, Dominik; Jazzar, Rodolphe; Melaimi, Mohand; Bertrand, Guy Synthesis of Hemilabile Cyclic (Alkyl)(amino)carbenes (CAACs) and Applications in Organometallic Chemistry. Journal of the American Chemical Society 138(25) (2016) 7884-7887
Space group: P 1 21 1
Cell volume: 1132.47
Cell parameters: 8.4234; 16.0108; 8.5636; 90; 101.32; 90;

COD ID: 4125111

CIF file

Formula: - C13 H19 N3 S -
Comments: Howe, Ethan N. W.; Busschaert, Nathalie; Wu, Xin; Berry, Stuart N.; Ho, Junming; Light, Mark E.; Czech, Dawid D.; Klein, Harry A.; Kitchen, Jonathan A.; Gale, Philip A. pH-Regulated Nonelectrogenic Anion Transport by Phenylthiosemicarbazones. Journal of the American Chemical Society 138(26) (2016) 8301-8308
Space group: P 1 21 1
Cell volume: 1372.78
Cell parameters: 6.3999; 18.9408; 11.3358; 90; 92.523; 90;

COD ID: 4125112

CIF file

Formula: - C14 H21 N3 O S -
Comments: Howe, Ethan N. W.; Busschaert, Nathalie; Wu, Xin; Berry, Stuart N.; Ho, Junming; Light, Mark E.; Czech, Dawid D.; Klein, Harry A.; Kitchen, Jonathan A.; Gale, Philip A. pH-Regulated Nonelectrogenic Anion Transport by Phenylthiosemicarbazones. Journal of the American Chemical Society 138(26) (2016) 8301-8308
Space group: P b c a
Cell volume: 2996.9
Cell parameters: 10.5978; 10.4507; 27.0588; 90; 90; 90;

COD ID: 4125113

CIF file

Formula: - C14 H18 F3 N3 S -
Comments: Howe, Ethan N. W.; Busschaert, Nathalie; Wu, Xin; Berry, Stuart N.; Ho, Junming; Light, Mark E.; Czech, Dawid D.; Klein, Harry A.; Kitchen, Jonathan A.; Gale, Philip A. pH-Regulated Nonelectrogenic Anion Transport by Phenylthiosemicarbazones. Journal of the American Chemical Society 138(26) (2016) 8301-8308
Space group: P 1 21/c 1
Cell volume: 1542.99
Cell parameters: 13.7959; 13.3873; 8.3649; 90; 92.859; 90;

COD ID: 4125114

CIF file

Formula: - C13 H17 N3 S -
Comments: Howe, Ethan N. W.; Busschaert, Nathalie; Wu, Xin; Berry, Stuart N.; Ho, Junming; Light, Mark E.; Czech, Dawid D.; Klein, Harry A.; Kitchen, Jonathan A.; Gale, Philip A. pH-Regulated Nonelectrogenic Anion Transport by Phenylthiosemicarbazones. Journal of the American Chemical Society 138(26) (2016) 8301-8308
Space group: P 1 21/c 1
Cell volume: 1317.98
Cell parameters: 15.8157; 7.5474; 11.0448; 90; 91.419; 90;

COD ID: 4125115
CIF file	Formula: - C23 H24 N2 O3 - Comments: Allemann, Oliver; Brutsch, Manuela; Lukesh, 3rd, John C; Brody, Daniel M.; Boger, Dale L. Synthesis of a Potent Vinblastine: Rationally Designed Added Benign Complexity. Journal of the American Chemical Society 138(27) (2016) 8376-8379 Space group: P 21 21 21 Cell volume: 1832.91 Cell parameters: 7.9683; 10.4097; 22.0972; 90; 90; 90;

COD ID: 4125116

CIF file

Formula: - C25 H38 Cl7 N -
Comments: Zhukhovitskiy, Aleksandr V.; Mavros, Michael G.; Queeney, K. T.; Wu, Tony; Voorhis, Troy Van; Johnson, Jeremiah A. Reactions of Persistent Carbenes with Hydrogen-Terminated Silicon Surfaces. Journal of the American Chemical Society 138(27) (2016) 8639-8652
Space group: P 1 21/n 1
Cell volume: 6024.2
Cell parameters: 9.8718; 16.9815; 36.212; 90; 97.081; 90;

COD ID: 4125117

CIF file

Formula: - C19 H29 F3 N2 O5 S -
Comments: Zhukhovitskiy, Aleksandr V.; Mavros, Michael G.; Queeney, K. T.; Wu, Tony; Voorhis, Troy Van; Johnson, Jeremiah A. Reactions of Persistent Carbenes with Hydrogen-Terminated Silicon Surfaces. Journal of the American Chemical Society 138(27) (2016) 8639-8652
Space group: P -1
Cell volume: 3236.8
Cell parameters: 12.6127; 15.2311; 17.9955; 69.5328; 88.0275; 88.8565;

COD ID: 4125118

CIF file

Formula: - C32 H63 N Si4 -
Comments: Zhukhovitskiy, Aleksandr V.; Mavros, Michael G.; Queeney, K. T.; Wu, Tony; Voorhis, Troy Van; Johnson, Jeremiah A. Reactions of Persistent Carbenes with Hydrogen-Terminated Silicon Surfaces. Journal of the American Chemical Society 138(27) (2016) 8639-8652
Space group: P 1 21/n 1
Cell volume: 3524.6
Cell parameters: 12.4987; 16.0655; 17.6184; 90; 94.9451; 90;

COD ID: 4125119

CIF file

Formula: - C25 H29 F3 N2 O5 S -
Comments: Zhukhovitskiy, Aleksandr V.; Mavros, Michael G.; Queeney, K. T.; Wu, Tony; Voorhis, Troy Van; Johnson, Jeremiah A. Reactions of Persistent Carbenes with Hydrogen-Terminated Silicon Surfaces. Journal of the American Chemical Society 138(27) (2016) 8639-8652
Space group: P 1 21/n 1
Cell volume: 2521.7
Cell parameters: 8.7865; 21.4221; 13.4402; 90; 94.5721; 90;

COD ID: 4125120

CIF file

Formula: - C14 H15 Cl4 N4 O Ru S -
Comments: Novotný, Jan; Sojka, Martin; Komorovsky, Stanislav; Nečas, Marek; Marek, Radek Interpreting the Paramagnetic NMR Spectra of Potential Ru(III) Metallodrugs: Synergy between Experiment and Relativistic DFT Calculations. Journal of the American Chemical Society 138(27) (2016) 8432-8445
Space group: P 1 21/n 1
Cell volume: 1949.4
Cell parameters: 7.1525; 23.0424; 11.829; 90; 90.688; 90;

COD ID: 4125121

CIF file

Formula: - C14 H15 Cl4 F6 N2 O Ru S -
Comments: Novotný, Jan; Sojka, Martin; Komorovsky, Stanislav; Nečas, Marek; Marek, Radek Interpreting the Paramagnetic NMR Spectra of Potential Ru(III) Metallodrugs: Synergy between Experiment and Relativistic DFT Calculations. Journal of the American Chemical Society 138(27) (2016) 8432-8445
Space group: P 1 21/n 1
Cell volume: 2103.79
Cell parameters: 7.8013; 10.8212; 25.017; 90; 95.03; 90;

COD ID: 4125122

CIF file

Formula: - C26.5 H30 Cl5 N2 O Ru S -
Comments: Novotný, Jan; Sojka, Martin; Komorovsky, Stanislav; Nečas, Marek; Marek, Radek Interpreting the Paramagnetic NMR Spectra of Potential Ru(III) Metallodrugs: Synergy between Experiment and Relativistic DFT Calculations. Journal of the American Chemical Society 138(27) (2016) 8432-8445
Space group: P -1
Cell volume: 5990.2
Cell parameters: 15.1499; 17.3913; 23.9791; 76.679; 89.978; 77.344;

COD ID: 4125123

CIF file

Formula: - C14 H21 Cl4 N2 O Rh S -
Comments: Novotný, Jan; Sojka, Martin; Komorovsky, Stanislav; Nečas, Marek; Marek, Radek Interpreting the Paramagnetic NMR Spectra of Potential Ru(III) Metallodrugs: Synergy between Experiment and Relativistic DFT Calculations. Journal of the American Chemical Society 138(27) (2016) 8432-8445
Space group: P -1
Cell volume: 1936.04
Cell parameters: 9.2004; 15.21; 15.6366; 71.257; 73.832; 72.534;

COD ID: 4125124

CIF file

Formula: - C14 H15 Cl4 N4 O Rh S -
Comments: Novotný, Jan; Sojka, Martin; Komorovsky, Stanislav; Nečas, Marek; Marek, Radek Interpreting the Paramagnetic NMR Spectra of Potential Ru(III) Metallodrugs: Synergy between Experiment and Relativistic DFT Calculations. Journal of the American Chemical Society 138(27) (2016) 8432-8445
Space group: P 1 21/n 1
Cell volume: 1945.09
Cell parameters: 7.1887; 22.9114; 11.8104; 90; 90.63; 90;

COD ID: 4125125

CIF file

Formula: - C14 H15 Cl4 F6 N2 O Rh S -
Comments: Novotný, Jan; Sojka, Martin; Komorovsky, Stanislav; Nečas, Marek; Marek, Radek Interpreting the Paramagnetic NMR Spectra of Potential Ru(III) Metallodrugs: Synergy between Experiment and Relativistic DFT Calculations. Journal of the American Chemical Society 138(27) (2016) 8432-8445
Space group: P 1 21/n 1
Cell volume: 2095
Cell parameters: 7.7976; 10.7641; 25.0618; 90; 95.151; 90;

COD ID: 4125126
CIF file	Formula: - C22 H27 I N O P - Comments: Yang, Youqing; Li, Ruirui; Zhao, Yue; Zhao, Dongbing; Shi, Zhuangzhi Cu-Catalyzed Direct C6-Arylation of Indoles. Journal of the American Chemical Society 138(28) (2016) 8734-8737 Space group: P -1 Cell volume: 2117.9 Cell parameters: 12.0966; 12.7937; 16.0697; 81.918; 70.076; 64.935;

COD ID: 4125127
CIF file	Formula: - C22 H28 N O P - Comments: Yang, Youqing; Li, Ruirui; Zhao, Yue; Zhao, Dongbing; Shi, Zhuangzhi Cu-Catalyzed Direct C6-Arylation of Indoles. Journal of the American Chemical Society 138(28) (2016) 8734-8737 Space group: P b c a Cell volume: 3860.6 Cell parameters: 13.0319; 12.8304; 23.089; 90; 90; 90;

COD ID: 4125128

CIF file

Formula: - C23 H24 O8 -
Comments: Lahive, Ciaran W.; Deuss, Peter J.; Lancefield, Christopher S.; Sun, Zhuohua; Cordes, David B.; Young, Claire M.; Tran, Fanny; Slawin, Alexandra M. Z.; de Vries, Johannes G.; Kamer, Paul C. J.; Westwood, Nicholas J.; Barta, Katalin Advanced Model Compounds for Understanding Acid-Catalyzed Lignin Depolymerization: Identification of Renewable Aromatics and a Lignin-Derived Solvent. Journal of the American Chemical Society 138(28) (2016) 8900-8911
Space group: P 1 21/n 1
Cell volume: 2098
Cell parameters: 4.581; 20.94; 21.9; 90; 92.86; 90;

COD ID: 4125129

CIF file

Formula: - C20 H20 O7 -
Comments: Lahive, Ciaran W.; Deuss, Peter J.; Lancefield, Christopher S.; Sun, Zhuohua; Cordes, David B.; Young, Claire M.; Tran, Fanny; Slawin, Alexandra M. Z.; de Vries, Johannes G.; Kamer, Paul C. J.; Westwood, Nicholas J.; Barta, Katalin Advanced Model Compounds for Understanding Acid-Catalyzed Lignin Depolymerization: Identification of Renewable Aromatics and a Lignin-Derived Solvent. Journal of the American Chemical Society 138(28) (2016) 8900-8911
Space group: P 1 21/c 1
Cell volume: 1792.6
Cell parameters: 8.6085; 26.787; 7.8482; 90; 97.903; 90;

COD ID: 4125130

CIF file

Formula: - C64 H48 O40 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m m c
Cell volume: 8604
Cell parameters: 24.263; 24.263; 14.615; 90; 90; 90;

COD ID: 4125131

CIF file

Formula: - C56 H24 N8 O48 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m m c
Cell volume: 8957
Cell parameters: 24.25; 24.25; 15.232; 90; 90; 90;

COD ID: 4125132

CIF file

Formula: - C64 H56 O32 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m m c
Cell volume: 8844
Cell parameters: 24.348; 24.348; 14.918; 90; 90; 90;

COD ID: 4125133

CIF file

Formula: - C56 H24 I8 O32 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m m c
Cell volume: 8775
Cell parameters: 24.35; 24.354; 14.797; 90; 90; 90;

COD ID: 4125134

CIF file

Formula: - C64 H24 F24 O32 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/n c m :2
Cell volume: 14706
Cell parameters: 34.882; 34.882; 12.086; 90; 90; 90;

COD ID: 4125135

CIF file

Formula: - C56 H16 N16 O64 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m m c
Cell volume: 9885.6
Cell parameters: 23.024; 23.024; 18.6484; 90; 90; 90;

COD ID: 4125136

CIF file

Formula: - C72 H64 O32 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m m c
Cell volume: 9008
Cell parameters: 24.218; 24.218; 15.359; 90; 90; 90;

COD ID: 4125137

CIF file

Formula: - C98 H70 Cu0.53 I0.27 N2.27 O32 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m m c
Cell volume: 10023.1
Cell parameters: 23.0867; 23.087; 18.8049; 90; 90; 90;

COD ID: 4125138

CIF file

Formula: - C68 H50 O32 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/n c m :2
Cell volume: 15562
Cell parameters: 35.053; 35.053; 12.665; 90; 90; 90;

COD ID: 4125139

CIF file

Formula: - C72 H58 O32 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m m c
Cell volume: 8859
Cell parameters: 24.4; 24.401; 14.88; 90; 90; 90;

COD ID: 4125140

CIF file

Formula: - C76 H54 O32 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m m c
Cell volume: 9429
Cell parameters: 23.679; 23.679; 16.816; 90; 90; 90;

COD ID: 4125141

CIF file

Formula: - C70 H40 O32 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m m c
Cell volume: 10200
Cell parameters: 23.07; 23.075; 19.16; 90; 90; 90;

COD ID: 4125142

CIF file

Formula: - C86 H70 O32 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m m c
Cell volume: 9180
Cell parameters: 23.91; 23.91; 16.057; 90; 90; 90;

COD ID: 4125143

CIF file

Formula: - C74 H54 O32 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m m c
Cell volume: 8924
Cell parameters: 24.378; 24.378; 15.017; 90; 90; 90;

COD ID: 4125144

CIF file

Formula: - C83 H65 O32 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m n m
Cell volume: 17245
Cell parameters: 34.29; 34.293; 14.665; 90; 90; 90;

COD ID: 4125145

CIF file

Formula: - C82 H58 O32 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m m c
Cell volume: 8765
Cell parameters: 24.288; 24.288; 14.859; 90; 90; 90;

COD ID: 4125146

CIF file

Formula: - C87 H62 O32 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m n m
Cell volume: 18886
Cell parameters: 33.505; 33.505; 16.824; 90; 90; 90;

COD ID: 4125147

CIF file

Formula: - C96 H66 O32 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m m c
Cell volume: 9606
Cell parameters: 23.9; 23.9; 16.817; 90; 90; 90;

COD ID: 4125148

CIF file

Formula: - C80.8 H49.6 O28.8 Zr6 -
Comments: Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. Journal of the American Chemical Society 138(28) (2016) 8912-8919
Space group: P 42/m m c
Cell volume: 10380
Cell parameters: 23.33; 23.332; 19.07; 90; 90; 90;

COD ID: 4125149

CIF file

Formula: - C30 H16 B2 O4 -
Comments: Wang, Xiao-Ye; Narita, Akimitsu; Zhang, Wen; Feng, Xinliang; Müllen, Klaus Synthesis of Stable Nanographenes with OBO-Doped Zigzag Edges Based on Tandem Demethylation-Electrophilic Borylation. Journal of the American Chemical Society 138(29) (2016) 9021-9024
Space group: P -1
Cell volume: 1194.9
Cell parameters: 7.0696; 10.6921; 16.9433; 105.252; 91.082; 103.892;

COD ID: 4125150

CIF file

Formula: - C6 H16 B10 N2 -
Comments: Dziedzic, Rafal M.; Saleh, Liban M. A.; Axtell, Jonathan C.; Martin, Joshua L.; Stevens, Simone L.; Royappa, A. Timothy; Rheingold, Arnold L.; Spokoyny, Alexander M. B-N, B-O, and B-CN Bond Formation via Palladium-Catalyzed Cross-Coupling of B-Bromo-Carboranes. Journal of the American Chemical Society 138(29) (2016) 9081-9084
Space group: P n a 21
Cell volume: 1284.7
Cell parameters: 12.788; 10.8486; 9.2601; 90; 90; 90;

COD ID: 4125151

CIF file

Formula: - C10 H20 B10 O -
Comments: Dziedzic, Rafal M.; Saleh, Liban M. A.; Axtell, Jonathan C.; Martin, Joshua L.; Stevens, Simone L.; Royappa, A. Timothy; Rheingold, Arnold L.; Spokoyny, Alexander M. B-N, B-O, and B-CN Bond Formation via Palladium-Catalyzed Cross-Coupling of B-Bromo-Carboranes. Journal of the American Chemical Society 138(29) (2016) 9081-9084
Space group: P 1 21/n 1
Cell volume: 1574.64
Cell parameters: 8.6489; 13.1773; 13.8649; 90; 94.794; 90;

COD ID: 4125152

CIF file

Formula: - C3 H11 B10 N -
Comments: Dziedzic, Rafal M.; Saleh, Liban M. A.; Axtell, Jonathan C.; Martin, Joshua L.; Stevens, Simone L.; Royappa, A. Timothy; Rheingold, Arnold L.; Spokoyny, Alexander M. B-N, B-O, and B-CN Bond Formation via Palladium-Catalyzed Cross-Coupling of B-Bromo-Carboranes. Journal of the American Chemical Society 138(29) (2016) 9081-9084
Space group: P b c a
Cell volume: 2057.5
Cell parameters: 12.862; 12.2276; 13.0826; 90; 90; 90;

COD ID: 4125153

CIF file

Formula: - C18 H28 B10 O2 -
Comments: Dziedzic, Rafal M.; Saleh, Liban M. A.; Axtell, Jonathan C.; Martin, Joshua L.; Stevens, Simone L.; Royappa, A. Timothy; Rheingold, Arnold L.; Spokoyny, Alexander M. B-N, B-O, and B-CN Bond Formation via Palladium-Catalyzed Cross-Coupling of B-Bromo-Carboranes. Journal of the American Chemical Society 138(29) (2016) 9081-9084
Space group: P -1
Cell volume: 1101.34
Cell parameters: 7.7608; 11.8506; 13.1031; 103.335; 100.977; 103.535;

Back to the search form
Your own data is not in the COD? Deposit it, thanks!