Crystallography Open Database

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Searching year of publication is 2013

COD ID: 1508819
CIF file Formula: - C15 H19 Cl N4 O4 -
Comments: Ye, Zhenjun; Shi, Lina; Shao, Xusheng; Xu, Xiaoyong; Xu, Zhiping; Li, Zhong Pyrrole- and dihydropyrrole-fused neonicotinoids: design, synthesis, and insecticidal evaluation. Journal of agricultural and food chemistry 61(2) (2013) 312-319
Space group: P c a 21
Cell volume: 3219.8
Cell parameters: 11.6146; 7.7855; 35.607; 90; 90; 90;  

COD ID: 1508820
CIF file Formula: - C12 H22 Cl2 N2 O8 Pt -
Comments: Varbanov, Hristo P.; Jakupec, Michael A.; Roller, Alexander; Jensen, Frank; Galanski, Markus; Keppler, Bernhard K. Theoretical Investigations and Density Functional Theory Based Quantitative Structure-Activity Relationships Model for Novel Cytotoxic Platinum(IV) Complexes. Journal of medicinal chemistry 56(1) (2013) 330-344
Space group: P -1
Cell volume: 891.63
Cell parameters: 8.2185; 10.0375; 12.4165; 67.002; 71.136; 84.577;  

COD ID: 1508821
CIF file Formula: - C26 H20 -
Comments: Sonoda, Yoriko; Shimoi, Yukihiro; Goto, Midori; Tohnai, Norimitsu; Kanesato, Masatoshi Fluorescence Properties of (E,E,E)-1,6-Di(n-naphthyl)-1,3,5-hexatriene (n = 1, 2): Effects of Internal Rotation. The journal of physical chemistry. A 117(3) (2013) 566-578
Space group: P 1
Cell volume: 897.4
Cell parameters: 6.95; 7.4; 17.571; 92.119; 96.424; 90.191;  

COD ID: 1508822
CIF file Formula: - C26 H20 -
Comments: Sonoda, Yoriko; Shimoi, Yukihiro; Goto, Midori; Tohnai, Norimitsu; Kanesato, Masatoshi Fluorescence Properties of (E,E,E)-1,6-Di(n-naphthyl)-1,3,5-hexatriene (n = 1, 2): Effects of Internal Rotation. The journal of physical chemistry. A 117(3) (2013) 566-578
Space group: P 1 21 1
Cell volume: 879.7
Cell parameters: 6.556; 7.272; 18.452; 90; 90.519; 90;  

COD ID: 1508823
CIF file Formula: - C48 H53 N O7 Pt -
Comments: Shigehiro, Tatsuya; Yagi, Shigeyuki; Maeda, Takeshi; Nakazumi, Hiroyuki; Fujiwara, Hideki; Sakurai, Yoshiaki Photo- and Electroluminescence from 2-(Dibenzo[b,d]furan-4-yl)pyridine-Based Heteroleptic Cyclometalated Platinum(II) Complexes: Excimer Formation Drastically Facilitated by an Aromatic Diketonate Ancillary Ligand The Journal of Physical Chemistry C 117(1) (2013) 532
Space group: P 1 21/c 1
Cell volume: 4183.4
Cell parameters: 18.3993; 8.58214; 27.5862; 90; 106.182; 90;  

COD ID: 1508824
CIF file Formula: - C28 H29 N O3 Pt -
Comments: Shigehiro, Tatsuya; Yagi, Shigeyuki; Maeda, Takeshi; Nakazumi, Hiroyuki; Fujiwara, Hideki; Sakurai, Yoshiaki Photo- and Electroluminescence from 2-(Dibenzo[b,d]furan-4-yl)pyridine-Based Heteroleptic Cyclometalated Platinum(II) Complexes: Excimer Formation Drastically Facilitated by an Aromatic Diketonate Ancillary Ligand The Journal of Physical Chemistry C 117(1) (2013) 532
Space group: P 1 21/c 1
Cell volume: 5030.4
Cell parameters: 8.8407; 17.8439; 31.9076; 90; 92.0189; 90;  

COD ID: 1508825
CIF file Formula: - C17 H11 B Br F2 N O -
Comments: Zakrzewska, Anna; Kolehmainen, Erkki; Valkonen, Arto; Haapaniemi, Esa; Rissanen, Kari; Chęcińska, Lilianna; Ośmiałowski, Borys Substituent Effect in 2-Benzoylmethylenequinoline Difluoroborates Exhibiting Through-Space Couplings. Multinuclear Magnetic Resonance, X-ray Diffraction, and Computational Study. The journal of physical chemistry. A 117(1) (2013) 252-256
Space group: P 1 21/n 1
Cell volume: 1440.27
Cell parameters: 8.2591; 12.7538; 14.1802; 90; 105.367; 90;  

COD ID: 1508826
CIF file Formula: - C18 H14 B F2 N O2 -
Comments: Zakrzewska, Anna; Kolehmainen, Erkki; Valkonen, Arto; Haapaniemi, Esa; Rissanen, Kari; Chęcińska, Lilianna; Ośmiałowski, Borys Substituent Effect in 2-Benzoylmethylenequinoline Difluoroborates Exhibiting Through-Space Couplings. Multinuclear Magnetic Resonance, X-ray Diffraction, and Computational Study. The journal of physical chemistry. A 117(1) (2013) 252-256
Space group: P 1 21 1
Cell volume: 1459.74
Cell parameters: 8.3324; 12.3542; 14.6062; 90; 103.868; 90;  

COD ID: 1508827
CIF file Formula: - C18 H14 B F2 N O -
Comments: Zakrzewska, Anna; Kolehmainen, Erkki; Valkonen, Arto; Haapaniemi, Esa; Rissanen, Kari; Chęcińska, Lilianna; Ośmiałowski, Borys Substituent Effect in 2-Benzoylmethylenequinoline Difluoroborates Exhibiting Through-Space Couplings. Multinuclear Magnetic Resonance, X-ray Diffraction, and Computational Study. The journal of physical chemistry. A 117(1) (2013) 252-256
Space group: P 1 21/n 1
Cell volume: 1413.61
Cell parameters: 8.2951; 12.8843; 13.5914; 90; 103.305; 90;  

COD ID: 1508828
CIF file Formula: - C18 H11 B F5 N O -
Comments: Zakrzewska, Anna; Kolehmainen, Erkki; Valkonen, Arto; Haapaniemi, Esa; Rissanen, Kari; Chęcińska, Lilianna; Ośmiałowski, Borys Substituent Effect in 2-Benzoylmethylenequinoline Difluoroborates Exhibiting Through-Space Couplings. Multinuclear Magnetic Resonance, X-ray Diffraction, and Computational Study. The journal of physical chemistry. A 117(1) (2013) 252-256
Space group: P -1
Cell volume: 762.54
Cell parameters: 7.7839; 8.172; 12.735; 77.081; 80.031; 76.88;  

COD ID: 1508829
CIF file Formula: - C18 H14 B F2 N O -
Comments: Zakrzewska, Anna; Kolehmainen, Erkki; Valkonen, Arto; Haapaniemi, Esa; Rissanen, Kari; Chęcińska, Lilianna; Ośmiałowski, Borys Substituent Effect in 2-Benzoylmethylenequinoline Difluoroborates Exhibiting Through-Space Couplings. Multinuclear Magnetic Resonance, X-ray Diffraction, and Computational Study. The journal of physical chemistry. A 117(1) (2013) 252-256
Space group: P 1 21/c 1
Cell volume: 1417.92
Cell parameters: 7.1119; 14.2344; 14.2595; 90; 100.811; 90;  

COD ID: 1508830
CIF file Formula: - C17 H12 B F2 N O -
Comments: Zakrzewska, Anna; Kolehmainen, Erkki; Valkonen, Arto; Haapaniemi, Esa; Rissanen, Kari; Chęcińska, Lilianna; Ośmiałowski, Borys Substituent Effect in 2-Benzoylmethylenequinoline Difluoroborates Exhibiting Through-Space Couplings. Multinuclear Magnetic Resonance, X-ray Diffraction, and Computational Study. The journal of physical chemistry. A 117(1) (2013) 252-256
Space group: P 1 21/n 1
Cell volume: 1308.26
Cell parameters: 7.67122; 11.9542; 14.336; 90; 95.657; 90;  

COD ID: 1508831
CIF file Formula: - C14 H9 N O3 -
Comments: Fourati, M. Amine; Skene, W. G.; Bazuin, C Géraldine; Prud'homme, Robert E. Photophysical and Electrochemical Investigations of the Fluorescent Probe, 4,4'-Bis(2-benzoxazolyl)stilbene. The journal of physical chemistry. A 117(5) (2013) 836-844
Space group: P -1
Cell volume: 783.15
Cell parameters: 4.7147; 9.9033; 17.3871; 101.436; 95.574; 97.222;  

COD ID: 1508832
CIF file Formula: - C56 H120 O12 Si8 -
Comments: El Aziz, Youssef; Bassindale, Alan R.; Taylor, Peter G.; Stephenson, Richard A.; Hursthouse, Michael B.; Harrington, Ross W.; Clegg, William X-ray Crystal Structures, Packing Behavior, and Thermal Stability Studies of a Homologous Series ofn-Alkyl-Substituted Polyhedral Oligomeric Silsesquioxanes Macromolecules 46(3) (2013) 988
Space group: P 4/n :2
Cell volume: 7104
Cell parameters: 21.4407; 21.4407; 15.4535; 90; 90; 90;  

COD ID: 1508833
CIF file Formula: - C56 H120 O12 Si8 -
Comments: El Aziz, Youssef; Bassindale, Alan R.; Taylor, Peter G.; Stephenson, Richard A.; Hursthouse, Michael B.; Harrington, Ross W.; Clegg, William X-ray Crystal Structures, Packing Behavior, and Thermal Stability Studies of a Homologous Series ofn-Alkyl-Substituted Polyhedral Oligomeric Silsesquioxanes Macromolecules 46(3) (2013) 988
Space group: P -1
Cell volume: 1752
Cell parameters: 8.5414; 8.9275; 23.11; 84.579; 87.068; 89.294;  

COD ID: 1508834
CIF file Formula: - C32 H72 O12 Si8 -
Comments: El Aziz, Youssef; Bassindale, Alan R.; Taylor, Peter G.; Stephenson, Richard A.; Hursthouse, Michael B.; Harrington, Ross W.; Clegg, William X-ray Crystal Structures, Packing Behavior, and Thermal Stability Studies of a Homologous Series ofn-Alkyl-Substituted Polyhedral Oligomeric Silsesquioxanes Macromolecules 46(3) (2013) 988
Space group: P -1
Cell volume: 1198.09
Cell parameters: 9.5947; 9.6312; 13.6739; 75.877; 80.373; 80.569;  

COD ID: 1508835
CIF file Formula: - C40 H88 O12 Si8 -
Comments: El Aziz, Youssef; Bassindale, Alan R.; Taylor, Peter G.; Stephenson, Richard A.; Hursthouse, Michael B.; Harrington, Ross W.; Clegg, William X-ray Crystal Structures, Packing Behavior, and Thermal Stability Studies of a Homologous Series ofn-Alkyl-Substituted Polyhedral Oligomeric Silsesquioxanes Macromolecules 46(3) (2013) 988
Space group: P 4/n :2
Cell volume: 10955.3
Cell parameters: 26.4815; 26.4815; 15.6221; 90; 90; 90;  

COD ID: 1508836
CIF file Formula: - C64 H136 O12 Si8 -
Comments: El Aziz, Youssef; Bassindale, Alan R.; Taylor, Peter G.; Stephenson, Richard A.; Hursthouse, Michael B.; Harrington, Ross W.; Clegg, William X-ray Crystal Structures, Packing Behavior, and Thermal Stability Studies of a Homologous Series ofn-Alkyl-Substituted Polyhedral Oligomeric Silsesquioxanes Macromolecules 46(3) (2013) 988
Space group: P -1
Cell volume: 1952.96
Cell parameters: 8.5348; 9.1768; 25.1451; 85.506; 84.329; 87.938;  

COD ID: 1508837
CIF file Formula: - C80 H168 O12 Si8 -
Comments: El Aziz, Youssef; Bassindale, Alan R.; Taylor, Peter G.; Stephenson, Richard A.; Hursthouse, Michael B.; Harrington, Ross W.; Clegg, William X-ray Crystal Structures, Packing Behavior, and Thermal Stability Studies of a Homologous Series ofn-Alkyl-Substituted Polyhedral Oligomeric Silsesquioxanes Macromolecules 46(3) (2013) 988
Space group: P -1
Cell volume: 2394
Cell parameters: 8.554; 9.232; 30.97; 97.556; 93.843; 97.615;  

COD ID: 1508838
CIF file Formula: - C48 H104 O12 Si8 -
Comments: El Aziz, Youssef; Bassindale, Alan R.; Taylor, Peter G.; Stephenson, Richard A.; Hursthouse, Michael B.; Harrington, Ross W.; Clegg, William X-ray Crystal Structures, Packing Behavior, and Thermal Stability Studies of a Homologous Series ofn-Alkyl-Substituted Polyhedral Oligomeric Silsesquioxanes Macromolecules 46(3) (2013) 988
Space group: P -1
Cell volume: 1621.9
Cell parameters: 8.664; 9.475; 20.486; 78.122; 80.489; 85.953;  

COD ID: 1508839
CIF file Formula: - C15 H22 O5 -
Comments: Wang, Shao-Juan; Bao, Li; Han, Jun-Jie; Wang, Quan-Xin; Yang, Xiao-Li; Wen, Hua-An; Guo, Liang-Dong; Li, Shao-Jie; Zhao, Feng; Liu, Hong-Wei Pleurospiroketals A-E, Perhydrobenzannulated 5,5-Spiroketal Sesquiterpenes from the Edible Mushroom Pleurotus cornucopiae. Journal of natural products 76(1) (2013) 45-50
Space group: P 21 21 21
Cell volume: 1507.07
Cell parameters: 9.8904; 10.0215; 15.205; 90; 90; 90;  

COD ID: 1508840
CIF file Formula: - C15 H26 O3 -
Comments: Luo, Ji; Liu, Xiangyu; Li, Erwei; Guo, Liangdong; Che, Yongsheng Arundinols A-C and Arundinones A and B from the Plant Endophytic Fungus Microsphaeropsis arundinis. Journal of natural products 76(1) (2013) 107-112
Space group: P 1 21 1
Cell volume: 702.3
Cell parameters: 9.965; 5.5627; 13.216; 90; 106.53; 90;  

COD ID: 1508841
CIF file Formula: - C26 H24 -
Comments: Jiang, Huanfeng; Gao, Yang; Wu, Wanqing; Huang, Yubing Pd(II)-Catalyzed Highly Regio- and Stereoselective Assembly of C-C Double Bonds: An Efficient Method for the Synthesis of 2,4-Dihalo-1,3,5-trienes from Alkynols. Organic letters 15(2) (2013) 238-241
Space group: P 1 21/c 1
Cell volume: 1003.5
Cell parameters: 11.406; 5.8201; 15.187; 90; 95.53; 90;  

COD ID: 1508842
CIF file Formula: - C17 H14 Br N O -
Comments: Cao, Zhong-Yan; Zhou, Feng; Yu, Yi-Hua; Zhou, Jian A Highly Diastereo- and Enantioselective Hg(II)-Catalyzed Cyclopropanation of Diazooxindoles and Alkenes. Organic letters 15(1) (2013) 42-45
Space group: P 21 21 21
Cell volume: 1400.8
Cell parameters: 6.1191; 12.656; 18.088; 90; 90; 90;  

COD ID: 1508843
CIF file Formula: - C22 H31 N O2 -
Comments: Martin, Rhia M.; Bergman, Robert G.; Ellman, Jonathan A. Synthesis of Isoquinuclidines from Highly Substituted Dihydropyridines via the Diels-Alder Reaction. Organic letters 15(3) (2013) 444-447
Space group: P 1 21 1
Cell volume: 962.09
Cell parameters: 7.6187; 15.2421; 8.3982; 90; 99.42; 90;  

COD ID: 1508844
CIF file Formula: - C15 H18 O4 -
Comments: Song, Liyan; Yao, Hongliang; Zhu, Liangyu; Tong, Rongbiao Asymmetric Total Syntheses of (-)-Penicipyrone and (-)-Tenuipyrone via Biomimetic Cascade Intermolecular Michael Addition/Cycloketalization. Organic letters 15(1) (2013) 6-9
Space group: P 1 21/c 1
Cell volume: 1334.52
Cell parameters: 15.5908; 12.0381; 7.2191; 90; 99.952; 90;  

COD ID: 1508845
CIF file Formula: - C13 H16 O4 -
Comments: Song, Liyan; Yao, Hongliang; Zhu, Liangyu; Tong, Rongbiao Asymmetric Total Syntheses of (-)-Penicipyrone and (-)-Tenuipyrone via Biomimetic Cascade Intermolecular Michael Addition/Cycloketalization. Organic letters 15(1) (2013) 6-9
Space group: P 1 21/c 1
Cell volume: 1138.98
Cell parameters: 10.6914; 9.8462; 11.5299; 90; 110.216; 90;  

COD ID: 1508846
CIF file Formula: - C12.5 H20 Cl2 Ir N O2 -
Comments: Wetzel, Alexander; Wöckel, Simone; Schelwies, Mathias; Brinks, Marion K.; Rominger, Frank; Hofmann, Peter; Limbach, Michael Selective Alkylation of Amines with Alcohols by Cp*-Iridium(III) Half-Sandwich Complexes. Organic letters 15(2) (2013) 266-269
Space group: P 21 21 21
Cell volume: 3109.8
Cell parameters: 12.8975; 14.6754; 16.4298; 90; 90; 90;  

COD ID: 1508847
CIF file Formula: - C18 H23 N O3 -
Comments: Wang, Gang; Liu, Xiaohua; Huang, Tianyu; Kuang, Yulong; Lin, Lili; Feng, Xiaoming Asymmetric catalytic 1,3-dipolar cycloaddition reaction of nitrile imines for the synthesis of chiral spiro-pyrazoline-oxindoles. Organic letters 15(1) (2013) 76-79
Space group: P -1
Cell volume: 860.49
Cell parameters: 6.7576; 9.8259; 13.085; 92.213; 97.254; 92.098;  

COD ID: 1508848
CIF file Formula: - C33 H29 N3 O3 -
Comments: Wang, Gang; Liu, Xiaohua; Huang, Tianyu; Kuang, Yulong; Lin, Lili; Feng, Xiaoming Asymmetric catalytic 1,3-dipolar cycloaddition reaction of nitrile imines for the synthesis of chiral spiro-pyrazoline-oxindoles. Organic letters 15(1) (2013) 76-79
Space group: P 1 21 1
Cell volume: 2759.7
Cell parameters: 12.016; 18.7857; 12.339; 90; 97.777; 90;  

COD ID: 1508849
CIF file Formula: - C29 H31 N3 O3 S -
Comments: Wang, Gang; Liu, Xiaohua; Huang, Tianyu; Kuang, Yulong; Lin, Lili; Feng, Xiaoming Asymmetric catalytic 1,3-dipolar cycloaddition reaction of nitrile imines for the synthesis of chiral spiro-pyrazoline-oxindoles. Organic letters 15(1) (2013) 76-79
Space group: P 21 21 21
Cell volume: 2670.4
Cell parameters: 9.0374; 15.0633; 19.6158; 90; 90; 90;  

COD ID: 1508850
CIF file Formula: - C36 H48 S4 Si2 -
Comments: Dou, Chuandong; Saito, Shohei; Gao, Libin; Matsumoto, Naoki; Karasawa, Takashi; Zhang, Hongyu; Fukazawa, Aiko; Yamaguchi, Shigehiro Sequential Electrophilic and Photochemical Cyclizations from Bis(bithienyl)acetylene to a Tetrathienonaphthalene Core. Organic letters 15(1) (2013) 80-83
Space group: P 1 21/c 1
Cell volume: 3534
Cell parameters: 14.45; 16.149; 16.146; 90; 110.285; 90;  

COD ID: 1508851
CIF file Formula: - C36 H48 S4 Si2 -
Comments: Dou, Chuandong; Saito, Shohei; Gao, Libin; Matsumoto, Naoki; Karasawa, Takashi; Zhang, Hongyu; Fukazawa, Aiko; Yamaguchi, Shigehiro Sequential Electrophilic and Photochemical Cyclizations from Bis(bithienyl)acetylene to a Tetrathienonaphthalene Core. Organic letters 15(1) (2013) 80-83
Space group: P -1
Cell volume: 1757.6
Cell parameters: 7.5456; 12.1175; 19.49; 80.956; 88.114; 87.511;  

COD ID: 1508852
CIF file Formula: - C36 H49 I S4 Si2 -
Comments: Dou, Chuandong; Saito, Shohei; Gao, Libin; Matsumoto, Naoki; Karasawa, Takashi; Zhang, Hongyu; Fukazawa, Aiko; Yamaguchi, Shigehiro Sequential Electrophilic and Photochemical Cyclizations from Bis(bithienyl)acetylene to a Tetrathienonaphthalene Core. Organic letters 15(1) (2013) 80-83
Space group: P -1
Cell volume: 1938.5
Cell parameters: 8.5863; 12.175; 18.897; 92.036; 96.456; 98.521;  

COD ID: 1508853
CIF file Formula: - C52 H30 F6 S -
Comments: Li, Jing; Huang, Huanan; Liang, Weihong; Gao, Qun; Duan, Zheng Catalytic C-h and C-s bond activation of thiophenes. Organic letters 15(2) (2013) 282-285
Space group: P -1
Cell volume: 1951.88
Cell parameters: 11.2017; 12.1697; 15.1195; 85.32; 82.624; 72.927;  

COD ID: 1508854
CIF file Formula: - C69 H52 S -
Comments: Li, Jing; Huang, Huanan; Liang, Weihong; Gao, Qun; Duan, Zheng Catalytic C-h and C-s bond activation of thiophenes. Organic letters 15(2) (2013) 282-285
Space group: P -1
Cell volume: 2606.7
Cell parameters: 10.4792; 13.4657; 20.0797; 70.764; 77.704; 82.037;  

COD ID: 1508855
CIF file Formula: - C44 H35 F4 S -
Comments: Li, Jing; Huang, Huanan; Liang, Weihong; Gao, Qun; Duan, Zheng Catalytic C-h and C-s bond activation of thiophenes. Organic letters 15(2) (2013) 282-285
Space group: P 1 21/c 1
Cell volume: 3926.09
Cell parameters: 9.3242; 20.5863; 20.4716; 90; 92.4025; 90;  

COD ID: 1508856
CIF file Formula: - C213 H201 S4 -
Comments: Li, Jing; Huang, Huanan; Liang, Weihong; Gao, Qun; Duan, Zheng Catalytic C-h and C-s bond activation of thiophenes. Organic letters 15(2) (2013) 282-285
Space group: P -1
Cell volume: 4510
Cell parameters: 16.0668; 16.7268; 18.1635; 96.294; 99.037; 108.324;  

COD ID: 1508857
CIF file Formula: - C32 H29 Cl N2 O3 -
Comments: Shi, Feng; Xing, Gui-Juan; Zhu, Ren-Yi; Tan, Wei; Tu, Shujiang A Catalytic Asymmetric Isatin-Involved Povarov Reaction: Diastereo- and Enantioselective Construction of Spiro[indolin-3,2'-quinoline] Scaffold. Organic letters 15(1) (2013) 128-131
Space group: P 21 21 21
Cell volume: 2686.69
Cell parameters: 8.3771; 10.29; 31.168; 90; 90; 90;  

COD ID: 1508858
CIF file Formula: - C28 H25 N O4 -
Comments: Wu, Hua; He, Yu-Ping; Gong, Liu-Zhu Direct Access to Enantioenriched Spiroacetals through Asymmetric Relay Catalytic Three-Component Reaction. Organic letters 15(3) (2013) 460-463
Space group: P 1 21 1
Cell volume: 1145
Cell parameters: 12.652; 5.3373; 17.942; 90; 109.082; 90;  

COD ID: 1508859
CIF file Formula: - C15 H19 N O3 -
Comments: Reddy, B. V. Subba; Reddy, M. Ramana; Rao, Y. Gopal; Yadav, J. S.; Sridhar, B. Cu(OTf)(2)-Catalyzed Synthesis of 2,3-Disubstituted Indoles and 2,4,5-Trisubstituted Pyrroles from α-Diazoketones. Organic letters 15(3) (2013) 464-467
Space group: P -1
Cell volume: 675.33
Cell parameters: 6.9397; 8.8694; 11.1168; 97.572; 94.165; 92.775;  

COD ID: 1508860
CIF file Formula: - C14 H15 N O2 -
Comments: Reddy, B. V. Subba; Reddy, M. Ramana; Rao, Y. Gopal; Yadav, J. S.; Sridhar, B. Cu(OTf)(2)-Catalyzed Synthesis of 2,3-Disubstituted Indoles and 2,4,5-Trisubstituted Pyrroles from α-Diazoketones. Organic letters 15(3) (2013) 464-467
Space group: P 1 21/n 1
Cell volume: 1254.91
Cell parameters: 11.7298; 9.2723; 11.8853; 90; 103.883; 90;  

COD ID: 1508861
CIF file Formula: - C34 H32 N4 -
Comments: Chandra, Brijesh; Mahanta, Sanjeev P.; Pati, Narendra N.; Baskaran, Sambath; Kanaparthi, Ravi K.; Sivasankar, Chinnappan; Panda, Pradeepta K. Calix[2]bispyrrolylarenes: New Expanded Calix[4]pyrroles for Fluorometric Sensing of Anions via Extended π-Conjugation. Organic letters 15(2) (2013) 306-309
Space group: P 1 21/c 1
Cell volume: 5375
Cell parameters: 13.046; 18.896; 21.809; 90; 91.007; 90;  

COD ID: 1508862
CIF file Formula: - C24 H16 N2 -
Comments: Louillat, Marie-Laure; Patureau, Frederic W. Toward polynuclear ru-cu catalytic dehydrogenative C-N bond formation, on the reactivity of carbazoles. Organic letters 15(1) (2013) 164-167
Space group: P 1 21 1
Cell volume: 1724.65
Cell parameters: 7.6144; 7.5543; 29.9948; 90; 91.624; 90;  

COD ID: 1508863
CIF file Formula: - C24 H24 O4 -
Comments: Qin, Changming; Davies, Huw M. L. Enantioselective Synthesis of 2-Arylbicyclo[1.1.0]butane Carboxylates. Organic letters 15(2) (2013) 310-313
Space group: P -1
Cell volume: 1008.07
Cell parameters: 9.2295; 10.3951; 11.3783; 86.591; 69.851; 79.622;  

COD ID: 1508864
CIF file Formula: - C25 H25 N3 O3 -
Comments: Hong, Bor-Cherng; Liao, Wei-Kai; Dange, Nitin S.; Liao, Ju-Hsiou One-pot organocatalytic enantioselective domino double-Michael reaction and pictet-spengler-lactamization reaction. A facile entry to the "inside yohimbane" system with five contiguous stereogenic centers. Organic letters 15(3) (2013) 468-471
Space group: C 1 2 1
Cell volume: 2088.8
Cell parameters: 21.033; 9.9868; 10.2026; 90; 102.928; 90;  

COD ID: 1508865
CIF file Formula: - C25 H24 Cl N3 O3 -
Comments: Hong, Bor-Cherng; Liao, Wei-Kai; Dange, Nitin S.; Liao, Ju-Hsiou One-pot organocatalytic enantioselective domino double-Michael reaction and pictet-spengler-lactamization reaction. A facile entry to the "inside yohimbane" system with five contiguous stereogenic centers. Organic letters 15(3) (2013) 468-471
Space group: P 21 21 21
Cell volume: 2654.4
Cell parameters: 8.1146; 9.2164; 35.493; 90; 90; 90;  

COD ID: 1508866
CIF file Formula: - C12 H18 F6 N2 O2 -
Comments: Riofski, Mark V.; Hart, Allison D.; Colby, David A. Amidinate salt of hexafluoroacetone hydrate for the preparation of fluorinated compounds by the release of trifluoroacetate. Organic letters 15(1) (2013) 208-211
Space group: P 1 2/c 1
Cell volume: 1485.81
Cell parameters: 9.4219; 8.6467; 18.7345; 90; 103.222; 90;  

COD ID: 1508867
CIF file Formula: - C25 H28 Cl N O6 -
Comments: Gorbacheva, Evgenia O.; Tabolin, Andrey A.; Novikov, Roman A.; Khomutova, Yulia A.; Nelyubina, Yulia V.; Tomilov, Yury V.; Ioffe, Sema L. Six-membered cyclic nitronates as 1,3-dipoles in formal [3 + 3]-cycloaddition with donor-acceptor cyclopropanes. Synthesis of new type of bicyclic nitrosoacetals. Organic letters 15(2) (2013) 350-353
Space group: P 1 21/n 1
Cell volume: 2443.6
Cell parameters: 13.871; 11.664; 15.1202; 90; 92.72; 90;  

COD ID: 1508868
CIF file Formula: - C29 H29 N O6 -
Comments: Gorbacheva, Evgenia O.; Tabolin, Andrey A.; Novikov, Roman A.; Khomutova, Yulia A.; Nelyubina, Yulia V.; Tomilov, Yury V.; Ioffe, Sema L. Six-membered cyclic nitronates as 1,3-dipoles in formal [3 + 3]-cycloaddition with donor-acceptor cyclopropanes. Synthesis of new type of bicyclic nitrosoacetals. Organic letters 15(2) (2013) 350-353
Space group: P 1 21/c 1
Cell volume: 2431.04
Cell parameters: 9.4038; 10.7199; 24.4225; 90; 99.093; 90;  

COD ID: 1508869
CIF file Formula: - C29 H29 N O6 -
Comments: Gorbacheva, Evgenia O.; Tabolin, Andrey A.; Novikov, Roman A.; Khomutova, Yulia A.; Nelyubina, Yulia V.; Tomilov, Yury V.; Ioffe, Sema L. Six-membered cyclic nitronates as 1,3-dipoles in formal [3 + 3]-cycloaddition with donor-acceptor cyclopropanes. Synthesis of new type of bicyclic nitrosoacetals. Organic letters 15(2) (2013) 350-353
Space group: P -1
Cell volume: 2404.2
Cell parameters: 11.3123; 13.5731; 16.6509; 78.645; 73.569; 86.82;  

COD ID: 1508870
CIF file Formula: - C27 H33 N O7 -
Comments: Gorbacheva, Evgenia O.; Tabolin, Andrey A.; Novikov, Roman A.; Khomutova, Yulia A.; Nelyubina, Yulia V.; Tomilov, Yury V.; Ioffe, Sema L. Six-membered cyclic nitronates as 1,3-dipoles in formal [3 + 3]-cycloaddition with donor-acceptor cyclopropanes. Synthesis of new type of bicyclic nitrosoacetals. Organic letters 15(2) (2013) 350-353
Space group: P b c a
Cell volume: 4940.8
Cell parameters: 19.1983; 10.9762; 23.4467; 90; 90; 90;  

COD ID: 1508871
CIF file Formula: - C28 H33 N O7 -
Comments: Gorbacheva, Evgenia O.; Tabolin, Andrey A.; Novikov, Roman A.; Khomutova, Yulia A.; Nelyubina, Yulia V.; Tomilov, Yury V.; Ioffe, Sema L. Six-membered cyclic nitronates as 1,3-dipoles in formal [3 + 3]-cycloaddition with donor-acceptor cyclopropanes. Synthesis of new type of bicyclic nitrosoacetals. Organic letters 15(2) (2013) 350-353
Space group: P -1
Cell volume: 1280.26
Cell parameters: 9.6224; 10.0813; 14.8728; 103.357; 105.497; 103.944;  

COD ID: 1508872
CIF file Formula: - C30 H44 S4 Si4 -
Comments: Wu, Tianjing; Shi, Jianwu; Li, Chunli; Song, Jinsheng; Xu, Li; Wang, Hua Synthesis of Dendrimers Based on Tetrakis(thiophene-2-yl)ethene as New Dendron. Organic letters 15(2) (2013) 354-357
Space group: P 1 21/n 1
Cell volume: 1836.6
Cell parameters: 10.779; 6.217; 27.444; 90; 93; 90;  

COD ID: 1508873
CIF file Formula: - C110 H140 S16 Si12 -
Comments: Wu, Tianjing; Shi, Jianwu; Li, Chunli; Song, Jinsheng; Xu, Li; Wang, Hua Synthesis of Dendrimers Based on Tetrakis(thiophene-2-yl)ethene as New Dendron. Organic letters 15(2) (2013) 354-357
Space group: P -1
Cell volume: 3210
Cell parameters: 12.183; 16.129; 16.62; 100.265; 92.579; 90.124;  

COD ID: 1508874
CIF file Formula: - C27 H22 N2 -
Comments: Chen, Hui; Sanjaya, Stephen; Wang, Yi-Feng; Chiba, Shunsuke Copper-catalyzed aliphatic C-h amination with an amidine moiety. Organic letters 15(1) (2013) 212-215
Space group: P -1
Cell volume: 990.74
Cell parameters: 8.3493; 10.2504; 13.0418; 91.274; 104.819; 112.131;  

COD ID: 1508875
CIF file Formula: - C25 H20 N2 -
Comments: Chen, Hui; Sanjaya, Stephen; Wang, Yi-Feng; Chiba, Shunsuke Copper-catalyzed aliphatic C-h amination with an amidine moiety. Organic letters 15(1) (2013) 212-215
Space group: P 1 21/c 1
Cell volume: 1846.7
Cell parameters: 12.2998; 8.3428; 18.0813; 90; 95.545; 90;  

COD ID: 1508876
CIF file Formula: - C28 H24 Br N O3 S -
Comments: Guo, Qunsheng; Zhao, John Cong-Gui Highly enantioselective three-component direct mannich reactions of unfunctionalized ketones catalyzed by bifunctional organocatalysts. Organic letters 15(3) (2013) 508-511
Space group: P 1 21 1
Cell volume: 2390
Cell parameters: 17.676; 5.727; 23.637; 90; 92.756; 90;  

COD ID: 1508877
CIF file Formula: - C16 H12 N2 O3 -
Comments: Zhu, Yan-Ping; Fei, Zhuan; Liu, Mei-Cai; Jia, Feng-Cheng; Wu, An-Xin Direct One-Pot Synthesis of Luotonin F and Analogues via Rational Logical Design. Organic letters 15(2) (2013) 378-381
Space group: P -1
Cell volume: 660.9
Cell parameters: 6.9631; 9.251; 11.149; 82.052; 85.96; 68.329;  

COD ID: 1508878
CIF file Formula: - C32 H30 O3 Si -
Comments: Kondo, Shin-Ichi; Bie, Yi; Yamamura, Masaki Ratiometric Fluorescence Detection of Anions by Silanediol-based Receptors Bearing Anthryl and Pyrenyl Groups. Organic letters 15(3) (2013) 520-523
Space group: P -1
Cell volume: 1289.9
Cell parameters: 9.688; 10.4402; 12.9565; 89.249; 80.806; 85.661;  

COD ID: 1508879
CIF file Formula: - C62 H70 F12 N7 O14 P2 -
Comments: Yan, Xuzhou; Li, Zhengtao; Wei, Peifa; Huang, Feihe Chemically-Responsive Complexation of A Diquaternary Salt with Bis(m-phenylene)-32-Crown-10 Derivatives and Host Substituent Effect on Complexation Geometry. Organic letters 15(3) (2013) 534-537
Space group: C 1 c 1
Cell volume: 6635
Cell parameters: 11.021; 22.8264; 26.376; 90; 90.593; 90;  

COD ID: 1508880
CIF file Formula: - C69 H78 F12 Fe2 N2 O15 P2 -
Comments: Yan, Xuzhou; Li, Zhengtao; Wei, Peifa; Huang, Feihe Chemically-Responsive Complexation of A Diquaternary Salt with Bis(m-phenylene)-32-Crown-10 Derivatives and Host Substituent Effect on Complexation Geometry. Organic letters 15(3) (2013) 534-537
Space group: P n a 21
Cell volume: 6938.9
Cell parameters: 21.8315; 10.7382; 29.5987; 90; 90; 90;  

COD ID: 1508881
CIF file Formula: - C68 H82 F12 N4 O20 P2 -
Comments: Yan, Xuzhou; Li, Zhengtao; Wei, Peifa; Huang, Feihe Chemically-Responsive Complexation of A Diquaternary Salt with Bis(m-phenylene)-32-Crown-10 Derivatives and Host Substituent Effect on Complexation Geometry. Organic letters 15(3) (2013) 534-537
Space group: C 1 c 1
Cell volume: 7887.5
Cell parameters: 17.9964; 13.7356; 32.6891; 90; 102.548; 90;  

COD ID: 1508882
CIF file Formula: - C24 H19 N O5 S -
Comments: An, Jing; Lu, Liang-Qiu; Yang, Qing-Qing; Wang, Tao; Xiao, Wen-Jing Enantioselective Construction of Oxa- and Aza-Angular Triquinanes through Tandem [4 + 1]/[3 + 2] Cycloaddition of Sulfur Ylides and Nitroolefins. Organic letters 15(3) (2013) 542-545
Space group: P 1
Cell volume: 516.6
Cell parameters: 5.737; 8.686; 10.931; 83.072; 79.957; 75.074;  

COD ID: 1508883
CIF file Formula: - C26 H21 N O5 -
Comments: An, Jing; Lu, Liang-Qiu; Yang, Qing-Qing; Wang, Tao; Xiao, Wen-Jing Enantioselective Construction of Oxa- and Aza-Angular Triquinanes through Tandem [4 + 1]/[3 + 2] Cycloaddition of Sulfur Ylides and Nitroolefins. Organic letters 15(3) (2013) 542-545
Space group: P 1 21/c 1
Cell volume: 2113.56
Cell parameters: 11.1729; 22.3738; 8.8833; 90; 107.866; 90;  

COD ID: 1508884
CIF file Formula: - C16 H17 N O2 S2 -
Comments: Xu, Xiao-Bo; Liu, Jian; Zhang, Jian-Jian; Wang, Ya-Wen; Peng, Yu Nickel-mediated inter- and intramolecular C-s coupling of thiols and thioacetates with aryl iodides at room temperature. Organic letters 15(3) (2013) 550-553
Space group: P b c a
Cell volume: 3282
Cell parameters: 7.861; 9.93; 42.05; 90; 90; 90;  

COD ID: 1508885
CIF file Formula: - C13 H13 N O2 S -
Comments: Xu, Xiao-Bo; Liu, Jian; Zhang, Jian-Jian; Wang, Ya-Wen; Peng, Yu Nickel-mediated inter- and intramolecular C-s coupling of thiols and thioacetates with aryl iodides at room temperature. Organic letters 15(3) (2013) 550-553
Space group: P b c a
Cell volume: 2428
Cell parameters: 8.132; 12.907; 23.129; 90; 90; 90;  

COD ID: 1508886
CIF file Formula: - C24 H32 N4 O4 S -
Comments: Bian, Jianwei; Blakemore, David; Warmus, Joseph S.; Sun, Jianmin; Corbett, Matthew; Rose, Colin R.; Bechle, Bruce M. Diastereoselective Synthesis of β-Heteroaryl syn-α-Methyl-β-Amino Acid Derivatives via a Double Chiral Auxiliary Approach. Organic letters 15(3) (2013) 562-565
Space group: P 1 21 1
Cell volume: 1310.8
Cell parameters: 13.442; 6.2752; 16.172; 90; 106.076; 90;  

COD ID: 1508887
CIF file Formula: - C21 H20 O5 S -
Comments: Reddy Chidipudi, Suresh; Wieczysty, Martin D.; Khan, Imtiaz; Lam, Hon Wai Synthesis of Benzopyrans by Pd(II)- or Ru(II)-Catalyzed C-H Alkenylation of 2-Aryl-3-hydroxy-2-cyclohexenones. Organic letters 15(3) (2013) 570-573
Space group: P -1
Cell volume: 913.25
Cell parameters: 8.1107; 11.3209; 11.3866; 108.914; 101.259; 104.447;  

COD ID: 1508888
CIF file Formula: - C40 H42 O8 -
Comments: Lim, Hee Nam; Parker, Kathlyn A. Total synthesis of kingianin a. Organic letters 15(2) (2013) 398-401
Space group: P 1 21/c 1
Cell volume: 3238.7
Cell parameters: 7.2612; 46.73; 9.8379; 90; 104.021; 90;  

COD ID: 1508889
CIF file Formula: - C54 H62 N2 O4 -
Comments: Masuda, Motoki; Maeda, Chihiro; Yoshioka, Naoki Synthesis of Carbazole-Based Selenaporphyrin via Annulation. Organic letters 15(3) (2013) 578-581
Space group: P -1
Cell volume: 2318.87
Cell parameters: 10.8252; 14.0413; 16.0269; 80.5192; 80.3028; 76.9564;  

COD ID: 1508890
CIF file Formula: - C50 H50 N2 Se2 -
Comments: Masuda, Motoki; Maeda, Chihiro; Yoshioka, Naoki Synthesis of Carbazole-Based Selenaporphyrin via Annulation. Organic letters 15(3) (2013) 578-581
Space group: P -1
Cell volume: 1926.1
Cell parameters: 10.1478; 12.6951; 16.6983; 90.204; 104.566; 111.507;  

COD ID: 1508891
CIF file Formula: - C18 H26 N2 O -
Comments: Huang, Sheng-Dian; Zhang, Yu; Cao, Ming-Ming; Di, Ying-Tong; Tang, Gui-Hua; Peng, Zong-Gen; Jiang, Jian-Dong; He, Hong-Ping; Hao, Xiao-Jiang Myriberine A, a New Alkaloid with an Unprecedented Heteropentacyclic Skeleton from Myrioneuron faberi. Organic letters 15(3) (2013) 590-593
Space group: P 21 21 21
Cell volume: 1540.94
Cell parameters: 6.385; 8.7697; 27.5194; 90; 90; 90;  

COD ID: 1508892
CIF file Formula: - C25 H42 O -
Comments: Chiba, Ryota; Minami, Atsushi; Gomi, Katsuya; Oikawa, Hideaki Identification of Ophiobolin F Synthase by a Genome Mining Approach: A Sesterterpene Synthase from Aspergillus clavatus. Organic letters 15(3) (2013) 594-597
Space group: P 21 21 21
Cell volume: 4440.6
Cell parameters: 6.214; 15.5633; 45.916; 90; 90; 90;  

COD ID: 1508893
CIF file Formula: - C98 H156 F24 N22 Na4 O27 P4 -
Comments: Izzo, Irene; Ianniello, Graziella; De Cola, Chiara; Nardone, Brunello; Erra, Loredana; Vaughan, Gavin; Tedesco, Consiglia; De Riccardis, Francesco Structural effects of proline substitution and metal binding on hexameric cyclic peptoids. Organic letters 15(3) (2013) 598-601
Space group: R 3 :H
Cell volume: 9271
Cell parameters: 16.382; 16.382; 39.89; 90; 90; 120;  

COD ID: 1508894
CIF file Formula: - C30 H54 N6 O12 -
Comments: Izzo, Irene; Ianniello, Graziella; De Cola, Chiara; Nardone, Brunello; Erra, Loredana; Vaughan, Gavin; Tedesco, Consiglia; De Riccardis, Francesco Structural effects of proline substitution and metal binding on hexameric cyclic peptoids. Organic letters 15(3) (2013) 598-601
Space group: P -1
Cell volume: 824.5
Cell parameters: 8.3584; 9.1756; 11.6234; 99.636; 101.488; 104.239;  

COD ID: 1508895
CIF file Formula: - C57 H49 Cl7 Fe N6 O6 -
Comments: Zhou, Zaichun; Liu, Qiuhua; Yan, Ziqiang; Long, Ge; Zhang, Xi; Cao, Chenzhong; Jiang, Rongqing Conversion of Electron Configuration of Iron Ion through Core Contraction of Porphyrin: Implications for Heme Distortion. Organic letters 15(3) (2013) 606-609
Space group: P -1
Cell volume: 2778.6
Cell parameters: 12.29; 14.996; 16.269; 98.514; 106.348; 99.374;  

COD ID: 1508896
CIF file Formula: - C56 H48 Cl Fe N6 O6 -
Comments: Zhou, Zaichun; Liu, Qiuhua; Yan, Ziqiang; Long, Ge; Zhang, Xi; Cao, Chenzhong; Jiang, Rongqing Conversion of Electron Configuration of Iron Ion through Core Contraction of Porphyrin: Implications for Heme Distortion. Organic letters 15(3) (2013) 606-609
Space group: P 1 21/c 1
Cell volume: 5447.4
Cell parameters: 14.527; 30.638; 12.3382; 90; 97.26; 90;  

COD ID: 1508897
CIF file Formula: - C57 H50 Cl Fe N6 O6 -
Comments: Zhou, Zaichun; Liu, Qiuhua; Yan, Ziqiang; Long, Ge; Zhang, Xi; Cao, Chenzhong; Jiang, Rongqing Conversion of Electron Configuration of Iron Ion through Core Contraction of Porphyrin: Implications for Heme Distortion. Organic letters 15(3) (2013) 606-609
Space group: P -1
Cell volume: 5947.9
Cell parameters: 15.923; 16.738; 22.371; 91.302; 93.701; 90.604;  

COD ID: 1508898
CIF file Formula: - C58 H52 Cl Fe N6 O6 -
Comments: Zhou, Zaichun; Liu, Qiuhua; Yan, Ziqiang; Long, Ge; Zhang, Xi; Cao, Chenzhong; Jiang, Rongqing Conversion of Electron Configuration of Iron Ion through Core Contraction of Porphyrin: Implications for Heme Distortion. Organic letters 15(3) (2013) 606-609
Space group: P -1
Cell volume: 3044.2
Cell parameters: 15.749; 15.991; 16.15; 61.74; 63.39; 62.81;  

COD ID: 1508899
CIF file Formula: - C59 H54 Cl Fe N6 O6 -
Comments: Zhou, Zaichun; Liu, Qiuhua; Yan, Ziqiang; Long, Ge; Zhang, Xi; Cao, Chenzhong; Jiang, Rongqing Conversion of Electron Configuration of Iron Ion through Core Contraction of Porphyrin: Implications for Heme Distortion. Organic letters 15(3) (2013) 606-609
Space group: P -1
Cell volume: 3194.3
Cell parameters: 14.0827; 16.3185; 16.6591; 62.671; 75; 71.377;  

COD ID: 1508900
CIF file Formula: - C60 H56 Cl Fe N6 O6 -
Comments: Zhou, Zaichun; Liu, Qiuhua; Yan, Ziqiang; Long, Ge; Zhang, Xi; Cao, Chenzhong; Jiang, Rongqing Conversion of Electron Configuration of Iron Ion through Core Contraction of Porphyrin: Implications for Heme Distortion. Organic letters 15(3) (2013) 606-609
Space group: P -1
Cell volume: 3051.7
Cell parameters: 15.2; 16.065; 16.305; 115.096; 116.65; 94.005;  

COD ID: 1508901
CIF file Formula: - C15 H14 N2 O2 -
Comments: Tran, Tuan P.; Mullins, Patrick B.; Am Ende, Christopher W.; Pettersson, Martin Synthesis of Pyridopyrazine-1,6-diones from 6-Hydroxypicolinic Acids via a One-Pot Coupling/Cyclization Reaction. Organic letters 15(3) (2013) 642-645
Space group: P 1 21/c 1
Cell volume: 1246.6
Cell parameters: 13.2153; 7.6831; 12.8817; 90; 107.622; 90;  

COD ID: 1508902
CIF file Formula: - C12 H10 N4 O -
Comments: Tran, Tuan P.; Mullins, Patrick B.; Am Ende, Christopher W.; Pettersson, Martin Synthesis of Pyridopyrazine-1,6-diones from 6-Hydroxypicolinic Acids via a One-Pot Coupling/Cyclization Reaction. Organic letters 15(3) (2013) 642-645
Space group: P b c a
Cell volume: 2268.75
Cell parameters: 7.5741; 13.7438; 21.7946; 90; 90; 90;  

COD ID: 1508903
CIF file Formula: - C16 H15 Br N2 O2 -
Comments: Tran, Tuan P.; Mullins, Patrick B.; Am Ende, Christopher W.; Pettersson, Martin Synthesis of Pyridopyrazine-1,6-diones from 6-Hydroxypicolinic Acids via a One-Pot Coupling/Cyclization Reaction. Organic letters 15(3) (2013) 642-645
Space group: P 1 21/c 1
Cell volume: 1450.79
Cell parameters: 15.8197; 12.6493; 7.2819; 90; 95.363; 90;  

COD ID: 1508904
CIF file Formula: - C32 H31 N O7 -
Comments: Kim, U. Bin; Furkert, Daniel P.; Brimble, Margaret A. Total synthesis of chaetoquadrins a-C. Organic letters 15(3) (2013) 658-661
Space group: P 43
Cell volume: 2731.17
Cell parameters: 10.3793; 10.3793; 25.352; 90; 90; 90;  

COD ID: 1508905
CIF file Formula: - C16 H20 N2 Se Si2 -
Comments: Lindner, Benjamin D.; Coombs, Benjamin A.; Schaffroth, Manuel; Engelhart, Jens U.; Tverskoy, Olena; Rominger, Frank; Hamburger, Manuel; Bunz, Uwe H. F. From thia- to selenadiazoles: changing interaction priority. Organic letters 15(3) (2013) 666-669
Space group: P 1 21/n 1
Cell volume: 1975.1
Cell parameters: 10.8314; 15.999; 12.6094; 90; 115.323; 90;  

COD ID: 1508906
CIF file Formula: - C26 H34 N2 Se Si2 -
Comments: Lindner, Benjamin D.; Coombs, Benjamin A.; Schaffroth, Manuel; Engelhart, Jens U.; Tverskoy, Olena; Rominger, Frank; Hamburger, Manuel; Bunz, Uwe H. F. From thia- to selenadiazoles: changing interaction priority. Organic letters 15(3) (2013) 666-669
Space group: P 1 21/n 1
Cell volume: 2624.5
Cell parameters: 10.4163; 17.0453; 15.4541; 90; 106.965; 90;  

COD ID: 1508907
CIF file Formula: - C28 H44 N2 Se Si2 -
Comments: Lindner, Benjamin D.; Coombs, Benjamin A.; Schaffroth, Manuel; Engelhart, Jens U.; Tverskoy, Olena; Rominger, Frank; Hamburger, Manuel; Bunz, Uwe H. F. From thia- to selenadiazoles: changing interaction priority. Organic letters 15(3) (2013) 666-669
Space group: P 1 21/n 1
Cell volume: 3190.9
Cell parameters: 14.751; 14.938; 15.035; 90; 105.604; 90;  

COD ID: 1508908
CIF file Formula: - C32 H46 N2 Se Si2 -
Comments: Lindner, Benjamin D.; Coombs, Benjamin A.; Schaffroth, Manuel; Engelhart, Jens U.; Tverskoy, Olena; Rominger, Frank; Hamburger, Manuel; Bunz, Uwe H. F. From thia- to selenadiazoles: changing interaction priority. Organic letters 15(3) (2013) 666-669
Space group: P 1 21/n 1
Cell volume: 6791.6
Cell parameters: 14.8139; 15.1816; 30.2664; 90; 93.844; 90;  

COD ID: 1508909
CIF file Formula: - C36 H48 N2 Se Si2 -
Comments: Lindner, Benjamin D.; Coombs, Benjamin A.; Schaffroth, Manuel; Engelhart, Jens U.; Tverskoy, Olena; Rominger, Frank; Hamburger, Manuel; Bunz, Uwe H. F. From thia- to selenadiazoles: changing interaction priority. Organic letters 15(3) (2013) 666-669
Space group: P -1
Cell volume: 1774.5
Cell parameters: 8.1957; 13.139; 17.152; 78.547; 81.601; 80.832;  

COD ID: 1508910
CIF file Formula: - C34 H46 N4 Se Si2 -
Comments: Lindner, Benjamin D.; Coombs, Benjamin A.; Schaffroth, Manuel; Engelhart, Jens U.; Tverskoy, Olena; Rominger, Frank; Hamburger, Manuel; Bunz, Uwe H. F. From thia- to selenadiazoles: changing interaction priority. Organic letters 15(3) (2013) 666-669
Space group: P -1
Cell volume: 1765.88
Cell parameters: 9.0805; 12.4223; 16.7125; 71.73; 83.493; 81.475;  

COD ID: 1508911
CIF file Formula: - C36 H48 N2 S Si2 -
Comments: Lindner, Benjamin D.; Coombs, Benjamin A.; Schaffroth, Manuel; Engelhart, Jens U.; Tverskoy, Olena; Rominger, Frank; Hamburger, Manuel; Bunz, Uwe H. F. From thia- to selenadiazoles: changing interaction priority. Organic letters 15(3) (2013) 666-669
Space group: P -1
Cell volume: 1775.8
Cell parameters: 8.2003; 13.1453; 17.1892; 78.043; 81.532; 80.552;  

COD ID: 1508912
CIF file Formula: - C22 H17 N3 O6 -
Comments: Shu, Wen-Ming; Yang, Yan; Zhang, Dong-Xue; Wu, Liu-Ming; Zhu, Yan-Ping; Yin, Guo-Dong; Wu, An-Xin Highly Efficient Synthesis of 3a,6a-Dihydrofuro[2,3-b]furans via a Novel Bicyclization. Organic letters 15(3) (2013) 456-459
Space group: P 1 21/n 1
Cell volume: 1977.1
Cell parameters: 10.9383; 9.6552; 19.32; 90; 104.308; 90;  

COD ID: 1508913
CIF file Formula: - C22 H17 Br N2 O4 -
Comments: Shu, Wen-Ming; Yang, Yan; Zhang, Dong-Xue; Wu, Liu-Ming; Zhu, Yan-Ping; Yin, Guo-Dong; Wu, An-Xin Highly Efficient Synthesis of 3a,6a-Dihydrofuro[2,3-b]furans via a Novel Bicyclization. Organic letters 15(3) (2013) 456-459
Space group: P 1 21/n 1
Cell volume: 1956.8
Cell parameters: 10.877; 9.556; 19.596; 90; 106.11; 90;  

COD ID: 1508914
CIF file Formula: - C22 H16 N2 O4 -
Comments: Shu, Wen-Ming; Yang, Yan; Zhang, Dong-Xue; Wu, Liu-Ming; Zhu, Yan-Ping; Yin, Guo-Dong; Wu, An-Xin Highly Efficient Synthesis of 3a,6a-Dihydrofuro[2,3-b]furans via a Novel Bicyclization. Organic letters 15(3) (2013) 456-459
Space group: P 1 21/n 1
Cell volume: 1871.2
Cell parameters: 10.8804; 5.4346; 31.653; 90; 91.258; 90;  

COD ID: 1508915
CIF file Formula: - C38 H44 N2 O8 S -
Comments: Rajapaksa, Naomi S.; McGowan, Meredeth A.; Rienzo, Matthew; Jacobsen, Eric N. Enantioselective total synthesis of (+)-reserpine. Organic letters 15(3) (2013) 706-709
Space group: P 1
Cell volume: 1707.4
Cell parameters: 10.54; 13.2962; 13.7619; 71.577; 89.697; 69.957;  

COD ID: 1508916
CIF file Formula: - C18 H18 Cu N6 S2 -
Comments: Palanimuthu, Duraippandi; Shinde, Sridevi Vijay; Somasundaram, Kumaravel; Samuelson, Ashoka G. In Vitro and in Vivo Anticancer Activity of Copper Bis(thiosemicarbazone) Complexes. Journal of medicinal chemistry 56(3) (2013) 722-734
Space group: P b c n
Cell volume: 1897.4
Cell parameters: 31.372; 7.5677; 7.9918; 90; 90; 90;  

COD ID: 1508917
CIF file Formula: - C49 H54 Cl2 Cu2 N12 S4 -
Comments: Palanimuthu, Duraippandi; Shinde, Sridevi Vijay; Somasundaram, Kumaravel; Samuelson, Ashoka G. In Vitro and in Vivo Anticancer Activity of Copper Bis(thiosemicarbazone) Complexes. Journal of medicinal chemistry 56(3) (2013) 722-734
Space group: P 1 21/c 1
Cell volume: 5201.5
Cell parameters: 15.1825; 11.7338; 29.6982; 90; 100.534; 90;  

COD ID: 1508918
CIF file Formula: - C14 H24 Cu N6 S2 -
Comments: Palanimuthu, Duraippandi; Shinde, Sridevi Vijay; Somasundaram, Kumaravel; Samuelson, Ashoka G. In Vitro and in Vivo Anticancer Activity of Copper Bis(thiosemicarbazone) Complexes. Journal of medicinal chemistry 56(3) (2013) 722-734
Space group: P -1
Cell volume: 1733.6
Cell parameters: 7.58; 12.83; 18.298; 98.489; 99.605; 91.102;  

COD ID: 1508919
CIF file Formula: - C49 H37 N2 O5 -
Comments: Cheriya, Rijo T.; Nagarajan, Kalaivanan; Hariharan, Mahesh Single-Component Organic Light-Harvesting Red Luminescent Crystal The Journal of Physical Chemistry C 117(7) (2013) 3240
Space group: P -1
Cell volume: 1962.16
Cell parameters: 10.4825; 12.3742; 16.3558; 83.7391; 86.7693; 68.5231;  

COD ID: 1508920
CIF file Formula: - C28 H24 N2 O4 -
Comments: Wei, Ruirui; Song, Panshu; Tong, Aijun Reversible Thermochromism of Aggregation-Induced Emission-Active Benzophenone Azine Based on Polymorph-Dependent Excited-State Intramolecular Proton Transfer Fluorescence The Journal of Physical Chemistry C 117(7) (2013) 3467
Space group: P 1 21/c 1
Cell volume: 2376.3
Cell parameters: 11.125; 21.323; 10.4804; 90; 107.093; 90;  

COD ID: 1508921
CIF file Formula: - C28 H24 N2 O4 -
Comments: Wei, Ruirui; Song, Panshu; Tong, Aijun Reversible Thermochromism of Aggregation-Induced Emission-Active Benzophenone Azine Based on Polymorph-Dependent Excited-State Intramolecular Proton Transfer Fluorescence The Journal of Physical Chemistry C 117(7) (2013) 3467
Space group: C 1 2/c 1
Cell volume: 4687.1
Cell parameters: 19.228; 12.902; 21.509; 90; 118.55; 90;  

COD ID: 1508922
CIF file Formula: - C74 H72 Cl N O2 P4 W -
Comments: Moravec, Davis B.; Hopkins, Michael D. FRET Sensitization of Tungsten-Alkylidyne Complexes by Zinc Porphyrins in Self-Assembled Dyads. The journal of physical chemistry. A 117(8) (2013) 1744-1755
Space group: P -1
Cell volume: 3063
Cell parameters: 9.887; 12.071; 26.395; 90.302; 92.637; 103.19;  

COD ID: 1508923
CIF file Formula: - C10 H14 O3 -
Comments: Kumar, Manjeet; Qadri, Masroor; Sharma, Parduman Raj; Kumar, Arvind; Andotra, Samar S.; Kaur, Tandeep; Kapoor, Kamini; Gupta, Vivek K.; Kant, Rajni; Hamid, Abid; Johri, Sarojini; Taneja, Subhash C.; Vishwakarma, Ram A.; Riyaz-Ul-Hassan, Syed; Shah, Bhahwal Ali Tubulin Inhibitors from an Endophytic Fungus Isolated from Cedrus deodara. Journal of natural products 76(2) (2013) 194-199
Space group: P 1 21 1
Cell volume: 472.26
Cell parameters: 7.9356; 7.1221; 8.5697; 90; 102.824; 90;  

COD ID: 1508924
CIF file Formula: - C9 H14 O2 -
Comments: Kumar, Manjeet; Qadri, Masroor; Sharma, Parduman Raj; Kumar, Arvind; Andotra, Samar S.; Kaur, Tandeep; Kapoor, Kamini; Gupta, Vivek K.; Kant, Rajni; Hamid, Abid; Johri, Sarojini; Taneja, Subhash C.; Vishwakarma, Ram A.; Riyaz-Ul-Hassan, Syed; Shah, Bhahwal Ali Tubulin Inhibitors from an Endophytic Fungus Isolated from Cedrus deodara. Journal of natural products 76(2) (2013) 194-199
Space group: P 21 21 21
Cell volume: 833.72
Cell parameters: 7.3937; 10.5911; 10.6467; 90; 90; 90;  

COD ID: 1508925
CIF file Formula: - C22 H30 O6 S -
Comments: Saha, Mrinmoy; Carter, Rich G. Toward a unified approach for the lycopodines: synthesis of 10-hydroxylycopodine, deacetylpaniculine, and paniculine. Organic letters 15(4) (2013) 736-739
Space group: P 21 21 21
Cell volume: 2117.7
Cell parameters: 8.4382; 10.6416; 23.583; 90; 90; 90;  

COD ID: 1508926
CIF file Formula: - C19 H24 O5 S -
Comments: Saha, Mrinmoy; Carter, Rich G. Toward a unified approach for the lycopodines: synthesis of 10-hydroxylycopodine, deacetylpaniculine, and paniculine. Organic letters 15(4) (2013) 736-739
Space group: P 21 21 21
Cell volume: 1718.4
Cell parameters: 8.0743; 10.233; 20.798; 90; 90; 90;  

COD ID: 1508927
CIF file Formula: - C19 H26 O6 S -
Comments: Saha, Mrinmoy; Carter, Rich G. Toward a unified approach for the lycopodines: synthesis of 10-hydroxylycopodine, deacetylpaniculine, and paniculine. Organic letters 15(4) (2013) 736-739
Space group: P 21 21 21
Cell volume: 1794.9
Cell parameters: 8.0553; 10.1921; 21.862; 90; 90; 90;  

COD ID: 1508928
CIF file Formula: - C32 H28 N4 O8 -
Comments: Bhattacharya, Suman; Stojaković, Jelena; Saha, Binoy K.; Macgillivray, Leonard R. A product of a templated solid-state photodimerization acts as a template: single-crystal reactivity in a single polymorph of a cocrystal. Organic letters 15(4) (2013) 744-747
Space group: P 1 21/c 1
Cell volume: 1396.69
Cell parameters: 7.0625; 10.8486; 18.2963; 90; 94.908; 90;  

COD ID: 1508929
CIF file Formula: - C32 H28 N4 O8 -
Comments: Bhattacharya, Suman; Stojaković, Jelena; Saha, Binoy K.; Macgillivray, Leonard R. A product of a templated solid-state photodimerization acts as a template: single-crystal reactivity in a single polymorph of a cocrystal. Organic letters 15(4) (2013) 744-747
Space group: P -1
Cell volume: 1355.82
Cell parameters: 7.3377; 11.3673; 18.0101; 74.38; 90.072; 70.386;  

COD ID: 1508930
CIF file Formula: - C32 H28 N4 O8 -
Comments: Bhattacharya, Suman; Stojaković, Jelena; Saha, Binoy K.; Macgillivray, Leonard R. A product of a templated solid-state photodimerization acts as a template: single-crystal reactivity in a single polymorph of a cocrystal. Organic letters 15(4) (2013) 744-747
Space group: P -1
Cell volume: 1384.9
Cell parameters: 9.131; 11.006; 15.272; 99.5; 98.7; 110.13;  

COD ID: 1508931
CIF file Formula: - C21 H13 Cl4 N2 O3 -
Comments: Alvarez-Mico, Xavier; Jensen, Paul R.; Fenical, William; Hughes, Chambers C. Chlorizidine, a Cytotoxic 5H-Pyrrolo[2,1-a]isoindol-5-one-Containing Alkaloid from a Marine Streptomyces sp. Organic letters 15(5) (2013) 988-991
Space group: C 1 2 1
Cell volume: 2054.25
Cell parameters: 26.5331; 8.0048; 9.7571; 90; 97.575; 90;  

COD ID: 1508932
CIF file Formula: - C22 H14 Cl4 N2 O5 -
Comments: Alvarez-Mico, Xavier; Jensen, Paul R.; Fenical, William; Hughes, Chambers C. Chlorizidine, a Cytotoxic 5H-Pyrrolo[2,1-a]isoindol-5-one-Containing Alkaloid from a Marine Streptomyces sp. Organic letters 15(5) (2013) 988-991
Space group: P 1
Cell volume: 1088.06
Cell parameters: 7.649; 11.8911; 12.6157; 105.779; 98.658; 92.067;  

COD ID: 1508933
CIF file Formula: - C9 H12 N2 O4 -
Comments: Orimoto, Kohei; Oyama, Harufumi; Namera, Yuki; Niwa, Takashi; Nakada, Masahisa Catalytic Asymmetric [4 + 2] Cycloadditions and Hosomi-Sakurai Reactions of α-Alkylidene β-Keto Imides. Organic letters 15(4) (2013) 768-771
Space group: P 1 21/c 1
Cell volume: 985.87
Cell parameters: 7.7215; 7.90305; 16.5104; 90; 101.898; 90;  

COD ID: 1508934
CIF file Formula: - C18 H15 N O2 -
Comments: Liu, Xu; Zhang, Qian; Zhang, Dingyuan; Xin, Xiaoqing; Zhang, Rui; Zhou, Fenguo; Dong, Dewen PPA-Mediated C-C Bond Formation: A Synthetic Route to Substituted Indeno[2,1-c]quinolin-6(7H)-ones. Organic letters 15(4) (2013) 776-779
Space group: P 1 21/c 1
Cell volume: 2770.1
Cell parameters: 16.6508; 12.0775; 14.6164; 90; 109.539; 90;  

COD ID: 1508935
CIF file Formula: - C28 H34 O10 S -
Comments: Chooi, Yit-Heng; Fang, Jinxu; Liu, Hong; Filler, Scott G.; Wang, Pin; Tang, Yi Genome Mining of a Prenylated and Immunosuppressive Polyketide from Pathogenic Fungi. Organic letters 15(4) (2013) 780-783
Space group: P 1 21 1
Cell volume: 1372.8
Cell parameters: 5.3516; 19.434; 13.261; 90; 95.518; 90;  

COD ID: 1508936
CIF file Formula: - C32 H34 O7 -
Comments: Liu, Ming-Li; Duan, Ying-Hui; Hou, Yun-Long; Li, Chang; Gao, Hao; Dai, Yi; Yao, Xin-Sheng Nardoaristolones A and B, Two Terpenoids with Unusual Skeletons from Nardostachys chinensis Batal. Organic letters 15(5) (2013) 1000-1003
Space group: P 21 21 21
Cell volume: 2734.24
Cell parameters: 11.84571; 13.0433; 17.6965; 90; 90; 90;  

COD ID: 1508937
CIF file Formula: - C14 H18 O2 -
Comments: Liu, Ming-Li; Duan, Ying-Hui; Hou, Yun-Long; Li, Chang; Gao, Hao; Dai, Yi; Yao, Xin-Sheng Nardoaristolones A and B, Two Terpenoids with Unusual Skeletons from Nardostachys chinensis Batal. Organic letters 15(5) (2013) 1000-1003
Space group: P 21 21 21
Cell volume: 1214.35
Cell parameters: 8.06899; 9.64395; 15.6052; 90; 90; 90;  

COD ID: 1508938
CIF file Formula: - C20 H23 O3 P -
Comments: Sawada, Takashi; Nakada, Masahisa Enantioselective Total Synthesis of (+)-Colletoic Acid via Catalytic Asymmetric Intramolecular Cyclopropanation of an α-Diazo-β-keto Diphenylphosphine Oxide. Organic letters 15(5) (2013) 1004-1007
Space group: P 21 21 21
Cell volume: 1783.83
Cell parameters: 8.10822; 13.8133; 15.9269; 90; 90; 90;  

COD ID: 1508939
CIF file Formula: - C17 H36 N2 O2 S Si -
Comments: Cornwall, Richard G.; Zhao, Baoguo; Shi, Yian Catalytic asymmetric synthesis of cyclic sulfamides from conjugated dienes. Organic letters 15(4) (2013) 796-799
Space group: P 21 21 21
Cell volume: 2208.1
Cell parameters: 10.963; 11.569; 17.41; 90; 90; 90;  

COD ID: 1508940
CIF file Formula: - C19 H12 Br2 O2 -
Comments: Zöphel, Lukas; Enkelmann, Volker; Müllen, Klaus Tuning the HOMO-LUMO Gap of Pyrene Effectively via Donor-Acceptor Substitution: Positions 4,5 Versus 9,10. Organic letters 15(4) (2013) 804-807
Space group: P -1
Cell volume: 745.58
Cell parameters: 7.0896; 9.732; 11.0373; 99.588; 91.694; 96.224;  

COD ID: 1508941
CIF file Formula: - C20 H12 N2 O2 -
Comments: Zöphel, Lukas; Enkelmann, Volker; Müllen, Klaus Tuning the HOMO-LUMO Gap of Pyrene Effectively via Donor-Acceptor Substitution: Positions 4,5 Versus 9,10. Organic letters 15(4) (2013) 804-807
Space group: P -1
Cell volume: 721.27
Cell parameters: 7.0844; 10.1531; 10.6861; 105.788; 98.355; 96.968;  

COD ID: 1508942
CIF file Formula: - C21 H12 N2 O2 -
Comments: Zöphel, Lukas; Enkelmann, Volker; Müllen, Klaus Tuning the HOMO-LUMO Gap of Pyrene Effectively via Donor-Acceptor Substitution: Positions 4,5 Versus 9,10. Organic letters 15(4) (2013) 804-807
Space group: P m c n
Cell volume: 1501.9
Cell parameters: 6.8305; 11.0589; 19.8828; 90; 90; 90;  

COD ID: 1508943
CIF file Formula: - C10 H9 O2 -
Comments: Zöphel, Lukas; Enkelmann, Volker; Müllen, Klaus Tuning the HOMO-LUMO Gap of Pyrene Effectively via Donor-Acceptor Substitution: Positions 4,5 Versus 9,10. Organic letters 15(4) (2013) 804-807
Space group: C 1 2/c 1
Cell volume: 1560.1
Cell parameters: 15.5468; 10.7779; 10.234; 90; 114.524; 90;  

COD ID: 1508944
CIF file Formula: - C22 H18 O4 -
Comments: Zöphel, Lukas; Enkelmann, Volker; Müllen, Klaus Tuning the HOMO-LUMO Gap of Pyrene Effectively via Donor-Acceptor Substitution: Positions 4,5 Versus 9,10. Organic letters 15(4) (2013) 804-807
Space group: P 1 21/a 1
Cell volume: 820.46
Cell parameters: 11.3553; 7.1744; 11.5613; 90; 119.414; 90;  

COD ID: 1508945
CIF file Formula: - C28 H22 N4 -
Comments: Zöphel, Lukas; Enkelmann, Volker; Müllen, Klaus Tuning the HOMO-LUMO Gap of Pyrene Effectively via Donor-Acceptor Substitution: Positions 4,5 Versus 9,10. Organic letters 15(4) (2013) 804-807
Space group: P 1 21/n 1
Cell volume: 1117.55
Cell parameters: 9.0368; 9.2187; 13.518; 90; 97.088; 90;  

COD ID: 1508946
CIF file Formula: - C37 H25 N3 O -
Comments: Ghosh, Avijit; Chatterjee, Tamal; Lee, Way-Zen; Ravikanth, Mangalampalli Unusual formation of 21-oxacorrole from 21-oxaporphyrin induced by phosphoryl chloride. Organic letters 15(5) (2013) 1040-1043
Space group: P 1 21/c 1
Cell volume: 2697.6
Cell parameters: 17.131; 10.7442; 14.687; 90; 93.702; 90;  

COD ID: 1508947
CIF file Formula: - C19 H16 Cl N O3 -
Comments: Wei, Ying; Lin, Shaoxia; Liang, Fushun; Zhang, Jingping N-Bromosuccinimide/1,8-Diazabicyclo[5.4.1]undec-7-ene Combination: β-Amination of Chalcones via a Tandem Bromoamination/Debromination Sequence. Organic letters 15(4) (2013) 852-855
Space group: P 1 21/c 1
Cell volume: 1637.77
Cell parameters: 10.25; 10.486; 16.7877; 90; 114.815; 90;  

COD ID: 1508948
CIF file Formula: - C19 H19 N O -
Comments: Nakai, Kenichiro; Kurahashi, Takuya; Matsubara, Seijiro Synthesis of Quinolones by Nickel-Catalyzed Cycloaddition via Elimination of Nitrile. Organic letters 15(4) (2013) 856-859
Space group: P 1 21/c 1
Cell volume: 1557.8
Cell parameters: 8.8897; 17.783; 10.6532; 90; 112.329; 90;  

COD ID: 1508949
CIF file Formula: - C20 H21 N O -
Comments: Nakai, Kenichiro; Kurahashi, Takuya; Matsubara, Seijiro Synthesis of Quinolones by Nickel-Catalyzed Cycloaddition via Elimination of Nitrile. Organic letters 15(4) (2013) 856-859
Space group: P 1 21/n 1
Cell volume: 1574.6
Cell parameters: 10.1765; 16.6581; 10.2059; 90; 114.481; 90;  

COD ID: 1508950
CIF file Formula: - C27 H19 N O -
Comments: Nakai, Kenichiro; Kurahashi, Takuya; Matsubara, Seijiro Synthesis of Quinolones by Nickel-Catalyzed Cycloaddition via Elimination of Nitrile. Organic letters 15(4) (2013) 856-859
Space group: P -1
Cell volume: 1000.6
Cell parameters: 9.459; 10.483; 11.488; 94.23; 97.208; 116.495;  

COD ID: 1508951
CIF file Formula: - C22 H16 F4 N2 O2 -
Comments: Yu, Daohong; Lu, Long; Shen, Qilong Palladium-Catalyzed Coupling of Polyfluorinated Arenes with Heteroarenes via C-F/C-H Activation. Organic letters 15(4) (2013) 940-943
Space group: P -1
Cell volume: 982.56
Cell parameters: 10.1388; 10.3543; 10.8675; 98.858; 115.501; 99.511;  

COD ID: 1508952
CIF file Formula: - C18 H10 F2 N2 O -
Comments: Yu, Daohong; Lu, Long; Shen, Qilong Palladium-Catalyzed Coupling of Polyfluorinated Arenes with Heteroarenes via C-F/C-H Activation. Organic letters 15(4) (2013) 940-943
Space group: P -1
Cell volume: 708.66
Cell parameters: 7.9035; 9.5259; 10.3445; 103.883; 105.781; 98.414;  

COD ID: 1508953
CIF file Formula: - C20 H26 N2 O2 -
Comments: Liu, Yuchen; Zhen, Wencui; Dai, Wei; Wang, Fen; Li, Xingwei Silver(I)-catalyzed addition-cyclization of alkyne-functionalized azomethines. Organic letters 15(4) (2013) 874-877
Space group: P 1 21/c 1
Cell volume: 1864.3
Cell parameters: 13.5018; 16.1917; 8.5746; 90; 96.006; 90;  

COD ID: 1508954
CIF file Formula: - C17 H22 N2 O2 -
Comments: Liu, Yuchen; Zhen, Wencui; Dai, Wei; Wang, Fen; Li, Xingwei Silver(I)-catalyzed addition-cyclization of alkyne-functionalized azomethines. Organic letters 15(4) (2013) 874-877
Space group: P 1 21/n 1
Cell volume: 1554.11
Cell parameters: 11.0475; 8.7287; 16.2757; 90; 98.023; 90;  

COD ID: 1508955
CIF file Formula: - C25 H28 N2 O8 -
Comments: Yang, Shouliang; Xi, Yumeng; Zhu, Rong; Wang, Lin; Chen, Jiahua; Yang, Zhen Asymmetric Total Syntheses of Ansamacrolactams (+)-Q-1047H-A-A and (+)-Q-1047H-R-A. Organic letters 15(4) (2013) 812-815
Space group: P 21 21 21
Cell volume: 2491.9
Cell parameters: 8.0877; 8.3009; 37.117; 90; 90; 90;  

COD ID: 1508956
CIF file Formula: - C12 H9 N O4 -
Comments: Tsui, Gavin Chit; Ninnemann, Nina M.; Hosotani, Akihito; Lautens, Mark Expedient Synthesis of Chiral Oxazolidinone Scaffolds via Rhodium-Catalyzed Asymmetric Ring-Opening with Sodium Cyanate. Organic letters 15(5) (2013) 1064-1067
Space group: P 21 21 21
Cell volume: 1972.43
Cell parameters: 7.2756; 14.0819; 19.2518; 90; 90; 90;  

COD ID: 1508957
CIF file Formula: - C13 H14 Cl Hg N O3 -
Comments: Atta, Ananta Kumar; Kim, Seul-Bi; Heo, Jungseok; Cho, Dong-Gyu Hg(II)-Mediated Intramolecular Cyclization Reaction in Aqueous Media and Its Application as Hg(II) Selective Indicator. Organic letters 15(5) (2013) 1072-1075
Space group: P -1
Cell volume: 1452.69
Cell parameters: 6.9888; 10.8795; 19.1331; 92.887; 91.033; 90.132;  

COD ID: 1508958
CIF file Formula: - C26 H24 N O2 P S -
Comments: Matano, Yoshihiro; Ohkubo, Hiroshi; Honsho, Yoshihito; Saito, Arihiro; Seki, Shu; Imahori, Hiroshi Synthesis and Charge-Carrier Transport Properties of Poly(phosphole P-alkanesulfonylimide)s. Organic letters 15(4) (2013) 932-935
Space group: P b c a
Cell volume: 4359
Cell parameters: 11.06; 18.268; 21.576; 90; 90; 90;  

COD ID: 1508959
CIF file Formula: - C18 H18 N2 O2 S -
Comments: Kong, Chen; Jana, Navendu; Driver, Tom G. Rh(2)(II)-Catalyzed Selective Aminomethylene Migration from Styryl Azides. Organic letters 15(4) (2013) 824-827
Space group: C 1 2/c 1
Cell volume: 3244.1
Cell parameters: 23.455; 8.3832; 17.46; 90; 109.101; 90;  

COD ID: 1508960
CIF file Formula: - C17 H13 F6 N3 S -
Comments: Liu, Gang; Pu, Shouzhi; Wang, Renjie Photochromism of asymmetrical diarylethenes with a pyrrole unit: effects of aromatic stabilization energies of aryl rings. Organic letters 15(5) (2013) 980-983
Space group: P 1 21/c 1
Cell volume: 1776.1
Cell parameters: 15.8095; 13.1111; 8.6534; 90; 98.017; 90;  

COD ID: 1508961
CIF file Formula: - C18 H14 F6 N2 S -
Comments: Liu, Gang; Pu, Shouzhi; Wang, Renjie Photochromism of asymmetrical diarylethenes with a pyrrole unit: effects of aromatic stabilization energies of aryl rings. Organic letters 15(5) (2013) 980-983
Space group: P 1 21/c 1
Cell volume: 1858.4
Cell parameters: 16.432; 13.0362; 8.6933; 90; 93.67; 90;  

COD ID: 1508962
CIF file Formula: - C19 H14 F6 N2 -
Comments: Liu, Gang; Pu, Shouzhi; Wang, Renjie Photochromism of asymmetrical diarylethenes with a pyrrole unit: effects of aromatic stabilization energies of aryl rings. Organic letters 15(5) (2013) 980-983
Space group: P 1 21/c 1
Cell volume: 1808.4
Cell parameters: 16.571; 13.208; 8.2626; 90; 90.383; 90;  

COD ID: 1508963
CIF file Formula: - C18 H13 F6 N3 -
Comments: Liu, Gang; Pu, Shouzhi; Wang, Renjie Photochromism of asymmetrical diarylethenes with a pyrrole unit: effects of aromatic stabilization energies of aryl rings. Organic letters 15(5) (2013) 980-983
Space group: P 1 21/c 1
Cell volume: 1703.03
Cell parameters: 8.0432; 16.9675; 12.9693; 90; 105.807; 90;  

COD ID: 1508964
CIF file Formula: - C25 H24 O4 -
Comments: Zhang, Shan-Jun; Zhang, Jun; Zhou, Qing-Qing; Dong, Lin; Chen, Ying-Chun Aminocatalytic Asymmetric exo-Diels-Alder Reaction with Methiodide Salts of Mannich Bases and 2,4-Dienals to Construct Chiral Spirocycles. Organic letters 15(4) (2013) 968-971
Space group: P 1 21 1
Cell volume: 1010.26
Cell parameters: 8.4742; 11.5299; 10.6213; 90; 103.223; 90;  

COD ID: 1508965
CIF file Formula: - C17 H19 Br N2 O3 S -
Comments: Gu, Peiming; Sun, Jian; Kang, Xiao-Yan; Yi, Ming; Li, Xue-Qiang; Xue, Ping; Li, Rui A Formal Metal-Free N-Arylation via the Schmidt Reaction of Aromatic Aldehydes with an Azido Amine. Organic letters 15(5) (2013) 1124-1127
Space group: P 1 21/a 1
Cell volume: 1758.4
Cell parameters: 16.0215; 5.7478; 19.227; 90; 96.725; 90;  

COD ID: 1508966
CIF file Formula: - C29 H55 Cl Ir N3 P2 -
Comments: Guo, Le; Liu, Yinghua; Yao, Wubing; Leng, Xuebing; Huang, Zheng Iridium-Catalyzed Selective α-Alkylation of Unactivated Amides with Primary Alcohols. Organic letters 15(5) (2013) 1144-1147
Space group: P -1
Cell volume: 3679.6
Cell parameters: 12.2865; 14.517; 21.752; 81.286; 73.769; 89.591;  

COD ID: 1508967
CIF file Formula: - C29 H54 Ir N3 P2 -
Comments: Guo, Le; Liu, Yinghua; Yao, Wubing; Leng, Xuebing; Huang, Zheng Iridium-Catalyzed Selective α-Alkylation of Unactivated Amides with Primary Alcohols. Organic letters 15(5) (2013) 1144-1147
Space group: P -1
Cell volume: 1517.1
Cell parameters: 8.0462; 10.9096; 18.613; 83.081; 79.417; 71.196;  

COD ID: 1508968
CIF file Formula: - C16 H15 Br O2 -
Comments: Keilitz, Juliane; Newman, Stephen G.; Lautens, Mark Enantioselective rh-catalyzed domino transformations of alkynylcyclohexadienones with organoboron reagents. Organic letters 15(5) (2013) 1148-1151
Space group: P 21 21 21
Cell volume: 1354.5
Cell parameters: 7.3452; 9.9405; 18.551; 90; 90; 90;  

COD ID: 1511776
CIF file Formula: - C21 H22 N2 O4 -
Comments: Meylemans, Heather A.; Harvey, Benjamin G.; Reams, Josiah T.; Guenthner, Andrew J.; Cambrea, Lee R.; Groshens, Thomas J.; Baldwin, Lawrence C.; Garrison, Michael D.; Mabry, Joseph M. Synthesis, characterization, and cure chemistry of renewable bis(cyanate) esters derived from 2-methoxy-4-methylphenol. Biomacromolecules 14(3) (2013) 771-780
Space group: P 1 21/c 1
Cell volume: 1995.8
Cell parameters: 9.0462; 15.0946; 14.9988; 90; 102.966; 90;  

COD ID: 1511777
CIF file Formula: - C20 H20 N2 O4 -
Comments: Meylemans, Heather A.; Harvey, Benjamin G.; Reams, Josiah T.; Guenthner, Andrew J.; Cambrea, Lee R.; Groshens, Thomas J.; Baldwin, Lawrence C.; Garrison, Michael D.; Mabry, Joseph M. Synthesis, characterization, and cure chemistry of renewable bis(cyanate) esters derived from 2-methoxy-4-methylphenol. Biomacromolecules 14(3) (2013) 771-780
Space group: P -1
Cell volume: 928.4
Cell parameters: 7.062; 11.734; 12.337; 106.625; 95.476; 105.337;  

COD ID: 1511778
CIF file Formula: - C19 H18 N2 O4 -
Comments: Meylemans, Heather A.; Harvey, Benjamin G.; Reams, Josiah T.; Guenthner, Andrew J.; Cambrea, Lee R.; Groshens, Thomas J.; Baldwin, Lawrence C.; Garrison, Michael D.; Mabry, Joseph M. Synthesis, characterization, and cure chemistry of renewable bis(cyanate) esters derived from 2-methoxy-4-methylphenol. Biomacromolecules 14(3) (2013) 771-780
Space group: C 1 2/c 1
Cell volume: 1770.8
Cell parameters: 17.5687; 4.777; 22.8294; 90; 112.446; 90;  

COD ID: 1511779
CIF file Formula: - C21 H26 F2 O4 -
Comments: Han, Changho; Salyer, Amy E.; Kim, Eun Hoo; Jiang, Xinyi; Jarrard, Rachel E.; Powers, Matthew S.; Kirchhoff, Aaron M.; Salvador, Tolani K.; Chester, Julia A.; Hockerman, Gregory H.; Colby, David A. Evaluation of Difluoromethyl Ketones as Agonists of the γ-Aminobutyric Acid Type B (GABAB) Receptor. Journal of medicinal chemistry 56(6) (2013) 2456-2465
Space group: P 1 21/c 1
Cell volume: 1886
Cell parameters: 20.784; 10.63; 8.5364; 90; 90.131; 90;  

COD ID: 1511780
CIF file Formula: - C8 H4 D K O4 -
Comments: Riley, Erin A.; Hess, Chelsea M.; Pioquinto, Jan Rey L.; Kaminsky, Werner; Kahr, Bart; Reid, Philip J. Proton transfer and photoluminescence intermittency of single emitters in dyed crystals. The journal of physical chemistry. B 117(16) (2013) 4313-4324
Space group: P c a 21
Cell volume: 825.9
Cell parameters: 9.598; 13.32; 6.4599; 90; 90; 90;  

COD ID: 1511781
CIF file Formula: - C8 H4 D K O4 -
Comments: Riley, Erin A.; Hess, Chelsea M.; Pioquinto, Jan Rey L.; Kaminsky, Werner; Kahr, Bart; Reid, Philip J. Proton transfer and photoluminescence intermittency of single emitters in dyed crystals. The journal of physical chemistry. B 117(16) (2013) 4313-4324
Space group: P c a 21
Cell volume: 831.42
Cell parameters: 9.6164; 13.3282; 6.4869; 90; 90; 90;  

COD ID: 1511782
CIF file Formula: - C8 H5 K O4 -
Comments: Riley, Erin A.; Hess, Chelsea M.; Pioquinto, Jan Rey L.; Kaminsky, Werner; Kahr, Bart; Reid, Philip J. Proton transfer and photoluminescence intermittency of single emitters in dyed crystals. The journal of physical chemistry. B 117(16) (2013) 4313-4324
Space group: P c a 21
Cell volume: 825.01
Cell parameters: 9.5955; 13.2964; 6.4663; 90; 90; 90;  

COD ID: 1511783
CIF file Formula: - C8 H5 K O4 -
Comments: Riley, Erin A.; Hess, Chelsea M.; Pioquinto, Jan Rey L.; Kaminsky, Werner; Kahr, Bart; Reid, Philip J. Proton transfer and photoluminescence intermittency of single emitters in dyed crystals. The journal of physical chemistry. B 117(16) (2013) 4313-4324
Space group: P c a 21
Cell volume: 831.47
Cell parameters: 9.6172; 13.3264; 6.4876; 90; 90; 90;  

COD ID: 1511784
CIF file Formula: - C8 H8 B F2 Li N2 O4 -
Comments: Han, Sang-Don; Allen, Joshua L.; Jónsson, Erlendur; Johansson, Patrik; McOwen, Dennis W.; Boyle, Paul D.; Henderson, Wesley A. Solvate Structures and Computational/Spectroscopic Characterization of Lithium Difluoro(oxalato)borate (LiDFOB) Electrolytes The Journal of Physical Chemistry C 117(11) (2013) 5521
Space group: P 1 21/m 1
Cell volume: 550.98
Cell parameters: 6.1948; 15.6492; 6.2164; 90; 113.897; 90;  

COD ID: 1511785
CIF file Formula: - C4 H3 B F2 Li N O4 -
Comments: Han, Sang-Don; Allen, Joshua L.; Jónsson, Erlendur; Johansson, Patrik; McOwen, Dennis W.; Boyle, Paul D.; Henderson, Wesley A. Solvate Structures and Computational/Spectroscopic Characterization of Lithium Difluoro(oxalato)borate (LiDFOB) Electrolytes The Journal of Physical Chemistry C 117(11) (2013) 5521
Space group: P n m a
Cell volume: 737.65
Cell parameters: 8.0325; 6.1722; 14.8786; 90; 90; 90;  

COD ID: 1511786
CIF file Formula: - C8 H9 B F2 Li N3 O4 -
Comments: Han, Sang-Don; Allen, Joshua L.; Jónsson, Erlendur; Johansson, Patrik; McOwen, Dennis W.; Boyle, Paul D.; Henderson, Wesley A. Solvate Structures and Computational/Spectroscopic Characterization of Lithium Difluoro(oxalato)borate (LiDFOB) Electrolytes The Journal of Physical Chemistry C 117(11) (2013) 5521
Space group: P n m a
Cell volume: 1265.47
Cell parameters: 8.0286; 6.3995; 24.6301; 90; 90; 90;  

COD ID: 1511787
CIF file Formula: - C84 H144 B6 F12 Li6 N8 O48 -
Comments: Han, Sang-Don; Allen, Joshua L.; Jónsson, Erlendur; Johansson, Patrik; McOwen, Dennis W.; Boyle, Paul D.; Henderson, Wesley A. Solvate Structures and Computational/Spectroscopic Characterization of Lithium Difluoro(oxalato)borate (LiDFOB) Electrolytes The Journal of Physical Chemistry C 117(11) (2013) 5521
Space group: P 1 21/c 1
Cell volume: 6153
Cell parameters: 21.957; 12.906; 25.723; 90; 122.419; 90;  

COD ID: 1511788
CIF file Formula: - C13 H18 B2 F4 Li2 O17 -
Comments: Han, Sang-Don; Allen, Joshua L.; Jónsson, Erlendur; Johansson, Patrik; McOwen, Dennis W.; Boyle, Paul D.; Henderson, Wesley A. Solvate Structures and Computational/Spectroscopic Characterization of Lithium Difluoro(oxalato)borate (LiDFOB) Electrolytes The Journal of Physical Chemistry C 117(11) (2013) 5521
Space group: P 1 21/n 1
Cell volume: 1119.71
Cell parameters: 8.1606; 10.7284; 12.8309; 90; 94.6107; 90;  

COD ID: 1511789
CIF file Formula: - C22 H42 B2 F4 Li2 O14 -
Comments: Han, Sang-Don; Allen, Joshua L.; Jónsson, Erlendur; Johansson, Patrik; McOwen, Dennis W.; Boyle, Paul D.; Henderson, Wesley A. Solvate Structures and Computational/Spectroscopic Characterization of Lithium Difluoro(oxalato)borate (LiDFOB) Electrolytes The Journal of Physical Chemistry C 117(11) (2013) 5521
Space group: P 1
Cell volume: 820.1
Cell parameters: 8.554; 8.841; 12.929; 93.573; 108.72; 114.576;  

COD ID: 1511790
CIF file Formula: - C10 H20 B F2 Li O8 -
Comments: Han, Sang-Don; Allen, Joshua L.; Jónsson, Erlendur; Johansson, Patrik; McOwen, Dennis W.; Boyle, Paul D.; Henderson, Wesley A. Solvate Structures and Computational/Spectroscopic Characterization of Lithium Difluoro(oxalato)borate (LiDFOB) Electrolytes The Journal of Physical Chemistry C 117(11) (2013) 5521
Space group: C 1 2/c 1
Cell volume: 3245
Cell parameters: 25.731; 8.467; 16.921; 90; 118.327; 90;  

COD ID: 1511791
CIF file Formula: - C6 H6 B F2 Li O7 -
Comments: Han, Sang-Don; Allen, Joshua L.; Jónsson, Erlendur; Johansson, Patrik; McOwen, Dennis W.; Boyle, Paul D.; Henderson, Wesley A. Solvate Structures and Computational/Spectroscopic Characterization of Lithium Difluoro(oxalato)borate (LiDFOB) Electrolytes The Journal of Physical Chemistry C 117(11) (2013) 5521
Space group: P 1 21/m 1
Cell volume: 486.35
Cell parameters: 6.443; 6.2831; 12.1294; 90; 97.91; 90;  

COD ID: 1511792
CIF file Formula: - C11 H23 B F2 Li N3 O4 -
Comments: Han, Sang-Don; Allen, Joshua L.; Jónsson, Erlendur; Johansson, Patrik; McOwen, Dennis W.; Boyle, Paul D.; Henderson, Wesley A. Solvate Structures and Computational/Spectroscopic Characterization of Lithium Difluoro(oxalato)borate (LiDFOB) Electrolytes The Journal of Physical Chemistry C 117(11) (2013) 5521
Space group: P 1 21/c 1
Cell volume: 1650.9
Cell parameters: 13.626; 8.717; 18.413; 90; 130.986; 90;  

COD ID: 1511793
CIF file Formula: - C6 H4 B F2 Li N2 O4 -
Comments: Han, Sang-Don; Allen, Joshua L.; Jónsson, Erlendur; Johansson, Patrik; McOwen, Dennis W.; Boyle, Paul D.; Henderson, Wesley A. Solvate Structures and Computational/Spectroscopic Characterization of Lithium Difluoro(oxalato)borate (LiDFOB) Electrolytes The Journal of Physical Chemistry C 117(11) (2013) 5521
Space group: P n m a
Cell volume: 929.7
Cell parameters: 8.58; 7.781; 13.926; 90; 90; 90;  

COD ID: 1511794
CIF file Formula: - C38 H45 B F2 N2 -
Comments: Vu, Thanh Truc; Dvorko, Marina; Schmidt, Elena Y.; Audibert, Jean-Frédéric; Retailleau, Pascal; Trofimov, Boris A.; Pansu, Robert B.; Clavier, Gilles; Méallet-Renault, Rachel Understanding the Spectroscopic Properties and Aggregation Process of a New Emitting Boron Dipyrromethene (BODIPY) The Journal of Physical Chemistry C 117(10) (2013) 5373
Space group: P 1 21/c 1
Cell volume: 3087.9
Cell parameters: 14.0557; 11.4779; 19.3737; 90; 98.905; 90;  

COD ID: 1511795
CIF file Formula: - C14 H8 O2 S3 -
Comments: Zhou, Weidong; Hernández-Burgos, Kenneth; Burkhardt, Stephen E.; Qian, Hualei; Abru Héctor D. Synthesis and Electrochemical and Computational Analysis of Two New Families of Thiophene-Carbonyl Molecules The Journal of Physical Chemistry C 117(12) (2013) 6022
Space group: P c a 21
Cell volume: 1258.31
Cell parameters: 27.724; 3.8968; 11.6473; 90; 90; 90;  

COD ID: 1511796
CIF file Formula: - C10 H6 O2 S2 -
Comments: Zhou, Weidong; Hernández-Burgos, Kenneth; Burkhardt, Stephen E.; Qian, Hualei; Abru Héctor D. Synthesis and Electrochemical and Computational Analysis of Two New Families of Thiophene-Carbonyl Molecules The Journal of Physical Chemistry C 117(12) (2013) 6022
Space group: P 1 21/c 1
Cell volume: 471.28
Cell parameters: 7.2737; 4.7577; 13.719; 90; 96.938; 90;  

COD ID: 1511797
CIF file Formula: - C16 H8 O4 S3 -
Comments: Zhou, Weidong; Hernández-Burgos, Kenneth; Burkhardt, Stephen E.; Qian, Hualei; Abru Héctor D. Synthesis and Electrochemical and Computational Analysis of Two New Families of Thiophene-Carbonyl Molecules The Journal of Physical Chemistry C 117(12) (2013) 6022
Space group: P 1 21/c 1
Cell volume: 1444.75
Cell parameters: 17.4433; 7.3062; 11.3446; 90; 92.185; 90;  

COD ID: 1511798
CIF file Formula: - C62 H72 N6 S8 Si -
Comments: Zhugayevych, Andriy; Postupna, Olena; Bakus II, Ronald C.; Welch, Gregory C.; Bazan, Guillermo C.; Tretiak, Sergei Ab Initio Study of a Molecular Crystal for Photovoltaics: Light Absorption, Exciton and Charge Carrier Transport The Journal of Physical Chemistry C 117(10) (2013) 4920
Space group: C 1 2/c 1
Cell volume: 6025.8
Cell parameters: 39.3141; 15.2065; 10.3691; 90; 103.575; 90;  

COD ID: 1511799
CIF file Formula: - C3.665 D45.54 O30.33 -
Comments: Falenty, A.; Salamatin, A. N.; Kuhs, W. F. Kinetics of CO2-Hydrate Formation from Ice Powders: Data Summary and Modeling Extended to Low Temperatures The Journal of Physical Chemistry C 117(16) (2013) 8443
Space group: P m -3 n
Cell volume: 1671.56
Cell parameters: 11.8679; 11.8679; 11.8679; 90; 90; 90;  

COD ID: 1511800
CIF file Formula: - C12 H7 O P S3 -
Comments: Ren, Yi; Biegger, Felix; Baumgartner, Thomas Molecular Engineering of the Physical Properties of Highly Luminescent π-Conjugated Phospholes The Journal of Physical Chemistry C 117(9) (2013) 4748
Space group: P 1 21/c 1
Cell volume: 1230.42
Cell parameters: 10.076; 8.291; 14.934; 90; 99.516; 90;  

COD ID: 1511801
CIF file Formula: - C3 H8 -
Comments: Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Why Propane? The Journal of Physical Chemistry C 117(9) (2013) 4759
Space group: P 1 21/n 1
Cell volume: 290.7
Cell parameters: 3.8208; 11.912; 6.388; 90; 91.11; 90;  

COD ID: 1511802
CIF file Formula: - C3 H8 -
Comments: Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Why Propane? The Journal of Physical Chemistry C 117(9) (2013) 4759
Space group: P 1 21/n 1
Cell volume: 286.9
Cell parameters: 3.8036; 11.858; 6.3628; 90; 91.083; 90;  

COD ID: 1511803
CIF file Formula: - C3 H8 -
Comments: Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Why Propane? The Journal of Physical Chemistry C 117(9) (2013) 4759
Space group: P 1 21/n 1
Cell volume: 284
Cell parameters: 3.7895; 11.825; 6.34; 90; 91.096; 90;  

COD ID: 1511804
CIF file Formula: - C3 H8 -
Comments: Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Why Propane? The Journal of Physical Chemistry C 117(9) (2013) 4759
Space group: P 1 21/n 1
Cell volume: 279.4
Cell parameters: 3.7633; 11.778; 6.305; 90; 90.85; 90;  

COD ID: 1511805
CIF file Formula: - C3 H8 -
Comments: Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Why Propane? The Journal of Physical Chemistry C 117(9) (2013) 4759
Space group: P 1 21/n 1
Cell volume: 278.3
Cell parameters: 3.762; 11.781; 6.281; 90; 90.84; 90;  

COD ID: 1511806
CIF file Formula: - C3 H8 -
Comments: Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Why Propane? The Journal of Physical Chemistry C 117(9) (2013) 4759
Space group: P 1 21/n 1
Cell volume: 269.9
Cell parameters: 3.722; 11.676; 6.212; 90; 90.86; 90;  

COD ID: 1511807
CIF file Formula: - C3 H8 -
Comments: Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Why Propane? The Journal of Physical Chemistry C 117(9) (2013) 4759
Space group: P 1 21/n 1
Cell volume: 264.4
Cell parameters: 3.689; 11.651; 6.151; 90; 90.48; 90;  

COD ID: 1511808
CIF file Formula: - C4 H10 -
Comments: Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Why Propane? The Journal of Physical Chemistry C 117(9) (2013) 4759
Space group: P 1 21/c 1
Cell volume: 186.9
Cell parameters: 5.416; 4.893; 7.294; 90; 104.78; 90;  

COD ID: 1511809
CIF file Formula: - C4 H10 -
Comments: Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Why Propane? The Journal of Physical Chemistry C 117(9) (2013) 4759
Space group: P 1 21/c 1
Cell volume: 186
Cell parameters: 5.408; 4.887; 7.275; 90; 104.65; 90;  

COD ID: 1511810
CIF file Formula: - C4 H10 -
Comments: Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Why Propane? The Journal of Physical Chemistry C 117(9) (2013) 4759
Space group: P 1 21/c 1
Cell volume: 178.7
Cell parameters: 5.344; 4.833; 7.15; 90; 104.63; 90;  

COD ID: 1511811
CIF file Formula: - C4 H10 -
Comments: Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Why Propane? The Journal of Physical Chemistry C 117(9) (2013) 4759
Space group: P 1 21/c 1
Cell volume: 171.6
Cell parameters: 5.267; 4.759; 7.05; 90; 103.85; 90;  

COD ID: 1511812
CIF file Formula: - C4 H10 -
Comments: Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Why Propane? The Journal of Physical Chemistry C 117(9) (2013) 4759
Space group: P 1 21/c 1
Cell volume: 166.2
Cell parameters: 5.236; 4.735; 6.912; 90; 104.11; 90;  

COD ID: 1511813
CIF file Formula: - C52 H50 O2 -
Comments: Kumar, Shiv; Venkatramaiah, N.; Patil, Satish Fluoranthene Based Derivatives for Detection of Trace Explosive Nitroaromatics The Journal of Physical Chemistry C 117(14) (2013) 7236
Space group: P -1
Cell volume: 4189.2
Cell parameters: 12.28; 15.6586; 23.5675; 76.397; 78.217; 74.138;  

COD ID: 1511814
CIF file Formula: - C60 H64 O2 -
Comments: Kumar, Shiv; Venkatramaiah, N.; Patil, Satish Fluoranthene Based Derivatives for Detection of Trace Explosive Nitroaromatics The Journal of Physical Chemistry C 117(14) (2013) 7236
Space group: P 1 21/c 1
Cell volume: 4798.4
Cell parameters: 12.4695; 25.1015; 16.1011; 90; 107.8; 90;  

COD ID: 1511815
CIF file Formula: - C5 H6 N2 O S -
Comments: Jarzembska, Katarzyna N.; Kamiński, Radosław; Wenger, Emmanuel; Lecomte, Claude; Dominiak, Paulina M. Interplay between Charge Density Distribution, Crystal Structure Energetic Features, and Crystal Morphology of 6-Methyl-2-thiouracil The Journal of Physical Chemistry C 117(15) (2013) 7764
Space group: P 1 21/c 1
Cell volume: 597.97
Cell parameters: 4.3315; 14.4396; 9.5617; 90; 90.8638; 90;  

COD ID: 1511816
CIF file Formula: - C5 H6 N2 O S -
Comments: Jarzembska, Katarzyna N.; Kamiński, Radosław; Wenger, Emmanuel; Lecomte, Claude; Dominiak, Paulina M. Interplay between Charge Density Distribution, Crystal Structure Energetic Features, and Crystal Morphology of 6-Methyl-2-thiouracil The Journal of Physical Chemistry C 117(15) (2013) 7764
Space group: P 1 21/c 1
Cell volume: 594.69
Cell parameters: 4.3135; 14.432; 9.5548; 90; 91.17; 90;  

COD ID: 1511817
CIF file Formula: - C28 H34 -
Comments: Merz, Tyler A.; Waddell, Paul G.; Cole, Jacqueline M. Systematic Molecular Design ofp-Phenylene Lasing Properties The Journal of Physical Chemistry C 117(16) (2013) 8429
Space group: P -1
Cell volume: 552.1
Cell parameters: 6.663; 6.883; 12.477; 94.702; 94.348; 103.397;  

COD ID: 1511818
CIF file Formula: - C38 H42 -
Comments: Merz, Tyler A.; Waddell, Paul G.; Cole, Jacqueline M. Systematic Molecular Design ofp-Phenylene Lasing Properties The Journal of Physical Chemistry C 117(16) (2013) 8429
Space group: P 1 21/c 1
Cell volume: 1434.9
Cell parameters: 8.7787; 15.673; 10.689; 90; 102.668; 90;  

COD ID: 1511819
CIF file Formula: - C33 H34 O2 -
Comments: Merz, Tyler A.; Waddell, Paul G.; Cole, Jacqueline M. Systematic Molecular Design ofp-Phenylene Lasing Properties The Journal of Physical Chemistry C 117(16) (2013) 8429
Space group: P 1 21/n 1
Cell volume: 5046
Cell parameters: 9.862; 49.707; 10.319; 90; 93.959; 90;  

COD ID: 1511820
CIF file Formula: - C50 H70 Na2 O14 S2 -
Comments: Merz, Tyler A.; Waddell, Paul G.; Cole, Jacqueline M. Systematic Molecular Design ofp-Phenylene Lasing Properties The Journal of Physical Chemistry C 117(16) (2013) 8429
Space group: P -1
Cell volume: 5042
Cell parameters: 12.824; 16.877; 25.494; 103.863; 91.782; 108.619;  

COD ID: 1511821
CIF file Formula: - C50 H58 -
Comments: Merz, Tyler A.; Waddell, Paul G.; Cole, Jacqueline M. Systematic Molecular Design ofp-Phenylene Lasing Properties The Journal of Physical Chemistry C 117(16) (2013) 8429
Space group: P -1
Cell volume: 945.9
Cell parameters: 7.617; 10.296; 13.249; 72.923; 75.218; 76.43;  

COD ID: 1511822
CIF file Formula: - C52 H54 O2 -
Comments: Merz, Tyler A.; Waddell, Paul G.; Cole, Jacqueline M. Systematic Molecular Design ofp-Phenylene Lasing Properties The Journal of Physical Chemistry C 117(16) (2013) 8429
Space group: P 1 21/c 1
Cell volume: 4019.7
Cell parameters: 15.938; 11.092; 23.495; 90; 104.583; 90;  

COD ID: 1511823
CIF file Formula: - C12 H20 Cd N6 O6 -
Comments: Colaneri, Michael J.; Vitali, Jacqueline; Kirschbaum, Kristin Electron Paramagnetic Resonance Spectroscopic Study of Copper Hopping in Doped Bis(l-histidinato)cadmium Dihydrate. The journal of physical chemistry. A 117(16) (2013) 3414-3427
Space group: P 43 21 2
Cell volume: 1658.23
Cell parameters: 7.3625; 7.3625; 30.591; 90; 90; 90;  

COD ID: 1511824
CIF file Formula: - C12 H20 Cd N6 O6 -
Comments: Colaneri, Michael J.; Vitali, Jacqueline; Kirschbaum, Kristin Electron Paramagnetic Resonance Spectroscopic Study of Copper Hopping in Doped Bis(l-histidinato)cadmium Dihydrate. The journal of physical chemistry. A 117(16) (2013) 3414-3427
Space group: P 43 21 2
Cell volume: 1646
Cell parameters: 7.3515; 7.3515; 30.456; 90; 90; 90;  

COD ID: 1511825
CIF file Formula: - C8 H3.3333 N6 O2.6667 -
Comments: Sakai, Ken-ichi; Nagahara, Kenta; Yoshii, Yuuya; Hoshino, Norihisa; Akutagawa, Tomoyuki Structural and Spectroscopic Study of 6,7-Dicyano-Substituted Lumazine with High Electron Affinity and Proton Acidity The Journal of Physical Chemistry A 117(17) (2013) 3614
Space group: P 1 21/c 1
Cell volume: 2709.57
Cell parameters: 5.59928; 24.2233; 19.9883; 90; 91.9071; 90;  

COD ID: 1511826
CIF file Formula: - C26 H25 N9 O2 -
Comments: Sakai, Ken-ichi; Nagahara, Kenta; Yoshii, Yuuya; Hoshino, Norihisa; Akutagawa, Tomoyuki Structural and Spectroscopic Study of 6,7-Dicyano-Substituted Lumazine with High Electron Affinity and Proton Acidity The Journal of Physical Chemistry A 117(17) (2013) 3614
Space group: P n a 21
Cell volume: 2431.61
Cell parameters: 12.4315; 25.1447; 7.779; 90; 90; 90;  

COD ID: 1511827
CIF file Formula: - C23 H26 N9 O2 -
Comments: Sakai, Ken-ichi; Nagahara, Kenta; Yoshii, Yuuya; Hoshino, Norihisa; Akutagawa, Tomoyuki Structural and Spectroscopic Study of 6,7-Dicyano-Substituted Lumazine with High Electron Affinity and Proton Acidity The Journal of Physical Chemistry A 117(17) (2013) 3614
Space group: P -1
Cell volume: 1111.8
Cell parameters: 7.098; 8.88601; 17.7107; 91.29; 94.207; 93.309;  

COD ID: 1511828
CIF file Formula: - C11 H4 N6 O2 S2 -
Comments: Sakai, Ken-ichi; Nagahara, Kenta; Yoshii, Yuuya; Hoshino, Norihisa; Akutagawa, Tomoyuki Structural and Spectroscopic Study of 6,7-Dicyano-Substituted Lumazine with High Electron Affinity and Proton Acidity The Journal of Physical Chemistry A 117(17) (2013) 3614
Space group: P 1 21/c 1
Cell volume: 1230.81
Cell parameters: 12.4709; 6.73238; 15.9897; 90; 113.534; 90;  

COD ID: 1511829
CIF file Formula: - C24 H37 N7 O2 -
Comments: Sakai, Ken-ichi; Nagahara, Kenta; Yoshii, Yuuya; Hoshino, Norihisa; Akutagawa, Tomoyuki Structural and Spectroscopic Study of 6,7-Dicyano-Substituted Lumazine with High Electron Affinity and Proton Acidity The Journal of Physical Chemistry A 117(17) (2013) 3614
Space group: C 1 2/m 1
Cell volume: 2541.75
Cell parameters: 19.5748; 12.6306; 10.3215; 90; 95.1121; 90;  

COD ID: 1511830
CIF file Formula: - C8 H8 O3 -
Comments: Cai, Weizhao; Marciniak, Jędrzej; Andrzejewski, Michał; Katrusiak, Andrzej Pressure Effect ond,l-Mandelic Acid Racemate Crystallization The Journal of Physical Chemistry C 117(14) (2013) 7279
Space group: P b c a
Cell volume: 1549.7
Cell parameters: 9.676; 16.2; 9.8866; 90; 90; 90;  

COD ID: 1511831
CIF file Formula: - C8 H8 O3 -
Comments: Cai, Weizhao; Marciniak, Jędrzej; Andrzejewski, Michał; Katrusiak, Andrzej Pressure Effect ond,l-Mandelic Acid Racemate Crystallization The Journal of Physical Chemistry C 117(14) (2013) 7279
Space group: P b c a
Cell volume: 1519.3
Cell parameters: 9.66; 16.126; 9.753; 90; 90; 90;  

COD ID: 1511832
CIF file Formula: - C8 H8 O3 -
Comments: Cai, Weizhao; Marciniak, Jędrzej; Andrzejewski, Michał; Katrusiak, Andrzej Pressure Effect ond,l-Mandelic Acid Racemate Crystallization The Journal of Physical Chemistry C 117(14) (2013) 7279
Space group: P b c a
Cell volume: 1507.1
Cell parameters: 9.676; 16.179; 9.627; 90; 90; 90;  

COD ID: 1511833
CIF file Formula: - C8 H8 O3 -
Comments: Cai, Weizhao; Marciniak, Jędrzej; Andrzejewski, Michał; Katrusiak, Andrzej Pressure Effect ond,l-Mandelic Acid Racemate Crystallization The Journal of Physical Chemistry C 117(14) (2013) 7279
Space group: P b c a
Cell volume: 1471.2
Cell parameters: 9.634; 16.132; 9.466; 90; 90; 90;  

COD ID: 1511834
CIF file Formula: - C8 H8 O3 -
Comments: Cai, Weizhao; Marciniak, Jędrzej; Andrzejewski, Michał; Katrusiak, Andrzej Pressure Effect ond,l-Mandelic Acid Racemate Crystallization The Journal of Physical Chemistry C 117(14) (2013) 7279
Space group: P b c a
Cell volume: 1456.2
Cell parameters: 9.637; 16.135; 9.365; 90; 90; 90;  

COD ID: 1511835
CIF file Formula: - C8 H8 O3 -
Comments: Cai, Weizhao; Marciniak, Jędrzej; Andrzejewski, Michał; Katrusiak, Andrzej Pressure Effect ond,l-Mandelic Acid Racemate Crystallization The Journal of Physical Chemistry C 117(14) (2013) 7279
Space group: P 1 21/c 1
Cell volume: 1382.9
Cell parameters: 5.825; 28.908; 8.224; 90; 93.03; 90;  

COD ID: 1511836
CIF file Formula: - C8 H8 O3 -
Comments: Cai, Weizhao; Marciniak, Jędrzej; Andrzejewski, Michał; Katrusiak, Andrzej Pressure Effect ond,l-Mandelic Acid Racemate Crystallization The Journal of Physical Chemistry C 117(14) (2013) 7279
Space group: P 1 21/c 1
Cell volume: 1374.4
Cell parameters: 5.8185; 28.941; 8.173; 90; 93.01; 90;  

COD ID: 1511837
CIF file Formula: - C8 H8 O3 -
Comments: Cai, Weizhao; Marciniak, Jędrzej; Andrzejewski, Michał; Katrusiak, Andrzej Pressure Effect ond,l-Mandelic Acid Racemate Crystallization The Journal of Physical Chemistry C 117(14) (2013) 7279
Space group: P 1 21/c 1
Cell volume: 1344.4
Cell parameters: 5.806; 28.807; 8.05; 90; 93.12; 90;  

COD ID: 1511838
CIF file Formula: - C8 H8 O3 -
Comments: Cai, Weizhao; Marciniak, Jędrzej; Andrzejewski, Michał; Katrusiak, Andrzej Pressure Effect ond,l-Mandelic Acid Racemate Crystallization The Journal of Physical Chemistry C 117(14) (2013) 7279
Space group: P 1 21/c 1
Cell volume: 1311.2
Cell parameters: 5.786; 28.65; 7.924; 90; 93.44; 90;  

COD ID: 1511839
CIF file Formula: - C26.5 H30 Cl3 N O S Ti -
Comments: Chen, Zhou; Li, Jun-Fang; Tao, Wen-Jie; Sun, Xiu-Li; Yang, Xiao-Hong; Tang, Yong Copolymerization of Ethylene with Functionalized Olefins by [ONX] Titanium Complexes Macromolecules 46(7) (2013) 2870
Space group: P 1 21/n 1
Cell volume: 2640.9
Cell parameters: 9.4097; 16.5333; 17.4411; 90; 103.276; 90;  

COD ID: 1511840
CIF file Formula: - C15 H22 O3 -
Comments: Ma, Yan-Yan; Zhao, Deng-Gao; Gao, Kun Structural Investigation and Biological Activity of Sesquiterpene Lactones from the Traditional Chinese HerbInula racemosa Journal of Natural Products 76(4) (2013) 564
Space group: P 1 21 1
Cell volume: 1398.3
Cell parameters: 12.07; 7.88; 14.734; 90; 93.781; 90;  

COD ID: 1511841
CIF file Formula: - C15 H21 Cl O4 -
Comments: Ma, Yan-Yan; Zhao, Deng-Gao; Gao, Kun Structural Investigation and Biological Activity of Sesquiterpene Lactones from the Traditional Chinese HerbInula racemosa Journal of Natural Products 76(4) (2013) 564
Space group: P 1 21 1
Cell volume: 718.4
Cell parameters: 6.422; 11.87; 9.689; 90; 103.415; 90;  

COD ID: 1511842
CIF file Formula: - C15 H22 O4 -
Comments: Ma, Yan-Yan; Zhao, Deng-Gao; Gao, Kun Structural Investigation and Biological Activity of Sesquiterpene Lactones from the Traditional Chinese HerbInula racemosa Journal of Natural Products 76(4) (2013) 564
Space group: P 1 21 1
Cell volume: 679.5
Cell parameters: 6.155; 11.287; 9.836; 90; 96.098; 90;  

COD ID: 1511843
CIF file Formula: - C15 H24 O4 -
Comments: Ma, Yan-Yan; Zhao, Deng-Gao; Gao, Kun Structural Investigation and Biological Activity of Sesquiterpene Lactones from the Traditional Chinese HerbInula racemosa Journal of Natural Products 76(4) (2013) 564
Space group: P 21 21 21
Cell volume: 1476.9
Cell parameters: 8.379; 9.018; 19.545; 90; 90; 90;  

COD ID: 1511844
CIF file Formula: - C25 H30 O8 -
Comments: Harinantenaina, Liva; Bowman, Jessica D.; Brodie, Peggy J.; Slebodnick, Carla; Callmander, Martin W.; Rakotobe, Etienne; Randrianaivo, Richard; Rasamison, Vincent E.; Gorka, Alexander; Roepe, Paul D.; Cassera, Maria B.; Kingston, David G. I. Antiproliferative and antiplasmodial dimeric phloroglucinols from Mallotus oppositifolius from the Madagascar Dry Forest (1). Journal of natural products 76(3) (2013) 388-393
Space group: P 1 21/c 1
Cell volume: 2212.38
Cell parameters: 12.88614; 12.34409; 14.84644; 90; 110.476; 90;  

COD ID: 1511845
CIF file Formula: - C21 H24 O8 -
Comments: Harinantenaina, Liva; Bowman, Jessica D.; Brodie, Peggy J.; Slebodnick, Carla; Callmander, Martin W.; Rakotobe, Etienne; Randrianaivo, Richard; Rasamison, Vincent E.; Gorka, Alexander; Roepe, Paul D.; Cassera, Maria B.; Kingston, David G. I. Antiproliferative and antiplasmodial dimeric phloroglucinols from Mallotus oppositifolius from the Madagascar Dry Forest (1). Journal of natural products 76(3) (2013) 388-393
Space group: P 1 21/c 1
Cell volume: 1863.8
Cell parameters: 9.4459; 12.5596; 16.2541; 90; 104.867; 90;  

COD ID: 1511846
CIF file Formula: - C35 H42 O8 -
Comments: Wang, Luo-Yi; Wu, Jian; Yang, Zhuo; Wang, Xu-Jie; Fu, Yan; Liu, Shuang-Zhu; Wang, Hong-Min; Zhu, Wei-Liang; Zhang, Hai-Yan; Zhao, Wei-Min (M)- and (P)-Bicelaphanol A, Dimeric Trinorditerpenes with Promising Neuroprotective Activity fromCelastrus orbiculatus Journal of Natural Products 76(4) (2013) 745
Space group: P 1 21 1
Cell volume: 1516.93
Cell parameters: 8.4324; 16.6283; 10.8816; 90; 96.174; 90;  

COD ID: 1511847
CIF file Formula: - C27 H29 N5 O5 -
Comments: Shao, Chang-Lun; Xu, Ru-Fang; Wei, Mei-Yan; She, Zhi-Gang; Wang, Chang-Yun Structure and Absolute Configuration of Fumiquinazoline L, an Alkaloid from a Gorgonian-DerivedScopulariopsissp. Fungus Journal of Natural Products 76(4) (2013) 779
Space group: P 1 21 1
Cell volume: 1203.71
Cell parameters: 11.3275; 7.8127; 13.6034; 90; 90.954; 90;  

COD ID: 1511848
CIF file Formula: - C21 H30 O2 -
Comments: Ogata, Kenichi; Shimada, Daisuke; Furuya, Shouichi; Fukuzawa, Shin-ichi Nickel-catalyzed ring-opening alkylative coupling of enone with methylenecyclopropane in the presence of triethylborane. Organic letters 15(6) (2013) 1182-1185
Space group: P -1
Cell volume: 1863.5
Cell parameters: 7.628; 16.031; 16.085; 105.723; 95.4081; 96.799;  

COD ID: 1511849
CIF file Formula: - C32.5 H47.625 N8 O5.6875 -
Comments: Chouhan, Gagan; James, Keith Efficient construction of proline-containing β-turn mimetic cyclic tetrapeptides via CuAAC macrocyclization. Organic letters 15(6) (2013) 1206-1209
Space group: P 1 21 1
Cell volume: 14042.6
Cell parameters: 15.6976; 25.2314; 35.5709; 90; 94.636; 90;  

COD ID: 1511850
CIF file Formula: - C34.375 H52.25 Cl N8 O6.25 -
Comments: Chouhan, Gagan; James, Keith Efficient construction of proline-containing β-turn mimetic cyclic tetrapeptides via CuAAC macrocyclization. Organic letters 15(6) (2013) 1206-1209
Space group: P 21 21 21
Cell volume: 7575.1
Cell parameters: 17.5134; 17.8594; 24.2187; 90; 90; 90;  

COD ID: 1511851
CIF file Formula: - C36.25 H54 F3 N8 O6.25 -
Comments: Chouhan, Gagan; James, Keith Efficient construction of proline-containing β-turn mimetic cyclic tetrapeptides via CuAAC macrocyclization. Organic letters 15(6) (2013) 1206-1209
Space group: P 1
Cell volume: 3982.82
Cell parameters: 15.0672; 15.6539; 17.4818; 97.737; 99.263; 97.544;  

COD ID: 1511852
CIF file Formula: - C22 H22 Br N O7 S -
Comments: Yang, Wen; Yang, Yi; Du, Da-Ming Squaramide-tertiary amine catalyzed asymmetric cascade sulfa-Michael/Michael addition via dynamic kinetic resolution: access to highly functionalized chromans with three contiguous stereocenters. Organic letters 15(6) (2013) 1190-1193
Space group: P 1 21 1
Cell volume: 2195.1
Cell parameters: 14.599; 7.637; 20.16; 90; 102.416; 90;  

COD ID: 1511853
CIF file Formula: - C36 H56 Cl2 N2 P2 Ru -
Comments: Iida, Kazuki; Miura, Takashi; Ando, Junki; Saito, Susumu The Dual Role of Ruthenium and Alkali Base Catalysts in Enabling a Conceptually New Shortcut toN-Unsubstituted Pyrroles through Unmasked α-Amino Aldehydes Organic Letters 15(7) (2013) 1436
Space group: P -1
Cell volume: 1800
Cell parameters: 11.3882; 12.763; 13.2168; 86.38; 79.81; 72.19;  

COD ID: 1511854
CIF file Formula: - C36 H50 -
Comments: Wei, Junnian; Wang, Zitao; Zhang, Wen-Xiong; Xi, Zhenfeng Construction of octaalkyl-substituted and decasubstituted all-cis-octatetraenes via linear dimerization of 1,4-dicopper-1,3-butadienes and subsequent cross-coupling with halides. Organic letters 15(6) (2013) 1222-1225
Space group: C 1 2/c 1
Cell volume: 3090.3
Cell parameters: 13.9811; 14.0204; 15.849; 90; 95.903; 90;  

COD ID: 1511855
CIF file Formula: - C40 H54 -
Comments: Wei, Junnian; Wang, Zitao; Zhang, Wen-Xiong; Xi, Zhenfeng Construction of octaalkyl-substituted and decasubstituted all-cis-octatetraenes via linear dimerization of 1,4-dicopper-1,3-butadienes and subsequent cross-coupling with halides. Organic letters 15(6) (2013) 1222-1225
Space group: P 1 2/n 1
Cell volume: 1690.4
Cell parameters: 9.87; 9.2819; 18.478; 90; 93.06; 90;  

COD ID: 1511856
CIF file Formula: - C21 H22 Cl N2 O2 -
Comments: León, Brian; Fong, Jiunn C. N.; Peach, Kelly C.; Wong, Weng Ruh; Yildiz, Fitnat H.; Linington, Roger G. Development of quinoline-based disruptors of biofilm formation against Vibrio cholerae. Organic letters 15(6) (2013) 1234-1237
Space group: P 21 21 21
Cell volume: 1870.3
Cell parameters: 6.5377; 8.3477; 34.271; 90; 90; 90;  

COD ID: 1511857
CIF file Formula: - C20 H18 N2 O6 -
Comments: Lin, Wei; Dou, Guo-Lan; Hu, Ming-Hua; Cao, Cheng-Pao; Huang, Zhi-Bin; Shi, Da-Qing Facile, efficient, and diastereoselective synthesis of heterohelicene-like molecules. Organic letters 15(6) (2013) 1238-1241
Space group: P -1
Cell volume: 870.3
Cell parameters: 6.2683; 10.5563; 13.972; 92.725; 101.373; 105.089;  

COD ID: 1511858
CIF file Formula: - C26 H18.5 N2 O4.25 -
Comments: Lin, Wei; Dou, Guo-Lan; Hu, Ming-Hua; Cao, Cheng-Pao; Huang, Zhi-Bin; Shi, Da-Qing Facile, efficient, and diastereoselective synthesis of heterohelicene-like molecules. Organic letters 15(6) (2013) 1238-1241
Space group: P -1
Cell volume: 1995.4
Cell parameters: 11.735; 13.252; 15.517; 67.939; 71.678; 65.26;  

COD ID: 1511859
CIF file Formula: - C19 H20 O4 -
Comments: Zhang, Da-Li; Zhou, Li-Yan; Quan, Jun-Min; Zhang, Wei; Gu, Lian-Quan; Huang, Zhi-Shu; An, Lin-Kun Oxygen insertion of o-quinone under catalytic hydrogenation conditions. Organic letters 15(6) (2013) 1162-1165
Space group: P 1 21 1
Cell volume: 782.05
Cell parameters: 9.8118; 8.1212; 10.115; 90; 104.002; 90;  

COD ID: 1511860
CIF file Formula: - C22 H17 Br N4 O4 S -
Comments: Liu, Xiong-Li; Han, Wen-Yong; Zhang, Xiao-Mei; Yuan, Wei-Cheng Highly efficient and stereocontrolled construction of 3,3'-pyrrolidonyl spirooxindoles via organocatalytic domino Michael/cyclization reaction. Organic letters 15(6) (2013) 1246-1249
Space group: C 1 2 1
Cell volume: 2076.8
Cell parameters: 30.977; 6.0722; 11.0436; 90; 91.291; 90;  

COD ID: 1511861
CIF file Formula: - C29 H26 N4 O -
Comments: Li, Ming; Lv, Xiu-Liang; Wen, Li-Rong; Hu, Zhi-Qiang Direct solvent-free regioselective construction of pyrrolo[1,2-a][1,10]phenanthrolines based on isocyanide-based multicomponent reactions. Organic letters 15(6) (2013) 1262-1265
Space group: P 1 21/c 1
Cell volume: 2291
Cell parameters: 18.44; 7.7752; 18.306; 90; 119.204; 90;  

COD ID: 1511862
CIF file Formula: - C26 H19 Cl N4 O2 -
Comments: Li, Ming; Lv, Xiu-Liang; Wen, Li-Rong; Hu, Zhi-Qiang Direct solvent-free regioselective construction of pyrrolo[1,2-a][1,10]phenanthrolines based on isocyanide-based multicomponent reactions. Organic letters 15(6) (2013) 1262-1265
Space group: C 1 2/c 1
Cell volume: 4563
Cell parameters: 32.688; 7.675; 19.377; 90; 110.19; 90;  

COD ID: 1511863
CIF file Formula: - C18 H15 N O2 -
Comments: Yang, Weijun; Xu, Lijun; Chen, Zhengkai; Zhang, Lili; Miao, Maozhong; Ren, Hongjun Ru-catalyzed synthesis of dihydrofuroquinolines from azido-cyclopropyl ketones. Organic letters 15(6) (2013) 1282-1285
Space group: P 1 21/n 1
Cell volume: 1374.47
Cell parameters: 12.8977; 7.2069; 15.0389; 90; 100.506; 90;  

COD ID: 1511864
CIF file Formula: - C16 H16 O2 -
Comments: Xie, Xiaocong; Li, Yi; Fox, Joseph M. Selective Syntheses of Δα,βand Δβ,γButenolides from Allylic Cyclopropenecarboxylates via Tandem Ring Expansion/[3,3]-Sigmatropic Rearrangements Organic Letters 15(7) (2013) 1500
Space group: C 1 2/c 1
Cell volume: 2492.2
Cell parameters: 11.487; 6.052; 36.08; 90; 96.484; 90;  

COD ID: 1511865
CIF file Formula: - C23 H24 O2 -
Comments: Xie, Xiaocong; Li, Yi; Fox, Joseph M. Selective Syntheses of Δα,βand Δβ,γButenolides from Allylic Cyclopropenecarboxylates via Tandem Ring Expansion/[3,3]-Sigmatropic Rearrangements Organic Letters 15(7) (2013) 1500
Space group: P b c a
Cell volume: 3702.2
Cell parameters: 17.444; 8.121; 26.134; 90; 90; 90;  

COD ID: 1511866
CIF file Formula: - C44 H34 -
Comments: Feng, Xing; Hu, Jian-Yong; Iwanaga, Fumitaka; Seto, Nobuyuki; Redshaw, Carl; Elsegood, Mark R. J.; Yamato, Takehiko Blue-emitting butterfly-shaped 1,3,5,9-tetraarylpyrenes: synthesis, crystal structures, and photophysical properties. Organic letters 15(6) (2013) 1318-1321
Space group: P 1 21/n 1
Cell volume: 6214
Cell parameters: 14.22; 26.693; 16.457; 90; 95.884; 90;  

COD ID: 1511867
CIF file Formula: - C48 H42 O4 -
Comments: Feng, Xing; Hu, Jian-Yong; Iwanaga, Fumitaka; Seto, Nobuyuki; Redshaw, Carl; Elsegood, Mark R. J.; Yamato, Takehiko Blue-emitting butterfly-shaped 1,3,5,9-tetraarylpyrenes: synthesis, crystal structures, and photophysical properties. Organic letters 15(6) (2013) 1318-1321
Space group: P -1
Cell volume: 1811.4
Cell parameters: 12.642; 12.96; 13.854; 86.048; 67.354; 60.942;  

COD ID: 1511868
CIF file Formula: - C45 H35 Cl3 O4 -
Comments: Feng, Xing; Hu, Jian-Yong; Iwanaga, Fumitaka; Seto, Nobuyuki; Redshaw, Carl; Elsegood, Mark R. J.; Yamato, Takehiko Blue-emitting butterfly-shaped 1,3,5,9-tetraarylpyrenes: synthesis, crystal structures, and photophysical properties. Organic letters 15(6) (2013) 1318-1321
Space group: P 1 21/c 1
Cell volume: 3619.9
Cell parameters: 14.076; 9.7666; 26.439; 90; 95.169; 90;  

COD ID: 1511869
CIF file Formula: - C15 H13 Cl N2 O2 S -
Comments: Alla, Santhosh Kumar; Kumar, Rapolu Kiran; Sadhu, Pradeep; Punniyamurthy, Tharmalingam Iodobenzene catalyzed C-H amination of N-substituted amidines using m-chloroperbenzoic acid. Organic letters 15(6) (2013) 1334-1337
Space group: P 1 21/c 1
Cell volume: 1457.59
Cell parameters: 14.7051; 12.7004; 7.9795; 90; 102.019; 90;  

COD ID: 1511870
CIF file Formula: - C22 H31 N3 O5 -
Comments: Ramesh, Veera V. E.; Kale, Sangram S.; Kotmale, Amol S.; Gawade, Rupesh L.; Puranik, Vedavati G.; Rajamohanan, P. R.; Sanjayan, Gangadhar J. Carboxamide versus Sulfonamide in Peptide Backbone Folding: A Case Study with a Hetero Foldamer Organic Letters 15(7) (2013) 1504
Space group: P 1 21 1
Cell volume: 2216.1
Cell parameters: 10.2325; 17.7301; 12.7057; 90; 105.974; 90;  

COD ID: 1511871
CIF file Formula: - C21 H31 N3 O7 S -
Comments: Ramesh, Veera V. E.; Kale, Sangram S.; Kotmale, Amol S.; Gawade, Rupesh L.; Puranik, Vedavati G.; Rajamohanan, P. R.; Sanjayan, Gangadhar J. Carboxamide versus Sulfonamide in Peptide Backbone Folding: A Case Study with a Hetero Foldamer Organic Letters 15(7) (2013) 1504
Space group: P 1 21 1
Cell volume: 1233.9
Cell parameters: 8.677; 12.585; 11.434; 90; 98.801; 90;  

COD ID: 1511872
CIF file Formula: - C42 H60 N6 O12 -
Comments: Ramesh, Veera V. E.; Kale, Sangram S.; Kotmale, Amol S.; Gawade, Rupesh L.; Puranik, Vedavati G.; Rajamohanan, P. R.; Sanjayan, Gangadhar J. Carboxamide versus Sulfonamide in Peptide Backbone Folding: A Case Study with a Hetero Foldamer Organic Letters 15(7) (2013) 1504
Space group: P 21 21 21
Cell volume: 4488.3
Cell parameters: 11.3088; 15.8114; 25.101; 90; 90; 90;  

COD ID: 1511873
CIF file Formula: - C36 H50 N6 O11 S2 -
Comments: Ramesh, Veera V. E.; Kale, Sangram S.; Kotmale, Amol S.; Gawade, Rupesh L.; Puranik, Vedavati G.; Rajamohanan, P. R.; Sanjayan, Gangadhar J. Carboxamide versus Sulfonamide in Peptide Backbone Folding: A Case Study with a Hetero Foldamer Organic Letters 15(7) (2013) 1504
Space group: P 21 21 21
Cell volume: 4005.46
Cell parameters: 8.7784; 15.2539; 29.9127; 90; 90; 90;  

COD ID: 1511874
CIF file Formula: - C30 H27 N3 O8 -
Comments: Rajasekaran, T.; Karthik, G.; Sridhar, B.; Subba Reddy, B. V. Dual Behavior of Isatin-Based Cyclic Ketimines with Dicarbomethoxy Carbene: Expedient Synthesis of Highly Functionalized Spirooxindolyl Oxazolidines and Pyrrolines Organic Letters 15(7) (2013) 1512
Space group: C 1 2/c 1
Cell volume: 5630.3
Cell parameters: 22.5171; 13.122; 21.6558; 90; 118.366; 90;  

COD ID: 1511875
CIF file Formula: - C32 H28 N2 O9 -
Comments: Rajasekaran, T.; Karthik, G.; Sridhar, B.; Subba Reddy, B. V. Dual Behavior of Isatin-Based Cyclic Ketimines with Dicarbomethoxy Carbene: Expedient Synthesis of Highly Functionalized Spirooxindolyl Oxazolidines and Pyrrolines Organic Letters 15(7) (2013) 1512
Space group: P 1 21/n 1
Cell volume: 2775.4
Cell parameters: 7.9805; 19.764; 17.862; 90; 99.901; 90;  

COD ID: 1511876
CIF file Formula: - C38 H32 -
Comments: Fix, Aaron G.; Deal, Parker E.; Vonnegut, Chris L.; Rose, Bradley D.; Zakharov, Lev N.; Haley, Michael M. Indeno[2,1-c]fluorene: a new electron-accepting scaffold for organic electronics. Organic letters 15(6) (2013) 1362-1365
Space group: P n a 21
Cell volume: 5561.9
Cell parameters: 29.183; 9.2281; 20.653; 90; 90; 90;  

COD ID: 1511877
CIF file Formula: - C35 H32 Cl N2 O9.5 -
Comments: Jiang, Bo; Wang, Xue; Xu, Hai-Wei; Tu, Man-Su; Tu, Shu-Jiang; Li, Guigen Highly selective domino multicyclizations for forming polycyclic fused acridines and azaheterocyclic skeletons. Organic letters 15(7) (2013) 1540-1543
Space group: P -1
Cell volume: 1635.5
Cell parameters: 10.1026; 12.2338; 13.8484; 102.226; 100.255; 94.067;  

COD ID: 1511878
CIF file Formula: - C31 H28 N2 O6 -
Comments: Jiang, Bo; Wang, Xue; Xu, Hai-Wei; Tu, Man-Su; Tu, Shu-Jiang; Li, Guigen Highly selective domino multicyclizations for forming polycyclic fused acridines and azaheterocyclic skeletons. Organic letters 15(7) (2013) 1540-1543
Space group: P 1 21/n 1
Cell volume: 2664.9
Cell parameters: 16.7024; 8.0751; 19.7821; 90; 92.799; 90;  

COD ID: 1511879
CIF file Formula: - C45 H42 Cl2 N2 O4 S -
Comments: Gao, Jing; Li, Yan; Wang, Zhaohui Synthesis and properties of naphthobisbenzothiophene diimides. Organic letters 15(6) (2013) 1366-1369
Space group: P 1 21/c 1
Cell volume: 3974.5
Cell parameters: 21.024; 11.026; 17.458; 90; 100.86; 90;  

COD ID: 1511880
CIF file Formula: - C52 H46 Cl4 N2 O4 S2 -
Comments: Gao, Jing; Li, Yan; Wang, Zhaohui Synthesis and properties of naphthobisbenzothiophene diimides. Organic letters 15(6) (2013) 1366-1369
Space group: P -1
Cell volume: 2337.9
Cell parameters: 11.967; 13.253; 15.005; 88.88; 79.64; 87.14;  

COD ID: 1511881
CIF file Formula: - C22 H14 O -
Comments: Yamamoto, Kosuke; Okazumi, Mieko; Suemune, Hiroshi; Usui, Kazuteru Synthesis of [5]Helicenes with a Substituent Exclusively on the Interior Side of the Helix by Metal-catalyzed Cycloisomerization. Organic letters 15(8) (2013) 1806-1809
Space group: P b c a
Cell volume: 2863.7
Cell parameters: 9.652; 14.2244; 20.858; 90; 90; 90;  

COD ID: 1511882
CIF file Formula: - C23 H16 O -
Comments: Yamamoto, Kosuke; Okazumi, Mieko; Suemune, Hiroshi; Usui, Kazuteru Synthesis of [5]Helicenes with a Substituent Exclusively on the Interior Side of the Helix by Metal-catalyzed Cycloisomerization. Organic letters 15(8) (2013) 1806-1809
Space group: P 1 21 1
Cell volume: 1530.4
Cell parameters: 7.4251; 11.3441; 18.176; 90; 91.632; 90;  

COD ID: 1511883
CIF file Formula: - C23 H16 O -
Comments: Yamamoto, Kosuke; Okazumi, Mieko; Suemune, Hiroshi; Usui, Kazuteru Synthesis of [5]Helicenes with a Substituent Exclusively on the Interior Side of the Helix by Metal-catalyzed Cycloisomerization. Organic letters 15(8) (2013) 1806-1809
Space group: P 1 21/n 1
Cell volume: 1547.5
Cell parameters: 12.06; 8.342; 15.779; 90; 102.872; 90;  

COD ID: 1511884
CIF file Formula: - C17 H14 Cl N O -
Comments: Ladd, Carolyn L.; Sustac Roman, Daniela; Charette, André B. Silver-promoted, palladium-catalyzed direct arylation of cyclopropanes: facile access to spiro 3,3'-cyclopropyl oxindoles. Organic letters 15(6) (2013) 1350-1353
Space group: P n a 21
Cell volume: 1353.4
Cell parameters: 12.5875; 17.8684; 6.0173; 90; 90; 90;  

COD ID: 1511885
CIF file Formula: - C18 H14 F3 N O -
Comments: Ladd, Carolyn L.; Sustac Roman, Daniela; Charette, André B. Silver-promoted, palladium-catalyzed direct arylation of cyclopropanes: facile access to spiro 3,3'-cyclopropyl oxindoles. Organic letters 15(6) (2013) 1350-1353
Space group: P 1 21/n 1
Cell volume: 1493.53
Cell parameters: 15.2477; 5.8321; 16.7963; 90; 90.669; 90;  

COD ID: 1511886
CIF file Formula: - C22 H14 O5 -
Comments: Maruo, Sayako; Nishio, Kazuyuki; Sasamori, Takahiro; Tokitoh, Norihiro; Kuramochi, Kouji; Tsubaki, Kazunori Biomimetic Synthesis of Zeylanone and Zeylanone Epoxide by Dimerization of 2-Methyl-1,4-naphthoquinone Organic Letters 15(7) (2013) 1556
Space group: P 1 21/a 1
Cell volume: 1666.27
Cell parameters: 12.1557; 11.7061; 12.5509; 90; 111.094; 90;  

COD ID: 1511887
CIF file Formula: - C20 H19 N O3 -
Comments: Sueda, Takuya; Kawada, Arisa; Urashi, Yumi; Teno, Naoki Ag- and Au-Catalyzed Addition of Alcohols to Ynimides: β-Regioselective Carbonylation and Production of Oxazoles Organic Letters 15(7) (2013) 1560
Space group: P 1 21/c 1
Cell volume: 1717.6
Cell parameters: 13.727; 16.832; 7.474; 90; 95.94; 90;  

COD ID: 1511888
CIF file Formula: - C27 H33 Br N2 O4 S -
Comments: Qian, Yu; Zavalij, Peter J.; Hu, Wenhao; Doyle, Michael P. Bicyclic Pyrazolidinone Derivatives from Diastereoselective Catalytic [3 + 3]-Cycloaddition Reactions of Enoldiazoacetates with Azomethine Imines Organic Letters 15(7) (2013) 1564
Space group: P b c a
Cell volume: 5445.4
Cell parameters: 9.5282; 21.6974; 26.3399; 90; 90; 90;  

COD ID: 1511889
CIF file Formula: - C19 H26 O3 -
Comments: Yin, Hong; Luo, Jian-Guang; Shan, Si-Ming; Wang, Xiao-Bing; Luo, Jun; Yang, Ming-Hua; Kong, Ling-Yi Amomaxins A and B, Two Unprecedented Rearranged Labdane Norditerpenoids with a Nine-Membered Ring fromAmomum maximum Organic Letters 15(7) (2013) 1572
Space group: P 21 21 21
Cell volume: 1651.57
Cell parameters: 6.49546; 11.74349; 21.65156; 90; 90; 90;  

COD ID: 1511890
CIF file Formula: - C27 H26 N2 O6 S -
Comments: Rajkumar, Sundaram; Shankland, Kenneth; Goodman, Jonathan M.; Cobb, Alexander J. A. Organocatalytic domino reaction of cyanosulfones: access to complex cyclohexane systems with quaternary carbon centers. Organic letters 15(6) (2013) 1386-1389
Space group: P 21 21 21
Cell volume: 2471.9
Cell parameters: 6.945; 17.2536; 20.6291; 90; 90; 90;  

COD ID: 1511891
CIF file Formula: - C24 H26 N2 O6 S -
Comments: Rajkumar, Sundaram; Shankland, Kenneth; Goodman, Jonathan M.; Cobb, Alexander J. A. Organocatalytic domino reaction of cyanosulfones: access to complex cyclohexane systems with quaternary carbon centers. Organic letters 15(6) (2013) 1386-1389
Space group: P 1 21 1
Cell volume: 1154.24
Cell parameters: 7.5203; 11.5007; 13.5727; 90; 100.496; 90;  

COD ID: 1511892
CIF file Formula: - C31 H49 Au Cl O2 P -
Comments: Obradors, Carla; Leboeuf, David; Aydin, Juhanes; Echavarren, Antonio M. Gold(I)-Catalyzed Macrocyclization of 1,n-Enynes Organic Letters 15(7) (2013) 1576
Space group: P 1 21/c 1
Cell volume: 3107.2
Cell parameters: 9.0124; 20.098; 17.2357; 90; 95.571; 90;  

COD ID: 1511893
CIF file Formula: - C33 H53 Au Cl P -
Comments: Obradors, Carla; Leboeuf, David; Aydin, Juhanes; Echavarren, Antonio M. Gold(I)-Catalyzed Macrocyclization of 1,n-Enynes Organic Letters 15(7) (2013) 1576
Space group: P 1 21/n 1
Cell volume: 3191
Cell parameters: 12.376; 16.1339; 16.0235; 90; 94.179; 90;  

COD ID: 1511894
CIF file Formula: - C20 H20 O -
Comments: Obradors, Carla; Leboeuf, David; Aydin, Juhanes; Echavarren, Antonio M. Gold(I)-Catalyzed Macrocyclization of 1,n-Enynes Organic Letters 15(7) (2013) 1576
Space group: P 1 21/c 1
Cell volume: 1461.13
Cell parameters: 11.8987; 6.0503; 21.0067; 90; 104.945; 90;  

COD ID: 1511895
CIF file Formula: - C10 H12 O3 -
Comments: Newhouse, Timothy R.; Kaib, Philip S. J.; Gross, Andrew W.; Corey, E. J. Versatile Approaches for the Synthesis of Fused-Ring γ-Lactones Utilizing Cyclopropane Intermediates Organic Letters 15(7) (2013) 1591
Space group: P 21 21 21
Cell volume: 1719.64
Cell parameters: 9.7707; 12.1601; 14.4735; 90; 90; 90;  

COD ID: 1511896
CIF file Formula: - C10 H12 O3 -
Comments: Newhouse, Timothy R.; Kaib, Philip S. J.; Gross, Andrew W.; Corey, E. J. Versatile Approaches for the Synthesis of Fused-Ring γ-Lactones Utilizing Cyclopropane Intermediates Organic Letters 15(7) (2013) 1591
Space group: P 1 21/n 1
Cell volume: 852.25
Cell parameters: 6.4751; 19.7106; 6.7241; 90; 96.744; 90;  

COD ID: 1511897
CIF file Formula: - C9 H10 O4 -
Comments: Newhouse, Timothy R.; Kaib, Philip S. J.; Gross, Andrew W.; Corey, E. J. Versatile Approaches for the Synthesis of Fused-Ring γ-Lactones Utilizing Cyclopropane Intermediates Organic Letters 15(7) (2013) 1591
Space group: P 1 21 1
Cell volume: 812
Cell parameters: 11.2375; 6.1253; 11.8492; 90; 95.395; 90;  

COD ID: 1511898
CIF file Formula: - C12 H10 O4 -
Comments: Newhouse, Timothy R.; Kaib, Philip S. J.; Gross, Andrew W.; Corey, E. J. Versatile Approaches for the Synthesis of Fused-Ring γ-Lactones Utilizing Cyclopropane Intermediates Organic Letters 15(7) (2013) 1591
Space group: P 1 21/c 1
Cell volume: 957.89
Cell parameters: 6.4936; 15.2903; 9.7857; 90; 99.641; 90;  

COD ID: 1511899
CIF file Formula: - C24 H28 O5 -
Comments: Ramachandran, P. Veeraraghavan; Nicponski, Daniel; Kim, Bomi Total regio- and diastereocontrol in the aldol reactions of dienolborinates. Organic letters 15(6) (2013) 1398-1401
Space group: P 1 21/n 1
Cell volume: 2138.34
Cell parameters: 7.9353; 17.7258; 15.3911; 90; 98.985; 90;  

COD ID: 1511900
CIF file Formula: - C28 H25 O4 P -
Comments: You, Wei; Li, Yan; Brown, M. Kevin Stereoselective Synthesis of All-Carbon Tetrasubstituted Alkenes from In Situ Generated Ketenes and Organometallic Reagents Organic Letters 15(7) (2013) 1610
Space group: P -1
Cell volume: 1169.7
Cell parameters: 5.7391; 11.1115; 18.7773; 79.448; 83.65; 87.656;  

COD ID: 1511901
CIF file Formula: - C30 H31 N O4 S -
Comments: Kamimura, Akio; So, Masahiro; Ishikawa, Shingo; Uno, Hidemitsu Pd-catalyzed tandem sp2-sp3 coupling reactions of chiral stannolanes: an efficient preparation of optically active tetrahydrobenz[f]isoindoles. Organic letters 15(6) (2013) 1402-1405
Space group: P 1 21 1
Cell volume: 1349.7
Cell parameters: 10.756; 9.1384; 13.732; 90; 90.326; 90;  

COD ID: 1511902
CIF file Formula: - C20 H21 N O3 S -
Comments: Kamimura, Akio; So, Masahiro; Ishikawa, Shingo; Uno, Hidemitsu Pd-catalyzed tandem sp2-sp3 coupling reactions of chiral stannolanes: an efficient preparation of optically active tetrahydrobenz[f]isoindoles. Organic letters 15(6) (2013) 1402-1405
Space group: P 1 21 1
Cell volume: 868.4
Cell parameters: 7.062; 9.027; 13.891; 90; 101.281; 90;  

COD ID: 1511903
CIF file Formula: - C21 H19 Cl2 N3 O6 S3 -
Comments: Yadav, M. Ramu; Rit, Raja K.; Sahoo, Akhila K. Sulfoximine Directed Intermolecular o-C-H Amidation of Arenes with Sulfonyl Azides. Organic letters 15(7) (2013) 1638-1641
Space group: P 1 21/c 1
Cell volume: 2451.1
Cell parameters: 11.5332; 14.9254; 17.4658; 90; 125.386; 90;  

COD ID: 1511904
CIF file Formula: - C12 H14 Cl2 O5 S -
Comments: Kim, Seong-Hwan; Kwon, So Hee; Park, Seon-Hui; Lee, Jae Kyun; Bang, Hea-Son; Nam, Sang-Jip; Kwon, Hak Cheol; Shin, Jongheon; Oh, Dong-Chan Tripartin, a Histone Demethylase Inhibitor from a Bacterium Associated with a Dung Beetle Larva. Organic letters 15(8) (2013) 1834-1837
Space group: P -1
Cell volume: 743.1
Cell parameters: 8.1107; 9.1475; 11.4039; 106.487; 103.627; 104.156;  

COD ID: 1511905
CIF file Formula: - C37 H3 B F20 S6 -
Comments: Bag, Pradip; Tham, Fook S.; Donnadieu, Bruno; Haddon, Robert C. Hexathiophenalenyliums cations: syntheses, structures, and redox chemistry. Organic letters 15(6) (2013) 1198-1201
Space group: P 1 21/c 1
Cell volume: 3504.95
Cell parameters: 10.3266; 21.7894; 16.1875; 90; 105.788; 90;  

COD ID: 1511906
CIF file Formula: - C39 H26 B Cl4 N O2 S6 -
Comments: Bag, Pradip; Tham, Fook S.; Donnadieu, Bruno; Haddon, Robert C. Hexathiophenalenyliums cations: syntheses, structures, and redox chemistry. Organic letters 15(6) (2013) 1198-1201
Space group: P 1 21/n 1
Cell volume: 3762.4
Cell parameters: 13.145; 23.279; 13.4019; 90; 113.447; 90;  

COD ID: 1511907
CIF file Formula: - C16 H22 Br N O5 S -
Comments: Nocquet-Thibault, Sophie; Retailleau, Pascal; Cariou, Kevin; Dodd, Robert H. Iodine(III)-Mediated Umpolung of Bromide Salts for the Ethoxybromination of Enamides. Organic letters 15(8) (2013) 1842-1845
Space group: C 1 c 1
Cell volume: 1915.1
Cell parameters: 8.334; 17.631; 13.162; 90; 98.01; 90;  

COD ID: 1511908
CIF file Formula: - C23 H24 Br N O3 S -
Comments: Nocquet-Thibault, Sophie; Retailleau, Pascal; Cariou, Kevin; Dodd, Robert H. Iodine(III)-Mediated Umpolung of Bromide Salts for the Ethoxybromination of Enamides. Organic letters 15(8) (2013) 1842-1845
Space group: P 1 21/c 1
Cell volume: 4385.6
Cell parameters: 24.175; 15.224; 12.249; 90; 103.389; 90;  

COD ID: 1511909
CIF file Formula: - C20 H19 Br N4 O3 -
Comments: Chen, Xianjie; Chen, Hui; Ji, Xun; Jiang, Hualiang; Yao, Zhu-Jun; Liu, Hong Asymmetric One-Pot Sequential Mannich/Hydroamination Reaction by Organo- and Gold Catalysts: Synthesis of Spiro[pyrrolidin-3,2'-oxindole] Derivatives. Organic letters 15(8) (2013) 1846-1849
Space group: P 1
Cell volume: 1000.04
Cell parameters: 9.2928; 10.4817; 11.6022; 75.347; 66.757; 89.136;  

COD ID: 1511910
CIF file Formula: - C30 H22 Si -
Comments: Oyama, Hiromi; Nakano, Koji; Harada, Takunori; Kuroda, Reiko; Naito, Masanobu; Nobusawa, Kazuyuki; Nozaki, Kyoko Facile Synthetic Route to Highly Luminescent Sila[7]helicene Organic Letters 15(9) (2013) 2104
Space group: P 21 21 21
Cell volume: 2184.5
Cell parameters: 7.199; 14.568; 20.83; 90; 90; 90;  

COD ID: 1511911
CIF file Formula: - C23 H25 N O6 S -
Comments: Tombe, Rihoko; Kurahashi, Takuya; Matsubara, Seijiro Nickel-catalyzed cycloaddition of vinylcyclopropanes to imines. Organic letters 15(8) (2013) 1791-1793
Space group: P -1
Cell volume: 1155.2
Cell parameters: 9.474; 10.2346; 12.862; 67.948; 89.908; 88.178;  

COD ID: 1511912
CIF file Formula: - C20 H25 N O6 -
Comments: Rasapalli, Sivappa; Jarugumilli, Gopalakrishna; Yarrapothu, Gangadhara Rao; Golen, James A.; Rheingold, Arnold L. Studies toward Total Synthesis of Divergolides C and D Organic Letters 15(7) (2013) 1736
Space group: P -1
Cell volume: 941.35
Cell parameters: 9.8884; 9.9615; 11.2817; 86.326; 68.916; 65.816;  

COD ID: 1511913
CIF file Formula: - C21 H27 N O3 S Si -
Comments: Shen, Kun; Han, Xiuling; Lu, Xiyan Cationic Pd(II)-Catalyzed Reductive Cyclization of Alkyne-Tethered Ketones or Aldehydes Using Ethanol as Hydrogen Source Organic Letters 15(7) (2013) 1732
Space group: P 1 21/c 1
Cell volume: 2176.5
Cell parameters: 17.5619; 12.6304; 9.8128; 90; 90.571; 90;  

COD ID: 1511914
CIF file Formula: - C10 H24 F6 O10 Pd S6 -
Comments: Walker, Sarah E.; Boehnke, Julian; Glen, Pauline E.; Levey, Steven; Patrick, Lisa; Jordan-Hore, James A; Lee, Ai-Lan Ligand- and Base-Free Pd(II)-Catalyzed Controlled Switching between Oxidative Heck and Conjugate Addition Reactions. Organic letters 15(8) (2013) 1886-1889
Space group: P -1
Cell volume: 1219.62
Cell parameters: 8.6136; 8.6555; 17.198; 100.351; 95.827; 102.234;  

COD ID: 1511915
CIF file Formula: - C14 H20 N2 O -
Comments: Gan, Wei; Moon, Patrick J.; Clavette, Christian; Das Neves, Nicolas; Markiewicz, Thomas; Toderian, Amy B.; Beauchemin, André M Synthesis and reactivity of unsymmetrical azomethine imines formed using alkene aminocarbonylation. Organic letters 15(8) (2013) 1890-1893
Space group: P -1
Cell volume: 602.5
Cell parameters: 6.484; 9.9421; 9.963; 85.839; 72.127; 80.358;  

COD ID: 1511916
CIF file Formula: - C14 H16 N2 O2 -
Comments: Gan, Wei; Moon, Patrick J.; Clavette, Christian; Das Neves, Nicolas; Markiewicz, Thomas; Toderian, Amy B.; Beauchemin, André M Synthesis and reactivity of unsymmetrical azomethine imines formed using alkene aminocarbonylation. Organic letters 15(8) (2013) 1890-1893
Space group: P 1 21/c 1
Cell volume: 1175.4
Cell parameters: 9.355; 10.436; 12.314; 90; 102.117; 90;  

COD ID: 1511917
CIF file Formula: - C58 H62 Cl2 O18 -
Comments: Suzuki, Takahiro; Miyajima, Yuria; Suzuki, Kaname; Iwakiri, Kanako; Koshimizu, Masaki; Hirai, Go; Sodeoka, Mikiko; Kobayashi, Susumu Unexpected Diels-Alder/Carbonyl-ene Cascade toward the Biomimetic Synthesis of Chloropupukeananin. Organic letters 15(7) (2013) 1748-1751
Space group: P 1 21/n 1
Cell volume: 5375.3
Cell parameters: 13.2073; 19.249; 21.407; 90; 98.997; 90;  

COD ID: 1511918
CIF file Formula: - C16 H11 Cl O7 -
Comments: Suzuki, Takahiro; Miyajima, Yuria; Suzuki, Kaname; Iwakiri, Kanako; Koshimizu, Masaki; Hirai, Go; Sodeoka, Mikiko; Kobayashi, Susumu Unexpected Diels-Alder/Carbonyl-ene Cascade toward the Biomimetic Synthesis of Chloropupukeananin. Organic letters 15(7) (2013) 1748-1751
Space group: C 1 2 1
Cell volume: 2962.7
Cell parameters: 17.187; 7.3498; 23.976; 90; 101.984; 90;  

COD ID: 1511919
CIF file Formula: - C16 H24 O4 -
Comments: Handore, Kishor L.; Reddy, D. Srinivasa A diverted total syntheses of potent cell adhesion inhibitor peribysin e analogues. Organic letters 15(8) (2013) 1894-1897
Space group: P 1 21/c 1
Cell volume: 1465.2
Cell parameters: 6.9099; 18.7473; 11.4333; 90; 98.401; 90;  

COD ID: 1511920
CIF file Formula: - C24 H18 O2 -
Comments: Bhunia, Anup; Patra, Atanu; Puranik, Vedavati G.; Biju, Akkattu T. NHC-Catalyzed Reaction of Enals with Hydroxy Chalcones: Diastereoselective Synthesis of Functionalized Coumarins. Organic letters 15(7) (2013) 1756-1759
Space group: P 1 21/c 1
Cell volume: 3558.1
Cell parameters: 12.9452; 8.9427; 31.393; 90; 101.747; 90;  

COD ID: 1511921
CIF file Formula: - C19 H19 F3 N2 O3 S -
Comments: Senczyszyn, Jemma; Brice, Heloise; Clayden, Jonathan Spirocyclic dihydropyridines by electrophile-induced dearomatizing cyclization of N-alkenyl pyridinecarboxamides. Organic letters 15(8) (2013) 1922-1925
Space group: P 1 21/m 1
Cell volume: 920.8
Cell parameters: 9.4896; 9.4513; 10.805; 90; 108.172; 90;  

COD ID: 1511922
CIF file Formula: - C19 H19 F3 N2 O4 S -
Comments: Senczyszyn, Jemma; Brice, Heloise; Clayden, Jonathan Spirocyclic dihydropyridines by electrophile-induced dearomatizing cyclization of N-alkenyl pyridinecarboxamides. Organic letters 15(8) (2013) 1922-1925
Space group: C 1 2 1
Cell volume: 1876.47
Cell parameters: 23.483; 6.302; 13.176; 90; 105.776; 90;  

COD ID: 1511923
CIF file Formula: - C33 H30 O7 -
Comments: Wang, Sunewang Rixin; Radosevich, Alexander T. Reductive Homocondensation of Benzylidene- and Alkylidenepyruvate Esters by a P(NMe2)3-Mediated Tandem Reaction. Organic letters 15(8) (2013) 1926-1929
Space group: P -1
Cell volume: 1409.6
Cell parameters: 10.6078; 11.7116; 13.0714; 103.006; 107.583; 105.221;  

COD ID: 1511924
CIF file Formula: - C28 H32 O5 -
Comments: Wang, Sunewang Rixin; Radosevich, Alexander T. Reductive Homocondensation of Benzylidene- and Alkylidenepyruvate Esters by a P(NMe2)3-Mediated Tandem Reaction. Organic letters 15(8) (2013) 1926-1929
Space group: P -1
Cell volume: 2593.1
Cell parameters: 10.046; 12.149; 22.277; 77.506; 77.945; 89.988;  

COD ID: 1511925
CIF file Formula: - C17 H26 O3 -
Comments: Schwartz, Brett D.; Matoušová, Eliška; White, Richard; Banwell, Martin G.; Willis, Anthony C. A chemoenzymatic total synthesis of the protoilludane aryl ester (+)-armillarivin. Organic letters 15(8) (2013) 1934-1937
Space group: P 1 21 1
Cell volume: 790.59
Cell parameters: 9.402; 8.096; 10.9386; 90; 108.285; 90;  


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