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COD ID	Links	Formula	Space group	Cell parameters	Cell volume	Bibliography
1516097	CIF	C11 H12 O5	C 1 c 1	10.4253; 12.8651; 8.1381 90; 109.962; 90	1025.92	Barradas, Silvia; Hernández-Torres, Gloria; Urbano, Antonio; Carreño, M Carmen Total synthesis of natural p-quinol cochinchinenone. Organic letters, 2012, 14, 5952-5955
1516099	CIF	C23 H20 N2 O	P 1 21 1	6.4088; 17.279; 8.579 90; 101.67; 90	930.4	Cai, Zhong-Jian; Wang, Shun-Yi; Ji, Shun-Jun CuI/BF3·Et2O cocatalyzed aerobic dehydrogenative reactions of ketones with benzylamines: facile synthesis of substituted imidazoles. Organic letters, 2012, 14, 6068-6071
1516100	CIF	C22 H18 N2	P 1 21/n 1	9.768; 11.392; 15.15 90; 97.216; 90	1672.5	Cai, Zhong-Jian; Wang, Shun-Yi; Ji, Shun-Jun CuI/BF3·Et2O cocatalyzed aerobic dehydrogenative reactions of ketones with benzylamines: facile synthesis of substituted imidazoles. Organic letters, 2012, 14, 6068-6071
1516101	CIF	C20 H18 O5	P 1 21/n 1	16.4332; 5.5136; 18.3321 90; 106.549; 90	1592.2	Truong, Phong; Shanahan, Charles S.; Doyle, Michael P. Divergent stereocontrol of acid catalyzed intramolecular aldol reactions of 2,3,7-triketoesters: synthesis of highly functionalized cyclopentanones. Organic letters, 2012, 14, 3608-3611
1516103	CIF	C18 H24 N2 O	P b c n	18.945; 8.6958; 20.3655 90; 90; 90	3355.1	Zhao, Shu-Bin; Bilodeau, Eric; Lemieux, Valérie; Beauchemin, André M Hydrogen bonding directed intermolecular Cope-type hydroamination of alkenes. Organic letters, 2012, 14, 5082-5085
1516104	CIF	C30 H28 Cl N O4 S	P -1	10.0293; 16.6704; 17.4029 70.567; 76.603; 78.855	2647.7	Hu, Jian; Tian, Bing; Wu, Xinyan; Tong, Xiaofeng Tertiary amine-triggered cascade S(N)2/cycloaddition: an efficient construction of complex azaheterocycles under mild conditions. Organic letters, 2012, 14, 5074-5077
1516105	CIF	C22 H26 N2 O6	P 1 21/n 1	11.618; 12.024; 16.15 90; 110.574; 90	2112.2	Villa, Reymundo A.; Xu, Qihai; Kwon, Ohyun Total synthesis of (±)-hirsutine: application of phosphine-catalyzed imine-allene [4 + 2] annulation. Organic letters, 2012, 14, 4634-4637
1516106	CIF	C13 H15 N O	C 1 2/c 1	14.0539; 11.358; 13.4342 90; 101.523; 90	2101.2	Li, Xiao-Jing; Qiao, Jin-Bao; Sun, Jian; Li, Xue-Qiang; Gu, Peiming Intramolecular Schmidt Reaction of Acyl Chlorides with Alkyl Azides: Capture of N-Acyliminium Ion Intermediates with Aromatic rings. Organic letters, 2014, 16, 2865-2867
1516107	CIF	C19 H33 N O5 S Si	P -1	11.8101; 12.7217; 16.841 72.829; 75.377; 75.493	2296.4	Adams, Christopher S.; Grigg, R. David; Schomaker, Jennifer M. Complete stereodivergence in the synthesis of 2-amino-1,3-diols from allenes Chemical Science, 2014, 5, 3046
1516108	CIF	C20 H31 N O6 S Si	P -1	7.248; 12.231; 12.439 87.85; 81.98; 89.975	1091.2	Adams, Christopher S.; Grigg, R. David; Schomaker, Jennifer M. Complete stereodivergence in the synthesis of 2-amino-1,3-diols from allenes Chemical Science, 2014, 5, 3046
1516109	CIF	C20 H31 N O6 S Si	P 1 21/n 1	6.9812; 22.209; 14.9476 90; 96.282; 90	2303.6	Adams, Christopher S.; Grigg, R. David; Schomaker, Jennifer M. Complete stereodivergence in the synthesis of 2-amino-1,3-diols from allenes Chemical Science, 2014, 5, 3046
1516110	CIF	Cr O2	P 42/m n m	4.41; 4.41; 2.91 90; 90; 90	56.594	Glemser, O.; Hauschild, U.; Truepel, F. Ueber Chromoxyde zwischen Cr2 O3 und Cr O3 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1954, 277, 113-208
1516111	CIF	C46 H48 N2 O Zr	P -1	11.0188; 13.6909; 15.087 64.169; 68.942; 75.522	1899.9	Klet, Rachel C.; Theriault, Curt N.; Klosin, Jerzy; Labinger, Jay A.; Bercaw, John E. Investigations into Asymmetric Post-Metallocene Group 4 Complexes for the Synthesis of Highly Regioirregular Polypropylene Macromolecules, 2014, 47, 3317
1516112	CIF	C36.83 H46.32 Cl2.34 N2 O Ti	P -1	10.387; 15.918; 21.74 76.406; 79.036; 87.948	3429.9	Klet, Rachel C.; Theriault, Curt N.; Klosin, Jerzy; Labinger, Jay A.; Bercaw, John E. Investigations into Asymmetric Post-Metallocene Group 4 Complexes for the Synthesis of Highly Regioirregular Polypropylene Macromolecules, 2014, 47, 3317
1516113	CIF	C11 H12 F N O2	P 1 21/n 1	11.272; 5.8049; 16.158 90; 108.477; 90	1002.8	Lu, Deng-Fu; Liu, Guan-Sai; Zhu, Cheng-Liang; Yuan, Bo; Xu, Hao Iron(II)-Catalyzed Intramolecular Olefin Aminofluorination. Organic letters, 2014, 16, 2912-2915
1516114	CIF	C72 H23 N O8	P -1	10.128; 10.497; 20.664 85.27; 77.477; 78.869	2102.4	Hashikawa, Yoshifumi; Murata, Michihisa; Wakamiya, Atsushi; Murata, Yasujiro Synthesis of open-cage ketolactam derivatives of fullerene c60 encapsulating a hydrogen molecule. Organic letters, 2014, 16, 2970-2973
1516115	CIF	C23 H28 N2 O3	P 1 21 1	8.5089; 9.1505; 12.5241 90; 96.049; 90	969.71	Low, Yun-Yee; Gan, Chew-Yan; Kam, Toh-Seok Andransinine: an unusual case of spontaneous resolution in an indole alkaloid derivative. Journal of natural products, 2014, 77, 1532-1535
1516116	CIF	C24 H32 N2 O4	P n a 21	8.6828; 21.4082; 11.2277 90; 90; 90	2087.04	Low, Yun-Yee; Gan, Chew-Yan; Kam, Toh-Seok Andransinine: an unusual case of spontaneous resolution in an indole alkaloid derivative. Journal of natural products, 2014, 77, 1532-1535
1516117	CIF	C23 H28 N2 O3	P 1 21 1	8.4914; 9.1548; 12.4788 90; 95.838; 90	965	Low, Yun-Yee; Gan, Chew-Yan; Kam, Toh-Seok Andransinine: an unusual case of spontaneous resolution in an indole alkaloid derivative. Journal of natural products, 2014, 77, 1532-1535
1516118	CIF	C23 H28 N2 O3	C 1 2/c 1	39.082; 8.588; 24.128 90; 105.802; 90	7792.2	Low, Yun-Yee; Gan, Chew-Yan; Kam, Toh-Seok Andransinine: an unusual case of spontaneous resolution in an indole alkaloid derivative. Journal of natural products, 2014, 77, 1532-1535
1516119	CIF	C23 H28 N2 O3	P 1 21 1	8.5096; 9.1538; 12.5333 90; 96.03; 90	970.882	Low, Yun-Yee; Gan, Chew-Yan; Kam, Toh-Seok Andransinine: an unusual case of spontaneous resolution in an indole alkaloid derivative. Journal of natural products, 2014, 77, 1532-1535
1516120	CIF	B H6 N2 Na	P 1 21/c 1	4.97456; 7.9607; 10.2456 90; 115.166; 90	367.22	Chua, Yong Shen; Pei, Qijun; Ju, Xiaohua; Zhou, Wei; Udovic, Terrence J.; Wu, Guotao; Xiong, Zhitao; Chen, Ping; Wu, Hui Alkali Metal Hydride Modification on Hydrazine Borane for Improved Dehydrogenation The Journal of Physical Chemistry C, 2014, 118, 11244
1516121	CIF	C15 H11 N O3	P -1	5.502; 21.052; 21.138 88.513; 82.982; 85.62	2423	Wu, Xia; Gao, Qinghe; Liu, Shan; Wu, Anxin I2-Catalyzed Oxidative Cross-Coupling of Methyl Ketones and Benzamidines Hydrochloride: A Facile Access to α-Ketoimides. Organic letters, 2014, 16, 2888-2891
1516122	CIF	C58 H36 O4	P -1	12.469; 14.085; 14.436 114.938; 101.497; 98.755	2171.7	Wackerly, Jay Wm; Zhang, Mengfei; Nodder, Stephen T.; Carlin, Stephen M.; Katz, Jeffrey L. Single Step Synthesis of Acetylene-Substituted Oxacalix[4]arenes. Organic letters, 2014, 16, 2920-2922
1516123	CIF	C21 H20 F3 N O2	P -1	6.186; 9.6029; 16.4251 77.495; 80.955; 87.557	940.68	Guo, Chun-Xiao; Zhang, Wen-Zhen; Liu, Si; Lu, Xiao-Bing Cu(i)-catalyzed chemical fixation of CO2 with 2-alkynylaniline into 4-hydroxyquinolin-2(1H)-one Catalysis Science & Technology, 2014, 4, 1570
1516124	CIF	C21 H23 N O2	P -1	7.7051; 10.8189; 11.1726 75.918; 86.59; 87.802	901.49	Guo, Chun-Xiao; Zhang, Wen-Zhen; Liu, Si; Lu, Xiao-Bing Cu(i)-catalyzed chemical fixation of CO2 with 2-alkynylaniline into 4-hydroxyquinolin-2(1H)-one Catalysis Science & Technology, 2014, 4, 1570
1516125	CIF	C31 H39 N5 O8 S2 Zn	P 1 21/c 1	21.5392; 14.9764; 11.0367 90; 102.006; 90	3482.3	Martín, C.; Whiteoak, C. J.; Martin, E.; Martínez Belmonte, M.; Escudero-Adán, E. C.; Kleij, A. W. Easily accessible bifunctional Zn(salpyr) catalysts for the formation of organic carbonates Catalysis Science & Technology, 2014, 4, 1615
1516126	CIF	C30 H40 I N3 O4 Zn	P 1 21/c 1	20.7881; 19.8405; 7.4304 90; 97.665; 90	3037.3	Martín, C.; Whiteoak, C. J.; Martin, E.; Martínez Belmonte, M.; Escudero-Adán, E. C.; Kleij, A. W. Easily accessible bifunctional Zn(salpyr) catalysts for the formation of organic carbonates Catalysis Science & Technology, 2014, 4, 1615
1516127	CIF	C46 H64 Cl6 N6 O7 Zn	P -1	11.5808; 12.8843; 18.9944 78.363; 87.683; 87.378	2771.6	Martín, C.; Whiteoak, C. J.; Martin, E.; Martínez Belmonte, M.; Escudero-Adán, E. C.; Kleij, A. W. Easily accessible bifunctional Zn(salpyr) catalysts for the formation of organic carbonates Catalysis Science & Technology, 2014, 4, 1615
1516128	CIF	C92 H126 Cl3 Cr2 Li N2 O5	P 31 2 1	18.945; 18.945; 25.39 90; 90; 120	7892	Chen, Hua; Dawe, Louise N.; Kozak, Christopher M. Chromium(iii) amine-bis(phenolate) complexes as catalysts for copolymerization of cyclohexene oxide and CO2 Catalysis Science & Technology, 2014, 4, 1547
1516129	CIF	C37 H34 N2 O6 S2	P 1 21/c 1	17.511; 10.814; 23.711 90; 130.536; 90	3412.4	Nayak, Sanatan; Ghosh, Nayan; Sahoo, Akhila K. Access to Cyclobutene-Fused Azepines through Au-Catalyzed Cycloisomerization of Stable Alkyne Tethered Ketene N,N-Acetals. Organic letters, 2014, 16, 2996-2999
1516130	CIF	C39 H32 N4 O6 S2	A b a 2	15.0516; 28.646; 18.0316 90; 90; 90	7774.7	Nayak, Sanatan; Ghosh, Nayan; Sahoo, Akhila K. Access to Cyclobutene-Fused Azepines through Au-Catalyzed Cycloisomerization of Stable Alkyne Tethered Ketene N,N-Acetals. Organic letters, 2014, 16, 2996-2999
1516131	CIF	C39 H38 N2 O8 S2	P -1	8.7849; 12.6893; 16.278 85.618; 79.626; 82.116	1765.6	Nayak, Sanatan; Ghosh, Nayan; Sahoo, Akhila K. Access to Cyclobutene-Fused Azepines through Au-Catalyzed Cycloisomerization of Stable Alkyne Tethered Ketene N,N-Acetals. Organic letters, 2014, 16, 2996-2999
1516132	CIF	C19 H14 Br N2 O0.5 S	C 1 2/c 1	11.406; 14.522; 20.97 90; 104.457; 90	3363.4	Ravi, Chitrakar; Chandra Mohan, Darapaneni; Adimurthy, Subbarayappa N-chlorosuccinimide-promoted regioselective sulfenylation of imidazoheterocycles at room temperature. Organic letters, 2014, 16, 2978-2981
1516133	CIF	C20 H4 Br4 Cl4	P c a 21	7.4442; 27.2175; 19.194 90; 90; 90	3888.9	Zagranyarski, Yulian; Chen, Long; Jänsch, Daniel; Gessner, Thomas; Li, Chen; Müllen, Klaus Toward perylene dyes by the hundsdiecker reaction. Organic letters, 2014, 16, 2814-2817
1516134	CIF	C19 H27 N O2 S Si	P 1 21 1	9.154; 16.606; 13.184 90; 91.919; 90	2003	Mita, Tsuyoshi; Sugawara, Masumi; Saito, Keisuke; Sato, Yoshihiro Catalytic Enantioselective Silylation of N-Sulfonylimines: Asymmetric Synthesis of α-Amino Acids from CO2 via Stereospecific Carboxylation of α-Amino Silanes. Organic letters, 2014, 16, 3028-3031
1516135	CIF	C14 H25 N O2 S Sn	P 1 21 1	11.1188; 10.5531; 15.6491 90; 110.738; 90	1717.26	Mita, Tsuyoshi; Sugawara, Masumi; Saito, Keisuke; Sato, Yoshihiro Catalytic Enantioselective Silylation of N-Sulfonylimines: Asymmetric Synthesis of α-Amino Acids from CO2 via Stereospecific Carboxylation of α-Amino Silanes. Organic letters, 2014, 16, 3028-3031
1516136	CIF	C78 H64 Cl2 O2 P4 Rh2	C 1 2/m 1	29.9133; 18.7802; 19.2461 90; 114.861; 90	9810.1	Meißner, Antje; Alberico, Elisabetta; Drexler, Hans-Joachim; Baumann, Wolfgang; Heller, Detlef Rhodium diphosphine complexes: a case study for catalyst activation and deactivation Catal. Sci. Technol., 2014, 4, 3409
1516137	CIF	C50 H47 Cl O2 P2 Rh	P -1	10.1367; 10.1518; 21.075 93.865; 102.017; 108.917	1985.2	Meißner, Antje; Alberico, Elisabetta; Drexler, Hans-Joachim; Baumann, Wolfgang; Heller, Detlef Rhodium diphosphine complexes: a case study for catalyst activation and deactivation Catal. Sci. Technol., 2014, 4, 3409
1516138	CIF	C20 H25 Cl F3 Ir N4 O3 S	P 1 21/n 1	8.92686; 16.30625; 16.1629 90; 99.0197; 90	2323.64	Woods, James A.; Lalrempuia, Ralte; Petronilho, Ana; McDaniel, Neal D.; Müller-Bunz, Helge; Albrecht, Martin; Bernhard, Stefan Carbene iridium complexes for efficient water oxidation: scope and mechanistic insights Energy & Environmental Science, 2014, 7, 2316
1516139	CIF	C26 H32 Cl F6 Ir N4 O0.5 P	P 1 21 1	8.6499; 30.9257; 11.9013 90; 95.343; 90	3169.82	Woods, James A.; Lalrempuia, Ralte; Petronilho, Ana; McDaniel, Neal D.; Müller-Bunz, Helge; Albrecht, Martin; Bernhard, Stefan Carbene iridium complexes for efficient water oxidation: scope and mechanistic insights Energy & Environmental Science, 2014, 7, 2316
1516140	CIF	C48 H47.38 B Cl Ir N4 O0.19	P b c a	16.815; 17.575; 28.6833 90; 90; 90	8476.59	Woods, James A.; Lalrempuia, Ralte; Petronilho, Ana; McDaniel, Neal D.; Müller-Bunz, Helge; Albrecht, Martin; Bernhard, Stefan Carbene iridium complexes for efficient water oxidation: scope and mechanistic insights Energy & Environmental Science, 2014, 7, 2316
1516141	CIF	C20 H25 Cl F3 Ir N4 O3 S	P -1	8.1397; 12.0802; 12.1711 93.308; 98.055; 96.258	1174.66	Woods, James A.; Lalrempuia, Ralte; Petronilho, Ana; McDaniel, Neal D.; Müller-Bunz, Helge; Albrecht, Martin; Bernhard, Stefan Carbene iridium complexes for efficient water oxidation: scope and mechanistic insights Energy & Environmental Science, 2014, 7, 2316
1516142	CIF	C24 H30 F6 Ir N5 O6 S2	P -1	9.9198; 12.2357; 14.1911 88.964; 72.328; 67.558	1507.5	Woods, James A.; Lalrempuia, Ralte; Petronilho, Ana; McDaniel, Neal D.; Müller-Bunz, Helge; Albrecht, Martin; Bernhard, Stefan Carbene iridium complexes for efficient water oxidation: scope and mechanistic insights Energy & Environmental Science, 2014, 7, 2316
1516143	CIF	C32 H38 F6 Ir N5 O7 S2	P 1 21/c 1	24.2752; 11.5628; 27.0877 90; 101.757; 90	7443.72	Woods, James A.; Lalrempuia, Ralte; Petronilho, Ana; McDaniel, Neal D.; Müller-Bunz, Helge; Albrecht, Martin; Bernhard, Stefan Carbene iridium complexes for efficient water oxidation: scope and mechanistic insights Energy & Environmental Science, 2014, 7, 2316
1516144	CIF	C28 H30 F6 Ir N5 O6 S2	P 1 21/n 1	15.4068; 12.8634; 17.5263 90; 103.099; 90	3383.05	Woods, James A.; Lalrempuia, Ralte; Petronilho, Ana; McDaniel, Neal D.; Müller-Bunz, Helge; Albrecht, Martin; Bernhard, Stefan Carbene iridium complexes for efficient water oxidation: scope and mechanistic insights Energy & Environmental Science, 2014, 7, 2316
1516145	CIF	C25 H27 Cl F3 Ir N4 O3 S	P 1 21/n 1	12.3897; 16.3148; 14.676 90; 114.395; 90	2701.69	Woods, James A.; Lalrempuia, Ralte; Petronilho, Ana; McDaniel, Neal D.; Müller-Bunz, Helge; Albrecht, Martin; Bernhard, Stefan Carbene iridium complexes for efficient water oxidation: scope and mechanistic insights Energy & Environmental Science, 2014, 7, 2316
1516146	CIF	C30 H35 F6 Ir N8 O6 S2	P 1 21/c 1	17.0427; 12.0904; 18.0154 90; 108.807; 90	3513.9	Woods, James A.; Lalrempuia, Ralte; Petronilho, Ana; McDaniel, Neal D.; Müller-Bunz, Helge; Albrecht, Martin; Bernhard, Stefan Carbene iridium complexes for efficient water oxidation: scope and mechanistic insights Energy & Environmental Science, 2014, 7, 2316
1516147	CIF	C7 H9 Br O2	P 32	17.8119; 17.8119; 6.2589 90; 90; 120	1719.7	Zipfel, Hannes F.; Carreira, Erick M. An efficient synthesis strategy to the core structure of 6-5-6-5-6-membered epipolythiodiketopiperazines. Organic letters, 2014, 16, 2854-2857
1516148	CIF	C21 H24 N2 O4 S	P 1 21 1	11.639; 5.5765; 15.5447 90; 106.278; 90	968.48	Zipfel, Hannes F.; Carreira, Erick M. An efficient synthesis strategy to the core structure of 6-5-6-5-6-membered epipolythiodiketopiperazines. Organic letters, 2014, 16, 2854-2857
1516149	CIF	C32.5 H31 Cl N2 O6	C 1 2 1	43.265; 15.0547; 10.2366 90; 93.976; 90	6651.5	Zipfel, Hannes F.; Carreira, Erick M. An efficient synthesis strategy to the core structure of 6-5-6-5-6-membered epipolythiodiketopiperazines. Organic letters, 2014, 16, 2854-2857
1516150	CIF	C23 H24 O3 S	P 21 21 21	6.5465; 7.844; 38.945 90; 90; 90	1999.9	Ohmatsu, Kohsuke; Hara, Yoshiyuki; Ooi, Takashi In situ generation of ion-paired chiral ligands: rapid identification of the optimal ligand for palladium-catalyzed asymmetric allylation Chemical Science, 2014, 5, 3645
1516151	CIF	C46 H46 Mg O4	C 1 2/c 1	19.0981; 9.6221; 22.024 90; 109.389; 90	3817.7	Wang, Yang; Liu, Bo; Wang, Xue; Zhao, Wei; Liu, Dongtao; Liu, Xinli; Cui, Dongmei Immortal ring-opening polymerization of ε-caprolactone by a neat magnesium catalyst system: an approach to obtain block and amphiphilic star polymers in situ Polymer Chemistry, 2014, 5, 4580
1516152	CIF	C16 H13 Br O3	P 1 21 1	7.952; 12.184; 14.721 90; 92.596; 90	1424.8	Fu, Liangbing; Wang, Hengbin; Davies, Huw M. L. Role of Ortho-Substituents on Rhodium-Catalyzed Asymmetric Synthesis of β-Lactones by Intramolecular C-H Insertions of Aryldiazoacetates. Organic letters, 2014, 16, 3036-3039
1516153	CIF	C11 H11 Br O3	P 21 21 21	12.06; 12.066; 14.641 90; 90; 90	2130.5	Fu, Liangbing; Wang, Hengbin; Davies, Huw M. L. Role of Ortho-Substituents on Rhodium-Catalyzed Asymmetric Synthesis of β-Lactones by Intramolecular C-H Insertions of Aryldiazoacetates. Organic letters, 2014, 16, 3036-3039
1516154	CIF	C10 H9 Br O3	P 1 21 1	6.2085; 5.3383; 15.239 90; 95.715; 90	502.6	Fu, Liangbing; Wang, Hengbin; Davies, Huw M. L. Role of Ortho-Substituents on Rhodium-Catalyzed Asymmetric Synthesis of β-Lactones by Intramolecular C-H Insertions of Aryldiazoacetates. Organic letters, 2014, 16, 3036-3039
1516155	CIF	C24 H46 Al4 N2 O2	P -1	7.361; 10.0951; 10.6561 103.037; 95.097; 96.205	761.67	Li, Yuanzhuo; Zhao, Ke-Qing; Elsegood, Mark R. J.; Prior, Timothy J.; Sun, Xinsen; Mo, Shanyan; Redshaw, Carl Organoaluminium complexes of ortho-, meta-, para-anisidines: synthesis, structural studies and ROP of ε-caprolactone (and rac-lactide) Catalysis Science & Technology, 2014, 4, 3025
1516156	CIF	C22 H38 Al4 N2 O2	P 1 21/n 1	8.751; 15.3173; 10.1026 90; 90.1329; 90	1354.17	Li, Yuanzhuo; Zhao, Ke-Qing; Elsegood, Mark R. J.; Prior, Timothy J.; Sun, Xinsen; Mo, Shanyan; Redshaw, Carl Organoaluminium complexes of ortho-, meta-, para-anisidines: synthesis, structural studies and ROP of ε-caprolactone (and rac-lactide) Catalysis Science & Technology, 2014, 4, 3025
1516157	CIF	C31 H54 Al4 N2 O2	P 1 21/n 1	7.1092; 21.245; 12.33 90; 92.839; 90	1859.98	Li, Yuanzhuo; Zhao, Ke-Qing; Elsegood, Mark R. J.; Prior, Timothy J.; Sun, Xinsen; Mo, Shanyan; Redshaw, Carl Organoaluminium complexes of ortho-, meta-, para-anisidines: synthesis, structural studies and ROP of ε-caprolactone (and rac-lactide) Catalysis Science & Technology, 2014, 4, 3025
1516158	CIF	C24 H10 Br2 F8 N4	C 1 2/c 1	28.893; 5.2362; 17.648 90; 118.696; 90	2342	Bushuyev, Oleksandr S.; Corkery, T. Christopher; Barrett, Christopher J.; Friščić, Tomislav Photo-mechanical azobenzene cocrystals and in situ X-ray diffraction monitoring of their optically-induced crystal-to-crystal isomerisation Chemical Science, 2014, 5, 3158
1516159	CIF	C22 H8 Br2 F8 N6	C 1 2/c 1	36.953; 5.2778; 11.5441 90; 90.529; 90	2251.4	Bushuyev, Oleksandr S.; Corkery, T. Christopher; Barrett, Christopher J.; Friščić, Tomislav Photo-mechanical azobenzene cocrystals and in situ X-ray diffraction monitoring of their optically-induced crystal-to-crystal isomerisation Chemical Science, 2014, 5, 3158
1516160	CIF	C24 H10 F8 I2 N4	C 1 2/c 1	29.154; 5.2244; 18.283 90; 120.726; 90	2393.8	Bushuyev, Oleksandr S.; Corkery, T. Christopher; Barrett, Christopher J.; Friščić, Tomislav Photo-mechanical azobenzene cocrystals and in situ X-ray diffraction monitoring of their optically-induced crystal-to-crystal isomerisation Chemical Science, 2014, 5, 3158
1516161	CIF	C22 H8 F8 I2 N6	C 1 2/c 1	28.722; 5.1901; 18.22 90; 120.623; 90	2337.3	Bushuyev, Oleksandr S.; Corkery, T. Christopher; Barrett, Christopher J.; Friščić, Tomislav Photo-mechanical azobenzene cocrystals and in situ X-ray diffraction monitoring of their optically-induced crystal-to-crystal isomerisation Chemical Science, 2014, 5, 3158
1516162	CIF	C24 H10 F8 I2 N4	C 1 2/c 1	40.225; 5.8436; 25.726 90; 123.647; 90	5034	Bushuyev, Oleksandr S.; Corkery, T. Christopher; Barrett, Christopher J.; Friščić, Tomislav Photo-mechanical azobenzene cocrystals and in situ X-ray diffraction monitoring of their optically-induced crystal-to-crystal isomerisation Chemical Science, 2014, 5, 3158
1516163	CIF	C24 H10 Br2 F8 N4	P -1	6.0828; 8.3133; 12.157 70.137; 84.722; 79.999	569.04	Bushuyev, Oleksandr S.; Corkery, T. Christopher; Barrett, Christopher J.; Friščić, Tomislav Photo-mechanical azobenzene cocrystals and in situ X-ray diffraction monitoring of their optically-induced crystal-to-crystal isomerisation Chemical Science, 2014, 5, 3158
1516164	CIF	C22 H8 Br2 F8 N6	P -1	5.9081; 8.3193; 23.198 94.956; 93.481; 95.848	1127.25	Bushuyev, Oleksandr S.; Corkery, T. Christopher; Barrett, Christopher J.; Friščić, Tomislav Photo-mechanical azobenzene cocrystals and in situ X-ray diffraction monitoring of their optically-induced crystal-to-crystal isomerisation Chemical Science, 2014, 5, 3158
1516165	CIF	C24 H10 F8 I2 N4	P -1	5.8317; 8.5364; 23.47 95.753; 96.748; 95.828	1146.8	Bushuyev, Oleksandr S.; Corkery, T. Christopher; Barrett, Christopher J.; Friščić, Tomislav Photo-mechanical azobenzene cocrystals and in situ X-ray diffraction monitoring of their optically-induced crystal-to-crystal isomerisation Chemical Science, 2014, 5, 3158
1516166	CIF	C22 H8 F8 I2 N6	P -1	5.8475; 8.445; 23.132 94.99; 95.779; 96.339	1124	Bushuyev, Oleksandr S.; Corkery, T. Christopher; Barrett, Christopher J.; Friščić, Tomislav Photo-mechanical azobenzene cocrystals and in situ X-ray diffraction monitoring of their optically-induced crystal-to-crystal isomerisation Chemical Science, 2014, 5, 3158
1516167	CIF	C24 H10 F8 I2 N4	C 1 2/c 1	11.097; 8.2444; 26.821 90; 91.457; 90	2453	Bushuyev, Oleksandr S.; Corkery, T. Christopher; Barrett, Christopher J.; Friščić, Tomislav Photo-mechanical azobenzene cocrystals and in situ X-ray diffraction monitoring of their optically-induced crystal-to-crystal isomerisation Chemical Science, 2014, 5, 3158
1516168	CIF	C12 H14 N2 O5	P 1 21/n 1	18.385; 5.62; 12.034 90; 96.57; 90	1235.2	Amit, A.; Mester, L.; Klewe, B.; Furberg, S. The Crystal Structure of Serotonin Hydrogen Oxalate Acta Chemica Scandinavica A, 1978, 267-270
1516169	CIF	C10 H8 B2 F4 N4	C 1 2/m 1	12.2662; 6.8136; 7.0499 90; 105.816; 90	566.9	Yu, Changjiang; Jiao, Lijuan; Zhang, Ping; Feng, Zeya; Cheng, Chi; Wei, Yun; Mu, Xiaolong; Hao, Erhong Highly Fluorescent BF2 Complexes of Hydrazine-Schiff Base Linked Bispyrrole. Organic letters, 2014, 16, 3048-3051
1516170	CIF	C14 H16 B2 F4 N4	P 1 21/c 1	9.2147; 12.1024; 7.3238 90; 108.772; 90	773.3	Yu, Changjiang; Jiao, Lijuan; Zhang, Ping; Feng, Zeya; Cheng, Chi; Wei, Yun; Mu, Xiaolong; Hao, Erhong Highly Fluorescent BF2 Complexes of Hydrazine-Schiff Base Linked Bispyrrole. Organic letters, 2014, 16, 3048-3051
1516171	CIF	C18 H24 B2 F4 N4	P 1 21/n 1	9.676; 13.659; 15.313 90; 103.66; 90	1966.6	Yu, Changjiang; Jiao, Lijuan; Zhang, Ping; Feng, Zeya; Cheng, Chi; Wei, Yun; Mu, Xiaolong; Hao, Erhong Highly Fluorescent BF2 Complexes of Hydrazine-Schiff Base Linked Bispyrrole. Organic letters, 2014, 16, 3048-3051
1516172	CIF	C10 H9 B F2 N4	P b c a	12.306; 9.48; 18.766 90; 90; 90	2189.3	Yu, Changjiang; Jiao, Lijuan; Zhang, Ping; Feng, Zeya; Cheng, Chi; Wei, Yun; Mu, Xiaolong; Hao, Erhong Highly Fluorescent BF2 Complexes of Hydrazine-Schiff Base Linked Bispyrrole. Organic letters, 2014, 16, 3048-3051
1516173	CIF	C14 H17 B F2 N4	P 1 21/c 1	8.058; 21.225; 8.7995 90; 102.217; 90	1470.9	Yu, Changjiang; Jiao, Lijuan; Zhang, Ping; Feng, Zeya; Cheng, Chi; Wei, Yun; Mu, Xiaolong; Hao, Erhong Highly Fluorescent BF2 Complexes of Hydrazine-Schiff Base Linked Bispyrrole. Organic letters, 2014, 16, 3048-3051
1516174	CIF	C26 H22 F6 N4 O4	C 1 2/c 1	29.895; 12.375; 15.464 90; 107.104; 90	5468	Zhang, Fa-Guang; Wei, Yi; Yi, Yu-Ping; Nie, Jing; Ma, Jun-An Regioselective Cycloaddition of Trifluorodiazoethane with Electron-Deficient Allenic Esters and Ketones: Access to CF3-Substituted Pyrazolines and Pyrazoles. Organic letters, 2014, 16, 3122-3125
1516175	CIF	C15 H18 N2 O3	P 1 21/n 1	9.4197; 8.3092; 17.992 90; 98.7; 90	1392	Cai, Shangjun; Chen, Chao; Shao, Peng; Xi, Chanjuan Rh(III)-Catalyzed Cascade Oxidative Olefination/Cyclization of Picolinamides and Alkenes via C-H Activation. Organic letters, 2014, 16, 3142-3145
1516176	CIF	C14 H16 N2 O3	P 1 21/c 1	7.5875; 21.568; 8.3245 90; 110.26; 90	1278	Cai, Shangjun; Chen, Chao; Shao, Peng; Xi, Chanjuan Rh(III)-Catalyzed Cascade Oxidative Olefination/Cyclization of Picolinamides and Alkenes via C-H Activation. Organic letters, 2014, 16, 3142-3145
1516177	CIF	C6 Cl4 O2	P 1 21/n 1	26.01; 8.1572; 28.795 90; 113.518; 90	5601.9	Rosokha, S. V.; Dibrov, S. M.; Rosokha, T. Y.; Kochi, J. K. Electronic structures of intermolecular charge-transfer states in fast electron transfers with tetrathiafulvalene donor. Thermal and photoactivation of [2 + 4] cycloaddition to o-chloranil acceptor. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2006, 5, 914-924
1516178	CIF	C6 Cl4 O2	P 1 21/c 1	6.0592; 16.3472; 8.1183 90; 94.249; 90	801.92	Rosokha, S. V.; Dibrov, S. M.; Rosokha, T. Y.; Kochi, J. K. Electronic structures of intermolecular charge-transfer states in fast electron transfers with tetrathiafulvalene donor. Thermal and photoactivation of [2 + 4] cycloaddition to o-chloranil acceptor. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2006, 5, 914-924
1516179	CIF	C16 H14 Cl4 O2	P 1 21/n 1	9.1022; 13.8161; 13.3595 90; 100.202; 90	1653.49	Rosokha, S. V.; Dibrov, S. M.; Rosokha, T. Y.; Kochi, J. K. Electronic structures of intermolecular charge-transfer states in fast electron transfers with tetrathiafulvalene donor. Thermal and photoactivation of [2 + 4] cycloaddition to o-chloranil acceptor. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2006, 5, 914-924
1516180	CIF	C60 H30 Cl8 O4	P 1 c 1	8.3157; 38.967; 14.2436 90; 91.718; 90	4613.4	Rosokha, S. V.; Dibrov, S. M.; Rosokha, T. Y.; Kochi, J. K. Electronic structures of intermolecular charge-transfer states in fast electron transfers with tetrathiafulvalene donor. Thermal and photoactivation of [2 + 4] cycloaddition to o-chloranil acceptor. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2006, 5, 914-924
1516181	CIF	C13 H6 Cl6 O2 S4	P 1 21/c 1	17; 13.405; 17.205 90; 97.907; 90	3883	Rosokha, S. V.; Dibrov, S. M.; Rosokha, T. Y.; Kochi, J. K. Electronic structures of intermolecular charge-transfer states in fast electron transfers with tetrathiafulvalene donor. Thermal and photoactivation of [2 + 4] cycloaddition to o-chloranil acceptor. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2006, 5, 914-924
1516182	CIF	C12 H4 Cl4 O2 S4	P 1 21/n 1	7.17; 16.961; 12.731 90; 97.176; 90	1536.1	Rosokha, S. V.; Dibrov, S. M.; Rosokha, T. Y.; Kochi, J. K. Electronic structures of intermolecular charge-transfer states in fast electron transfers with tetrathiafulvalene donor. Thermal and photoactivation of [2 + 4] cycloaddition to o-chloranil acceptor. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2006, 5, 914-924
1516183	CIF	C35 H80 B11 O4 S4	P -1	10.587; 11.677; 12.74 63.152; 67.095; 68.555	1259.4	Rosokha, S. V.; Dibrov, S. M.; Rosokha, T. Y.; Kochi, J. K. Electronic structures of intermolecular charge-transfer states in fast electron transfers with tetrathiafulvalene donor. Thermal and photoactivation of [2 + 4] cycloaddition to o-chloranil acceptor. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2006, 5, 914-924
1516184	CIF	C19 H40 B11 S4	P 1 21/n 1	9.1393; 13.3909; 12.5744 90; 109.609; 90	1449.6	Rosokha, S. V.; Dibrov, S. M.; Rosokha, T. Y.; Kochi, J. K. Electronic structures of intermolecular charge-transfer states in fast electron transfers with tetrathiafulvalene donor. Thermal and photoactivation of [2 + 4] cycloaddition to o-chloranil acceptor. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2006, 5, 914-924
1516185	CIF	C23 H22 O5	P -1	12.4283; 12.4686; 12.8462 85.951; 88.997; 78.875	1948.4	Choe, Tina; Khan, Saeed I.; Garcia-Garibay, Miguel A Combination vs. disproportionation in dialkyl biradicals. Selectivity reversal in a crystalline solid. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2006, 5, 449-451
1516186	CIF	C22 H22 O4	C 1 2/c 1	25.049; 11.3809; 14.7771 90; 117.603; 90	3733.2	Choe, Tina; Khan, Saeed I.; Garcia-Garibay, Miguel A Combination vs. disproportionation in dialkyl biradicals. Selectivity reversal in a crystalline solid. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2006, 5, 449-451
1516187	CIF	C22 H22 O4	P 1 21/c 1	14.8162; 14.8987; 8.3482 90; 90.134; 90	1842.8	Choe, Tina; Khan, Saeed I.; Garcia-Garibay, Miguel A Combination vs. disproportionation in dialkyl biradicals. Selectivity reversal in a crystalline solid. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2006, 5, 449-451
1516188	CIF	C18 H17 O6	P 21 21 2	5.4674; 29.89; 4.4627 90; 90; 90	729.3	La Clair, James J.; Rheingold, Arnold L.; Burkart, Michael D. Ganodone, a bioactive benzofuran from the fruiting bodies of Ganoderma tsugae. Journal of natural products, 2011, 74, 2045-2051
1516189	CIF	C7 H5 F O2	P 1 21/n 1	3.816; 6.3759; 26.571 90; 94.353; 90	644.6	Hathwar, Venkatesha R.; Thakur, Tejender S.; Dubey, Ritesh; Pavan, Mysore S.; Row, Tayur N Guru; Desiraju, Gautam R. Extending the supramolecular synthon based fragment approach (SBFA) for transferability of multipole charge density parameters to monofluorobenzoic acids and their cocrystals with isonicotinamide: importance of C-H···O, C-H···F, and F···F intermolecular regions. The journal of physical chemistry. A, 2011, 115, 12852-12863
1516190	CIF	C13 H11 F N2 O3	C 1 2/c 1	22.913; 5.2046; 20.0132 90; 100.212; 90	2348.8	Hathwar, Venkatesha R.; Thakur, Tejender S.; Dubey, Ritesh; Pavan, Mysore S.; Row, Tayur N Guru; Desiraju, Gautam R. Extending the supramolecular synthon based fragment approach (SBFA) for transferability of multipole charge density parameters to monofluorobenzoic acids and their cocrystals with isonicotinamide: importance of C-H···O, C-H···F, and F···F intermolecular regions. The journal of physical chemistry. A, 2011, 115, 12852-12863
1516191	CIF	C7 H5 F O2	P 1 21/n 1	3.7812; 6.3418; 26.539 90; 94.11; 90	634.8	Hathwar, Venkatesha R.; Thakur, Tejender S.; Dubey, Ritesh; Pavan, Mysore S.; Row, Tayur N Guru; Desiraju, Gautam R. Extending the supramolecular synthon based fragment approach (SBFA) for transferability of multipole charge density parameters to monofluorobenzoic acids and their cocrystals with isonicotinamide: importance of C-H···O, C-H···F, and F···F intermolecular regions. The journal of physical chemistry. A, 2011, 115, 12852-12863
1516192	CIF	C13 H10 F N2 O3	P -1	7.0275; 7.4474; 12.6005 74.371; 87.185; 70.004	596.12	Hathwar, Venkatesha R.; Thakur, Tejender S.; Dubey, Ritesh; Pavan, Mysore S.; Row, Tayur N Guru; Desiraju, Gautam R. Extending the supramolecular synthon based fragment approach (SBFA) for transferability of multipole charge density parameters to monofluorobenzoic acids and their cocrystals with isonicotinamide: importance of C-H···O, C-H···F, and F···F intermolecular regions. The journal of physical chemistry. A, 2011, 115, 12852-12863
1516193	CIF	C7 H5 F O2	P 1 21/n 1	6.5525; 3.7524; 25.021 90; 92.82; 90	614.5	Hathwar, Venkatesha R.; Thakur, Tejender S.; Dubey, Ritesh; Pavan, Mysore S.; Row, Tayur N Guru; Desiraju, Gautam R. Extending the supramolecular synthon based fragment approach (SBFA) for transferability of multipole charge density parameters to monofluorobenzoic acids and their cocrystals with isonicotinamide: importance of C-H···O, C-H···F, and F···F intermolecular regions. The journal of physical chemistry. A, 2011, 115, 12852-12863
1516194	CIF	C7 H5 F O2	P 1 21/c 1	3.7041; 6.2642; 26.6604 90; 92.96; 90	617.78	Hathwar, Venkatesha R.; Thakur, Tejender S.; Dubey, Ritesh; Pavan, Mysore S.; Row, Tayur N Guru; Desiraju, Gautam R. Extending the supramolecular synthon based fragment approach (SBFA) for transferability of multipole charge density parameters to monofluorobenzoic acids and their cocrystals with isonicotinamide: importance of C-H···O, C-H···F, and F···F intermolecular regions. The journal of physical chemistry. A, 2011, 115, 12852-12863
1516195	CIF	C7 H5 F O2	P 1 21/c 1	3.7411; 6.305; 26.564 90; 93.54; 90	625.4	Hathwar, Venkatesha R.; Thakur, Tejender S.; Dubey, Ritesh; Pavan, Mysore S.; Row, Tayur N Guru; Desiraju, Gautam R. Extending the supramolecular synthon based fragment approach (SBFA) for transferability of multipole charge density parameters to monofluorobenzoic acids and their cocrystals with isonicotinamide: importance of C-H···O, C-H···F, and F···F intermolecular regions. The journal of physical chemistry. A, 2011, 115, 12852-12863
1516196	CIF	C7 H5 F O2	P 1 21/c 1	3.7637; 6.3314; 26.607 90; 93.76; 90	632.7	Hathwar, Venkatesha R.; Thakur, Tejender S.; Dubey, Ritesh; Pavan, Mysore S.; Row, Tayur N Guru; Desiraju, Gautam R. Extending the supramolecular synthon based fragment approach (SBFA) for transferability of multipole charge density parameters to monofluorobenzoic acids and their cocrystals with isonicotinamide: importance of C-H···O, C-H···F, and F···F intermolecular regions. The journal of physical chemistry. A, 2011, 115, 12852-12863
1516197	CIF	C7 H5 F O2	P 1 21/n 1	6.7465; 3.7192; 24.285 90; 92.91; 90	608.6	Hathwar, Venkatesha R.; Thakur, Tejender S.; Dubey, Ritesh; Pavan, Mysore S.; Row, Tayur N Guru; Desiraju, Gautam R. Extending the supramolecular synthon based fragment approach (SBFA) for transferability of multipole charge density parameters to monofluorobenzoic acids and their cocrystals with isonicotinamide: importance of C-H···O, C-H···F, and F···F intermolecular regions. The journal of physical chemistry. A, 2011, 115, 12852-12863
1516198	CIF	C13 H11 F N2 O3	C 1 2/c 1	22.046; 5.2078; 20.995 90; 95.888; 90	2397.7	Hathwar, Venkatesha R.; Thakur, Tejender S.; Dubey, Ritesh; Pavan, Mysore S.; Row, Tayur N Guru; Desiraju, Gautam R. Extending the supramolecular synthon based fragment approach (SBFA) for transferability of multipole charge density parameters to monofluorobenzoic acids and their cocrystals with isonicotinamide: importance of C-H···O, C-H···F, and F···F intermolecular regions. The journal of physical chemistry. A, 2011, 115, 12852-12863
1516199	CIF	C3 Cl N	P 4/n m m :2	6.27205; 6.27205; 7.41472 90; 90; 90	291.685	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516200	CIF	C3 Cl N	P 4/n m m :2	6.26158; 6.26158; 7.40222 90; 90; 90	290.222	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516201	CIF	C3 Cl N	P 4/n m m :2	6.28481; 6.28481; 7.43083 90; 90; 90	293.509	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516202	CIF	C3 Cl N	P 4/n m m :2	6.24761; 6.24761; 7.38691 90; 90; 90	288.331	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516203	CIF	C3 Cl N	P 4/n m m :2	6.27406; 6.27406; 7.41752 90; 90; 90	291.982	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516204	CIF	C3 Cl N	P 4/n m m :2	6.24356; 6.24356; 7.38323 90; 90; 90	287.813	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516205	CIF	C3 Cl N	P 4/n m m :2	6.25716; 6.25716; 7.39742 90; 90; 90	289.624	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516206	CIF	C3 Cl N	P 4/n m m :2	6.26687; 6.26687; 7.40789 90; 90; 90	290.935	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516207	CIF	C3 Cl N	P 4/n m m :2	6.27959; 6.27959; 7.42355 90; 90; 90	292.735	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516208	CIF	C3 Cl N	P 4/n m m :2	6.25958; 6.25958; 7.39974 90; 90; 90	289.939	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516209	CIF	C3 Cl N	P 4/n m m :2	6.28727; 6.28727; 7.43434 90; 90; 90	293.878	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516210	CIF	C3 Cl N	P 4/n m m :2	6.27704; 6.27704; 7.42097 90; 90; 90	292.395	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516211	CIF	C3 Cl N	P 4/n m m :2	6.25021; 6.25021; 7.38992 90; 90; 90	288.688	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516212	CIF	C3 Cl N	P 4/n m m :2	6.25254; 6.25254; 7.39233 90; 90; 90	288.998	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516213	CIF	C3 Cl N	P 4/n m m :2	6.26923; 6.26923; 7.41088 90; 90; 90	291.272	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516214	CIF	C3 Cl N	P 4/n m m :2	6.28957; 6.28957; 7.43727 90; 90; 90	294.209	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516215	CIF	C3 Cl N	P 4/n m m :2	6.2548; 6.2548; 7.39492 90; 90; 90	289.308	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516216	CIF	C3 Cl N	P 4/n m m :2	6.2824; 6.2824; 7.42752 90; 90; 90	293.153	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516217	CIF	C3 Cl N	P 4/n m m :2	6.24506; 6.24506; 7.38479 90; 90; 90	288.013	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516218	CIF	C3 Cl N	P 4/n m m :2	6.26428; 6.26428; 7.40545 90; 90; 90	290.599	Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Russina, Olga; Caminiti, Ruggero Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water. The journal of physical chemistry. B, 2011, 115, 11805-11815
1516232	CIF	C82.5 H44 F15 N O	P -1	14.729; 15.302; 17.015 110.482; 91.5392; 117.76	3094.5	Chou, Chih-Ming; Saito, Shohei; Yamaguchi, Shigehiro Heterotriangulenes π-Expanded at Bridging Positions. Organic letters, 2014, 16, 2868-2871
1516233	CIF	C122.4 H59 Cl3.4 F15 N	P -1	26.3661; 26.5069; 39.8191 100.01; 99.1855; 99.1177	26552.9	Chou, Chih-Ming; Saito, Shohei; Yamaguchi, Shigehiro Heterotriangulenes π-Expanded at Bridging Positions. Organic letters, 2014, 16, 2868-2871
1516234	CIF	C78 H32 F15 N	C 1 2/c 1	25.7374; 16.733; 30.152 90; 114.227; 90	11841.7	Chou, Chih-Ming; Saito, Shohei; Yamaguchi, Shigehiro Heterotriangulenes π-Expanded at Bridging Positions. Organic letters, 2014, 16, 2868-2871
1516235	CIF	C13 H16 O6	P b c a	11.5879; 11.617; 19.7761 90; 90; 90	2662.19	Rout, Saroj Kumar; Guin, Srimanta; Ali, Wajid; Gogoi, Anupal; Patel, Bhisma K. Copper-Catalyzed Esterification of Alkylbenzenes with Cyclic Ethers and Cycloalkanes via C(sp(3))-H Activation Following Cross-Dehydrogenative Coupling. Organic letters, 2014, 16, 3086-3089
1516236	CIF	C49 H36 O5	P 1 2/n 1	9.772; 12.0351; 17.3162 90; 93.947; 90	2031.68	Nandakumar, Meganathan; Karunakaran, Jayachandran; Mohanakrishnan, Arasambattu K. Diels-Alder Reaction of 1,3-Diarylbenzo[c]furans with Thiophene S,S-Dioxide/Indenone Derivatives: A Facile Preparation of Substituted Dibenzothiophene S,S-Dioxides and Fluorenones. Organic letters, 2014, 16, 3068-3071
1516237	CIF	C34 H24 O4 S	P -1	13.7369; 13.8077; 16.4824 78.442; 68.211; 80.216	2828.35	Nandakumar, Meganathan; Karunakaran, Jayachandran; Mohanakrishnan, Arasambattu K. Diels-Alder Reaction of 1,3-Diarylbenzo[c]furans with Thiophene S,S-Dioxide/Indenone Derivatives: A Facile Preparation of Substituted Dibenzothiophene S,S-Dioxides and Fluorenones. Organic letters, 2014, 16, 3068-3071
1516238	CIF	C28 H18 O2 S	P 1 21/n 1	9.9374; 16.1534; 13.053 90; 100.308; 90	2061.49	Nandakumar, Meganathan; Karunakaran, Jayachandran; Mohanakrishnan, Arasambattu K. Diels-Alder Reaction of 1,3-Diarylbenzo[c]furans with Thiophene S,S-Dioxide/Indenone Derivatives: A Facile Preparation of Substituted Dibenzothiophene S,S-Dioxides and Fluorenones. Organic letters, 2014, 16, 3068-3071
1516239	CIF	C13 H11 F3 O2	P -1	7.6763; 10.0446; 15.7356 81.3; 82.163; 86.148	1186.79	Kohn, Benjamin L.; Rovis, Tomislav Cobaltate anion couples terminal dienes with trifluoroacetic anhydride: a direct fluoroacylation of 1,3-dienes Chemical Science, 2014, 5, 2889
1516240	CIF	C20 H16 O3	P 1 21/c 1	14.24; 6.321; 36.476 90; 98.915; 90	3243.6	Yang, Shu-Wen; Elangovan, Arumugasamy; Ho, Tong-Ing Donor-substituted phenyl-pi-chromones: electrochemiluminescence and intriguing electronic properties. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2005, 4, 327-332
1516241	CIF	C34 H32 B2 Cl4 N13 O3 Pr	P 1 21/n 1	10.414; 21.894; 17.805 90; 99.73; 90	4001.2	Davies, Graham M.; Adams, Harry; Pope, Simon J. A.; Faulkner, Stephen; Ward, Michael D. Photophysical properties of Pr(III) and Er(III) complexes of poly(pyrazolyl)borates. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2005, 4, 829-834
1516242	CIF	C34 H32 B2 Cl4 Er N13 O3	P 1 21/n 1	10.8892; 20.125; 18.381 90; 105.919; 90	3873.6	Davies, Graham M.; Adams, Harry; Pope, Simon J. A.; Faulkner, Stephen; Ward, Michael D. Photophysical properties of Pr(III) and Er(III) complexes of poly(pyrazolyl)borates. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2005, 4, 829-834
1516243	CIF	C22 H24 Si	C 1 2/c 1	15.986; 12.999; 18.745 90; 107.35; 90	3718	Zarkadis, Antonios K.; Georgakilas, Vassilios; Perdikomatis, Gerasimos P.; Trifonov, Anton; Gurzadyan, Gagik G.; Skoulika, Stavroula; Siskos, Michael G. Triplet- vs. singlet-state imposed photochemistry. The role of substituent effects on the photo-Fries and photodissociation reaction of triphenylmethyl silanes. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2005, 4, 469-480
1516244	CIF	C29 H28 O Si	P n a 21	17.088; 10.053; 13.654 90; 90; 90	2345.6	Zarkadis, Antonios K.; Georgakilas, Vassilios; Perdikomatis, Gerasimos P.; Trifonov, Anton; Gurzadyan, Gagik G.; Skoulika, Stavroula; Siskos, Michael G. Triplet- vs. singlet-state imposed photochemistry. The role of substituent effects on the photo-Fries and photodissociation reaction of triphenylmethyl silanes. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2005, 4, 469-480
1516245	CIF	C20 H18 N4 O2	P 1 21/c 1	7.173; 10.269; 22.512 90; 90.57; 90	1658.14	Insińska-Rak, Malgorzata; Sikorska, Ewa; Herance, Jose R.; Bourdelande, Jose L.; Khmelinskii, Igor V.; Kubicki, Maciej; Prukała, Wiesław; Machado, Isabel F.; Komasa, Anna; Ferreira, Luis F. V.; Sikorski, Marek Spectroscopy and photophysics of flavin-related compounds: 3-benzyl-lumiflavin. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2005, 4, 463-468
1516246	CIF	C19 H24 N2 O2	P 1 21/n 1	17.287; 12.249; 17.804 90; 103.09; 90	3672	Lohmeyer, Britta; Margaretha, Paul Photocycloaddition of cyclohex-2-enones to alkylidenemalononitriles (1,1-dicyanoalkenes). Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2005, 4, 637-640
1516247	CIF	C14 H18 N2 O	P 1 21/c 1	18.7448; 6.7681; 22.9068 90; 111.483; 90	2704.2	Lohmeyer, Britta; Margaretha, Paul Photocycloaddition of cyclohex-2-enones to alkylidenemalononitriles (1,1-dicyanoalkenes). Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2005, 4, 637-640
1516248	CIF	C39 H59 Au2 Br O2 P2	P 1 2/a 1	17.211; 12.442; 22.955 90; 105.75; 90	4731	Wing-Wah Yam, Vivian; Cheung, Kai-Leung; Yip, Sung-Kong; Zhu, Nianyong Synthesis, characterisation, electrochemistry and luminescence studies of 9-anthrylgold(I) complexes. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2005, 4, 149-153
1516249	CIF	C54 H42 Au2 Cl2 P2	P 1 21/n 1	12.258; 16.047; 23.166 90; 98.75; 90	4503.8	Wing-Wah Yam, Vivian; Cheung, Kai-Leung; Yip, Sung-Kong; Zhu, Nianyong Synthesis, characterisation, electrochemistry and luminescence studies of 9-anthrylgold(I) complexes. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2005, 4, 149-153
1516250	CIF	C156 H240 Mn6 N3 O33 Tb	P 1 21/n 1	19.483; 26.625; 38.568 90; 92.761; 90	19983	Ledezma-Gairaud, M; Grangel, L.; Aromí, G; Fujisawa, T.; Yamaguchi, A.; Sumiyama, A.; Sañudo, E C From serendipitous assembly to controlled synthesis of 3d-4f single-molecule magnets. Inorganic chemistry, 2014, 53, 5878-5880
1516251	CIF	C159 H244 La Mn6 N4 O34	P 1 21/n 1	27.1673; 19.6773; 32.4879 90; 105.531; 90	16733.2	Ledezma-Gairaud, M; Grangel, L.; Aromí, G; Fujisawa, T.; Yamaguchi, A.; Sumiyama, A.; Sañudo, E C From serendipitous assembly to controlled synthesis of 3d-4f single-molecule magnets. Inorganic chemistry, 2014, 53, 5878-5880
1516252	CIF	C156 H240 Gd Mn6 N3 O33	P 1 21/n 1	19.481; 26.582; 38.691 90; 92.731; 90	20013	Ledezma-Gairaud, M; Grangel, L.; Aromí, G; Fujisawa, T.; Yamaguchi, A.; Sumiyama, A.; Sañudo, E C From serendipitous assembly to controlled synthesis of 3d-4f single-molecule magnets. Inorganic chemistry, 2014, 53, 5878-5880
1516253	CIF	C6 H3 F N3 S4	P 1 21/c 1	4.789; 12.683; 16.599 90; 71.26; 90	954.8	Lekin, Kristina; Phan, Hoa; Winter, Stephen M.; Wong, Joanne W. L.; Leitch, Alicea A.; Laniel, Dominique; Yong, Wenjun; Secco, Richard A.; Tse, John S.; Desgreniers, Serge; Dube, Paul A.; Shatruk, Michael; Oakley, Richard T. Heat, Pressure and Light-Induced Interconversion of Bisdithiazolyl Radicals and Dimers. Journal of the American Chemical Society, 2014, 136, 8050
1516254	CIF	C6 H3 F N3 S4	P 1 21/n 1	17.301; 4.0582; 26.249 90; 92.074; 90	1841.8	Lekin, Kristina; Phan, Hoa; Winter, Stephen M.; Wong, Joanne W. L.; Leitch, Alicea A.; Laniel, Dominique; Yong, Wenjun; Secco, Richard A.; Tse, John S.; Desgreniers, Serge; Dube, Paul A.; Shatruk, Michael; Oakley, Richard T. Heat, Pressure and Light-Induced Interconversion of Bisdithiazolyl Radicals and Dimers. Journal of the American Chemical Society, 2014, 136, 8050
1516255	CIF	C12 H6 F2 N6 S8	P 1 21/c 1	4.6011; 12.7317; 15.9122 90; 78.949; 90	914.8	Lekin, Kristina; Phan, Hoa; Winter, Stephen M.; Wong, Joanne W. L.; Leitch, Alicea A.; Laniel, Dominique; Yong, Wenjun; Secco, Richard A.; Tse, John S.; Desgreniers, Serge; Dube, Paul A.; Shatruk, Michael; Oakley, Richard T. Heat, Pressure and Light-Induced Interconversion of Bisdithiazolyl Radicals and Dimers. Journal of the American Chemical Society, 2014, 136, 8050
1516256	CIF	C12 H6 F2 N6 S8	P 1 21/c 1	4.12168; 13.2722; 14.8586 90; 84.318; 90	808.83	Lekin, Kristina; Phan, Hoa; Winter, Stephen M.; Wong, Joanne W. L.; Leitch, Alicea A.; Laniel, Dominique; Yong, Wenjun; Secco, Richard A.; Tse, John S.; Desgreniers, Serge; Dube, Paul A.; Shatruk, Michael; Oakley, Richard T. Heat, Pressure and Light-Induced Interconversion of Bisdithiazolyl Radicals and Dimers. Journal of the American Chemical Society, 2014, 136, 8050
1516257	CIF	C6 H3 F N3 S4	P 1 21/c 1	4.789; 12.683; 16.281 90; 74.89; 90	954.7	Lekin, Kristina; Phan, Hoa; Winter, Stephen M.; Wong, Joanne W. L.; Leitch, Alicea A.; Laniel, Dominique; Yong, Wenjun; Secco, Richard A.; Tse, John S.; Desgreniers, Serge; Dube, Paul A.; Shatruk, Michael; Oakley, Richard T. Heat, Pressure and Light-Induced Interconversion of Bisdithiazolyl Radicals and Dimers. Journal of the American Chemical Society, 2014, 136, 8050
1516258	CIF	C12 H6 F2 N6 S8	P 1 21/c 1	3.86543; 13.4994; 14.4694 90; 86.261; 90	753.42	Lekin, Kristina; Phan, Hoa; Winter, Stephen M.; Wong, Joanne W. L.; Leitch, Alicea A.; Laniel, Dominique; Yong, Wenjun; Secco, Richard A.; Tse, John S.; Desgreniers, Serge; Dube, Paul A.; Shatruk, Michael; Oakley, Richard T. Heat, Pressure and Light-Induced Interconversion of Bisdithiazolyl Radicals and Dimers. Journal of the American Chemical Society, 2014, 136, 8050
1516259	CIF	C34 H38 Si2 Sn	C 1 2/c 1	20.3517; 11.4308; 14.8442 90; 116.774; 90	3083.1	Kuwabara, Takuya; Guo, Jing-Dong; Nagase, Shigeru; Minoura, Mao; Herber, Rolfe H.; Saito, Masaichi Enhancement of Stannylene Character in Stannole Dianion Equivalents Evidenced by NMR and Mössbauer Spectroscopy and Theoretical Studies of Newly Synthesized Silyl-Substituted Dilithiostannoles Organometallics, 2014, 33, 2910
1516260	CIF	C37 H52 Li2 O2 Si2 Sn	P 21 21 21	8.4097; 13.856; 32.621 90; 90; 90	3801.2	Kuwabara, Takuya; Guo, Jing-Dong; Nagase, Shigeru; Minoura, Mao; Herber, Rolfe H.; Saito, Masaichi Enhancement of Stannylene Character in Stannole Dianion Equivalents Evidenced by NMR and Mössbauer Spectroscopy and Theoretical Studies of Newly Synthesized Silyl-Substituted Dilithiostannoles Organometallics, 2014, 33, 2910
1516261	CIF	C36 H56 Li2 O2 Si2 Sn	P -1	12.3909; 12.4427; 13.724 83.022; 67.354; 75.564	1890.4	Kuwabara, Takuya; Guo, Jing-Dong; Nagase, Shigeru; Minoura, Mao; Herber, Rolfe H.; Saito, Masaichi Enhancement of Stannylene Character in Stannole Dianion Equivalents Evidenced by NMR and Mössbauer Spectroscopy and Theoretical Studies of Newly Synthesized Silyl-Substituted Dilithiostannoles Organometallics, 2014, 33, 2910
1516262	CIF	C20 H38 Au Cl4 N5	P -1	8.9016; 12.934; 13.6174 63.626; 78.563; 80.061	1370.35	Mirabdolbaghi, Roya; Dudding, Travis; Stamatatos, Theocharis A Class of Phase-Transfer Catalyst with Interionic Strain: Insight into the Bonding of Disubstituted N- vs Carbene-Stabilized N(I)-Centered Cations. Organic letters, 2014, 16, 2790-2793
1516263	CIF	C26 H41 Cl F9 N5 O6	P 1 21/c 1	16.646; 22.121; 9.329 90; 90.328; 90	3435.1	Mirabdolbaghi, Roya; Dudding, Travis; Stamatatos, Theocharis A Class of Phase-Transfer Catalyst with Interionic Strain: Insight into the Bonding of Disubstituted N- vs Carbene-Stabilized N(I)-Centered Cations. Organic letters, 2014, 16, 2790-2793
1516264	CIF	C24 H25 Cl N2 O4	P 21 21 21	11.939; 12.451; 15.057 90; 90; 90	2238.3	Zhang, Han-Ming; Gao, Zhong-Hua; Ye, Song Bifunctional N-Heterocyclic Carbene-Catalyzed Highly Enantioselective Synthesis of Spirocyclic Oxindolo-β-lactams. Organic letters, 2014, 16, 3079-3081
1516265	CIF	C24 H16 N2 O	P b c a	14.7042; 8.8119; 27.6407 90; 90; 90	3581.46	Dong, Jiaxing; Wang, Fei; You, Jingsong Copper-Mediated Tandem Oxidative C(sp(2))-H/C(sp)-H Alkynylation and Annulation of Arenes with Terminal Alkynes. Organic letters, 2014, 16, 2884-2887
1516266	CIF	C76 H59 B F15 O7 Si U	P -1	13.6767; 15.7946; 16.3191 102.448; 93.042; 96.154	3411.96	Pedrick, E. A.; Wu, G.; Kaltsoyannis, N.; Hayton, T. W. Reductive silylation of a uranyl dibenzoylmethanate complex: an example of controlled uranyl oxo ligand cleavage Chemical Science, 2014, 5, 3204
1516267	CIF	C68 H52 B F15 O7 Si U	P -1	12.8552; 15.7463; 16.5535 100.009; 103.592; 90.593	3202.79	Pedrick, E. A.; Wu, G.; Kaltsoyannis, N.; Hayton, T. W. Reductive silylation of a uranyl dibenzoylmethanate complex: an example of controlled uranyl oxo ligand cleavage Chemical Science, 2014, 5, 3204
1516268	CIF	C54 H37 B F15 O6 Si U	P -1	12.0721; 12.2867; 17.884 89.672; 80.12; 78.024	2555.2	Pedrick, E. A.; Wu, G.; Kaltsoyannis, N.; Hayton, T. W. Reductive silylation of a uranyl dibenzoylmethanate complex: an example of controlled uranyl oxo ligand cleavage Chemical Science, 2014, 5, 3204
1516269	CIF	C73 H48 B F15 O7 U	P 1	15.1204; 16.1764; 16.4479 112.966; 96.391; 115.286	3157	Pedrick, E. A.; Wu, G.; Kaltsoyannis, N.; Hayton, T. W. Reductive silylation of a uranyl dibenzoylmethanate complex: an example of controlled uranyl oxo ligand cleavage Chemical Science, 2014, 5, 3204
1516270	CIF	C86 H82 Dy N19 O2	P -1	11.6002; 15.3265; 22.3436 92.48; 95.186; 109.408	3720	Marx, R.; Moro, F.; Dörfel, M.; Ungur, L.; Waters, M.; Jiang, S. D.; Orlita, M.; Taylor, J.; Frey, W.; Chibotaru, L. F.; van Slageren, J. Spectroscopic determination of crystal field splittings in lanthanide double deckers Chemical Science, 2014, 5, 3287
1516271	CIF	C86 H82 Er N19 O2	P -1	11.5308; 15.2909; 22.27 92.524; 95.122; 109.342	3678.8	Marx, R.; Moro, F.; Dörfel, M.; Ungur, L.; Waters, M.; Jiang, S. D.; Orlita, M.; Taylor, J.; Frey, W.; Chibotaru, L. F.; van Slageren, J. Spectroscopic determination of crystal field splittings in lanthanide double deckers Chemical Science, 2014, 5, 3287
1516272	CIF	C86 H82 Ho N19 O2	P -1	11.5698; 15.3429; 22.3337 92.514; 95.132; 109.356	3714.1	Marx, R.; Moro, F.; Dörfel, M.; Ungur, L.; Waters, M.; Jiang, S. D.; Orlita, M.; Taylor, J.; Frey, W.; Chibotaru, L. F.; van Slageren, J. Spectroscopic determination of crystal field splittings in lanthanide double deckers Chemical Science, 2014, 5, 3287
1516273	CIF	C76 H118 B2 K2 O8	P b c a	16.1537; 19.955; 22.8279 90; 90; 90	7358.5	Araneda, Juan F.; Piers, Warren E.; Sgro, Michael J.; Parvez, Masood Bronsted acid-catalyzed skeletal rearrangements in polycyclic conjugated boracycles: a thermal route to a ladder diborole Chemical Science, 2014, 5, 3189
1516274	CIF	C60 H86 B2 K2 O4	P 1 21/c 1	10.3128; 14.6667; 19.3119 90; 102.005; 90	2857.13	Araneda, Juan F.; Piers, Warren E.; Sgro, Michael J.; Parvez, Masood Bronsted acid-catalyzed skeletal rearrangements in polycyclic conjugated boracycles: a thermal route to a ladder diborole Chemical Science, 2014, 5, 3189
1516275	CIF	C44 H56 B2	P -1	11.337; 11.9746; 13.9071 83.312; 85.92; 88.345	1869.97	Araneda, Juan F.; Piers, Warren E.; Sgro, Michael J.; Parvez, Masood Bronsted acid-catalyzed skeletal rearrangements in polycyclic conjugated boracycles: a thermal route to a ladder diborole Chemical Science, 2014, 5, 3189
1516276	CIF	C66 H88 B2 Cl4 Co	P -1	11.5296; 13.4868; 14.6512 112.337; 111.343; 95.399	1890	Araneda, Juan F.; Piers, Warren E.; Sgro, Michael J.; Parvez, Masood Bronsted acid-catalyzed skeletal rearrangements in polycyclic conjugated boracycles: a thermal route to a ladder diborole Chemical Science, 2014, 5, 3189
1516277	CIF	C116 H134 Cl4 Fe2 O4 P4	C 1 2/c 1	16.5044; 23.0305; 28.6494 90; 104.041; 90	10564.4	Heinl, Sebastian; Scheer, Manfred Activation of group 15 based cage compounds by [CpBIGFe(CO)2] radicals Chemical Science, 2014, 5, 3221
1516278	CIF	C116 H134 As4 Cl4 Fe2 O4	C 1 2/c 1	16.0862; 23.1908; 29.2063 90; 103.712; 90	10584.9	Heinl, Sebastian; Scheer, Manfred Activation of group 15 based cage compounds by [CpBIGFe(CO)2] radicals Chemical Science, 2014, 5, 3221
1516279	CIF	C116 H133.5 Cl2 Fe2 N0.5 O4 P4 S3	P -1	18.6002; 19.1311; 30.2819 89.89; 88.546; 84.899	10729.4	Heinl, Sebastian; Scheer, Manfred Activation of group 15 based cage compounds by [CpBIGFe(CO)2] radicals Chemical Science, 2014, 5, 3221
1516280	CIF	C114 H130 Fe2 O4 P4 Se3	P -1	13.6386; 16.2697; 23.7755 77.294; 86.087; 85.081	5120.9	Heinl, Sebastian; Scheer, Manfred Activation of group 15 based cage compounds by [CpBIGFe(CO)2] radicals Chemical Science, 2014, 5, 3221
1516281	CIF	C114 H130 Fe2 O3 S2	P -1	12.6885; 13.6189; 15.8914 103.957; 103.841; 103.076	2467.36	Heinl, Sebastian; Scheer, Manfred Activation of group 15 based cage compounds by [CpBIGFe(CO)2] radicals Chemical Science, 2014, 5, 3221
1516282	CIF	C60 H60 Cd2 N10 O21	C 1 2/c 1	47.182; 9.857; 32.787 90; 101.008; 90	14968	Song, Bai-Qiao; Wang, Xin-Long; Yang, Guang-Sheng; Wang, Hai-Ning; Liang, Jun; Shao, Kui-Zhan; Su, Zhong-Min A polyrotaxane-like metal‒organic framework exhibiting luminescent sensing of Eu3+cations and proton conductivity CrystEngComm, 2014, 16, 6882
1516284	CIF	C4 H10 N2 O5 Zn	P -1	9.09; 9.537; 10.42 106.112; 105.815; 106.854	766.9	Mroué, Kamal H; Power, William P. High-field solid-state (67)Zn NMR spectroscopy of several zinc-amino acid complexes. The journal of physical chemistry. A, 2010, 114, 324-335
1516285	CIF	C6 H8 Cl2 N4 Zn	P 1 21/n 1	7.9306; 11.7739; 11.4156 90; 105.441; 90	1027.45	Mroué, Kamal H; Power, William P. High-field solid-state (67)Zn NMR spectroscopy of several zinc-amino acid complexes. The journal of physical chemistry. A, 2010, 114, 324-335
1516286	CIF	C6 H22 N2 Na2 O10 S2 Zn	C 1 2 1	5.1893; 23.2065; 15.0008 90; 92.561; 90	1804.67	Mroué, Kamal H; Power, William P. High-field solid-state (67)Zn NMR spectroscopy of several zinc-amino acid complexes. The journal of physical chemistry. A, 2010, 114, 324-335
1516287	CIF	C24 H12 O13 Zn4	F m -3 m	25.8247; 25.8247; 25.8247 90; 90; 90	17222.9	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516288	CIF	C24 H12 O13 Zn4	F m -3 m	25.773; 25.773; 25.773 90; 90; 90	17119.7	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516289	CIF	C24 H12 O13 Zn4	F m -3 m	25.8825; 25.8825; 25.8825 90; 90; 90	17338.8	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516290	CIF	C24 H12 O13 Zn4	F m -3 m	25.755; 25.755; 25.755 90; 90; 90	17083.8	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516291	CIF	C24 H12 O13 Zn4	F m -3 m	25.8323; 25.8323; 25.8323 90; 90; 90	17238.1	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516292	CIF	C24 H12 O13 Zn4	F m -3 m	25.7555; 25.7555; 25.7555 90; 90; 90	17084.8	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516293	CIF	C24 H12 O13 Zn4	F m -3 m	25.8604; 25.8604; 25.8604 90; 90; 90	17294.4	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516294	CIF	C24 H12 O13 Zn4	F m -3 m	25.8643; 25.8643; 25.8643 90; 90; 90	17302.2	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516295	CIF	C24 H12 O13 Zn4	F m -3 m	25.8164; 25.8164; 25.8164 90; 90; 90	17206.3	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516296	CIF	C24 H12 O13 Zn4	F m -3 m	25.7874; 25.7874; 25.7874 90; 90; 90	17148.4	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516297	CIF	C24 H12 O13 Zn4	F m -3 m	25.8751; 25.8751; 25.8751 90; 90; 90	17323.9	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516298	CIF	C24 H12 O13 Zn4	F m -3 m	25.8104; 25.8104; 25.8104 90; 90; 90	17194.3	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516299	CIF	C24 H12 O13 Zn4	F m -3 m	25.8919; 25.8919; 25.8919 90; 90; 90	17357.7	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516300	CIF	C24 H12 O13 Zn4	F m -3 m	25.803; 25.803; 25.803 90; 90; 90	17179.5	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516301	CIF	C24 H12 O13 Zn4	F m -3 m	25.8449; 25.8449; 25.8449 90; 90; 90	17263.3	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516302	CIF	C24 H12 O13 Zn4	F m -3 m	25.8503; 25.8503; 25.8503 90; 90; 90	17274.2	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516303	CIF	C24 H12 O13 Zn4	F m -3 m	25.8382; 25.8382; 25.8382 90; 90; 90	17249.9	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516304	CIF	C24 H12 O13 Zn4	F m -3 m	25.7677; 25.7677; 25.7677 90; 90; 90	17109.1	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516305	CIF	C24 H12 O13 Zn4	F m -3 m	25.7984; 25.7984; 25.7984 90; 90; 90	17170.3	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516306	CIF	C24 H12 O13 Zn4	F m -3 m	25.7783; 25.7783; 25.7783 90; 90; 90	17130.2	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516307	CIF	C24 H12 O13 Zn4	F m -3 m	25.7894; 25.7894; 25.7894 90; 90; 90	17152.4	Lock, Nina; Wu, Yue; Christensen, Mogens; Cameron, Lisa J.; Peterson, Vanessa K.; Bridgeman, Adam J.; Kepert, Cameron J.; Iversen, Bo B. Elucidating Negative Thermal Expansion in MOF-5 The Journal of Physical Chemistry C, 2010, 114, 16181
1516308	CIF	C7 H14 F N O20 Si10	I 4/m	9.1454; 9.1454; 13.3651 90; 90; 90	1117.83	Amri, Mahrez; Clarkson, Guy J.; Walton, Richard I. Anisotropic Thermal Expansion of SiO2and AlPO4Clathrasils with the AST-Type Structure The Journal of Physical Chemistry C, 2010, 114, 6726
1516309	CIF	C7 H14 F N O20 Si10	I 4/m	9.1827; 9.1827; 13.3572 90; 90; 90	1126.31	Amri, Mahrez; Clarkson, Guy J.; Walton, Richard I. Anisotropic Thermal Expansion of SiO2and AlPO4Clathrasils with the AST-Type Structure The Journal of Physical Chemistry C, 2010, 114, 6726
1516310	CIF	C7 H14 F N O20 Si10	I 4/m	9.1666; 9.1666; 13.3662 90; 90; 90	1123.12	Amri, Mahrez; Clarkson, Guy J.; Walton, Richard I. Anisotropic Thermal Expansion of SiO2and AlPO4Clathrasils with the AST-Type Structure The Journal of Physical Chemistry C, 2010, 114, 6726
1516311	CIF	C7 H14 F N O20 Si10	I 4/m	9.154; 9.154; 13.3636 90; 90; 90	1119.81	Amri, Mahrez; Clarkson, Guy J.; Walton, Richard I. Anisotropic Thermal Expansion of SiO2and AlPO4Clathrasils with the AST-Type Structure The Journal of Physical Chemistry C, 2010, 114, 6726
1516312	CIF	C7 H14 F N O20 Si10	I 4/m	9.1379; 9.1379; 13.3657 90; 90; 90	1116.05	Amri, Mahrez; Clarkson, Guy J.; Walton, Richard I. Anisotropic Thermal Expansion of SiO2and AlPO4Clathrasils with the AST-Type Structure The Journal of Physical Chemistry C, 2010, 114, 6726
1516313	CIF	C7 H14 F N O20 Si10	I 4/m	9.1695; 9.1695; 13.344 90; 90; 90	1122	Amri, Mahrez; Clarkson, Guy J.; Walton, Richard I. Anisotropic Thermal Expansion of SiO2and AlPO4Clathrasils with the AST-Type Structure The Journal of Physical Chemistry C, 2010, 114, 6726
1516318	CIF	C25 H16 N4 O4	I -4 3 d	18.0373; 18.0373; 18.0373 90; 90; 90	5868.3	Beaudoin, Daniel; Maris, Thierry; Wuest, James D. Constructing monocrystalline covalent organic networks by polymerization Nature Chemistry, 2013, 5, 830-834
1516319	CIF	C25 H16 N4 O4	P -4 b 2	13.1545; 13.1545; 7.9818 90; 90; 90	1381.2	Beaudoin, Daniel; Maris, Thierry; Wuest, James D. Constructing monocrystalline covalent organic networks by polymerization Nature Chemistry, 2013, 5, 830-834
1516320	CIF	C24 H16 N4 O4 Si	P -4 b 2	13.421; 13.421; 8.528 90; 90; 90	1536.1	Beaudoin, Daniel; Maris, Thierry; Wuest, James D. Constructing monocrystalline covalent organic networks by polymerization Nature Chemistry, 2013, 5, 830-834
1516321	CIF	C34 H28 N4 O4	P 42/n :2	15.7703; 15.7703; 7.0717 90; 90; 90	1758.75	Beaudoin, Daniel; Maris, Thierry; Wuest, James D. Constructing monocrystalline covalent organic networks by polymerization Nature Chemistry, 2013, 5, 830-834
1516322	CIF	C20 H14 B F2 I O3	P 1 21/c 1	8.2225; 15.7819; 13.9342 90; 94.669; 90	1802.19	D’Aléo, Anthony; Heresanu, Vasile; Giorgi, Michel; Le Guennic, Boris; Jacquemin, Denis; Fages, Frédéric NIR Emission in Borondifluoride Complexes of 2′-Hydroxychalcone Derivatives Containing an Acetonaphthone Ring The Journal of Physical Chemistry C, 2014, 118, 11906
1516323	CIF	C22 H17 B F2 O3	P 1 21/c 1	7.0724; 13.4708; 18.7873 90; 92.283; 90	1788.46	D’Aléo, Anthony; Heresanu, Vasile; Giorgi, Michel; Le Guennic, Boris; Jacquemin, Denis; Fages, Frédéric NIR Emission in Borondifluoride Complexes of 2′-Hydroxychalcone Derivatives Containing an Acetonaphthone Ring The Journal of Physical Chemistry C, 2014, 118, 11906
1516324	CIF	C20 H13 B Br2 F2 O3	P 1 21/n 1	7.4641; 17.7664; 14.5841 90; 101.072; 90	1898	D’Aléo, Anthony; Heresanu, Vasile; Giorgi, Michel; Le Guennic, Boris; Jacquemin, Denis; Fages, Frédéric NIR Emission in Borondifluoride Complexes of 2′-Hydroxychalcone Derivatives Containing an Acetonaphthone Ring The Journal of Physical Chemistry C, 2014, 118, 11906
1516325	CIF	C9 H10 N O3 P	P 1 21/n 1	6.877; 16.165; 8.684 90; 107.06; 90	922.9	Kim, Yea Rin; Cho, Seungyoon; Lee, Phil Ho Metal-Free Azaphosphaannulation of Phosphonamides through Intramolecular Oxidative C-N Bond Formation. Organic letters, 2014, 16, 3098-3101
1516326	CIF	C10 H12 N O3 P	P 1 21/c 1	7.203; 8.501; 17.051 90; 90.9; 90	1044	Kim, Yea Rin; Cho, Seungyoon; Lee, Phil Ho Metal-Free Azaphosphaannulation of Phosphonamides through Intramolecular Oxidative C-N Bond Formation. Organic letters, 2014, 16, 3098-3101
1516327	CIF	C47 H76 P2 Pd Si	P 1 21/c 1	16.1665; 10.3002; 27.3994 90; 102.802; 90	4449.1	Suh, Hee-Won; Guard, Louise M.; Hazari, Nilay A mechanistic study of allene carboxylation with CO2resulting in the development of a Pd(ii) pincer complex for the catalytic hydroboration of CO2 Chemical Science, 2014, 5, 3859
1516328	CIF	C47 H76 P2 Pd Si	P 1 21/n 1	14.8954; 18.9114; 16.6032 90; 106.453; 90	4485.5	Suh, Hee-Won; Guard, Louise M.; Hazari, Nilay A mechanistic study of allene carboxylation with CO2resulting in the development of a Pd(ii) pincer complex for the catalytic hydroboration of CO2 Chemical Science, 2014, 5, 3859
1516329	CIF	C43 H64 O2 P2 Pd Si	P 1 21/n 1	12.6994; 25.26; 13.3608 90; 105.432; 90	4131.4	Suh, Hee-Won; Guard, Louise M.; Hazari, Nilay A mechanistic study of allene carboxylation with CO2resulting in the development of a Pd(ii) pincer complex for the catalytic hydroboration of CO2 Chemical Science, 2014, 5, 3859
1516330	CIF	C39 H60 P2 Pd Si	P 1 21/c 1	9.374; 17.3855; 23.3068 90; 101.572; 90	3721.1	Suh, Hee-Won; Guard, Louise M.; Hazari, Nilay A mechanistic study of allene carboxylation with CO2resulting in the development of a Pd(ii) pincer complex for the catalytic hydroboration of CO2 Chemical Science, 2014, 5, 3859
1516331	CIF	C44 H71 Al O2 P2 Pd Si	P 1 21/c 1	10.632; 23.5987; 19.2983 90; 105.726; 90	4660.7	Suh, Hee-Won; Guard, Louise M.; Hazari, Nilay A mechanistic study of allene carboxylation with CO2resulting in the development of a Pd(ii) pincer complex for the catalytic hydroboration of CO2 Chemical Science, 2014, 5, 3859
1516332	CIF	C38 H55 F3 O3 P2 Pd S Si	P b c a	23.517; 21.766; 14.71 90; 90; 90	7530	Suh, Hee-Won; Guard, Louise M.; Hazari, Nilay A mechanistic study of allene carboxylation with CO2resulting in the development of a Pd(ii) pincer complex for the catalytic hydroboration of CO2 Chemical Science, 2014, 5, 3859
1516333	CIF	C39 H60 P2 Pd Si	P 1 21/c 1	12.9946; 14.2318; 20.8681 90; 100.188; 90	3798.4	Suh, Hee-Won; Guard, Louise M.; Hazari, Nilay A mechanistic study of allene carboxylation with CO2resulting in the development of a Pd(ii) pincer complex for the catalytic hydroboration of CO2 Chemical Science, 2014, 5, 3859
1516334	CIF	C24 H21 Br2 N	P 1	8.187; 9.207; 27.256 90.044; 89.948; 106.384	1971.1	Thyrhaug, Erling; Hammershøj, Peter; Kjær, Kasper S; Sørensen, Thomas Just; Harrit, Niels H.; Nielsen, Martin M.; Bechgaard, Klaus Excited state kinetics of anthracene-bridge-aniline intramolecular exciplexes Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 1093-1105
1516335	CIF	C25 H23 Cl2 N	P -1	8.817; 20.29; 23.921 108.891; 90.992; 91.387	4046.3	Thyrhaug, Erling; Hammershøj, Peter; Kjær, Kasper S; Sørensen, Thomas Just; Harrit, Niels H.; Nielsen, Martin M.; Bechgaard, Klaus Excited state kinetics of anthracene-bridge-aniline intramolecular exciplexes. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 1093-1105
1516336	CIF	C24 H21 Cl2 N	P -1	8.09; 9.054; 27.394 90; 90; 90	2007	Thyrhaug, Erling; Hammershøj, Peter; Kjær, Kasper S; Sørensen, Thomas Just; Harrit, Niels H.; Nielsen, Martin M.; Bechgaard, Klaus Excited state kinetics of anthracene-bridge-aniline intramolecular exciplexes. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 1093-1105
1516337	CIF	C24 H22 Br N	P -1	9.285; 10.42; 10.928 67.167; 81.424; 78.925	953.03	Thyrhaug, Erling; Hammershøj, Peter; Kjær, Kasper S; Sørensen, Thomas Just; Harrit, Niels H.; Nielsen, Martin M.; Bechgaard, Klaus Excited state kinetics of anthracene-bridge-aniline intramolecular exciplexes. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 1093-1105
1516338	CIF	C24 H22 Cl N	P -1	9.298; 10.261; 10.943 66.706; 81.271; 78.544	936.72	Thyrhaug, Erling; Hammershøj, Peter; Kjær, Kasper S; Sørensen, Thomas Just; Harrit, Niels H.; Nielsen, Martin M.; Bechgaard, Klaus Excited state kinetics of anthracene-bridge-aniline intramolecular exciplexes. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 1093-1105
1516339	CIF	C12 H15 N O3	P 1 21 1	8.4867; 6.5654; 11.1325 90; 108.878; 90	586.92	Gietter, Amber A. S.; Gildner, Peter G.; Cinderella, Andrew P.; Watson, Donald A. General Route for Preparing β-Nitrocarbonyl Compounds Using Copper Thermal Redox Catalysis. Organic letters, 2014, 16, 3166-3169
1516340	CIF	C7 H11 N O4	P 21 21 21	5.8815; 8.9902; 15.9025 90; 90; 90	840.86	Gietter, Amber A. S.; Gildner, Peter G.; Cinderella, Andrew P.; Watson, Donald A. General Route for Preparing β-Nitrocarbonyl Compounds Using Copper Thermal Redox Catalysis. Organic letters, 2014, 16, 3166-3169
1516341	CIF	C14 H29 Cl N2 O3	P 1 21/c 1	8.9297; 13.194; 14.536 90; 98.9222; 90	1691.89	Gietter, Amber A. S.; Gildner, Peter G.; Cinderella, Andrew P.; Watson, Donald A. General Route for Preparing β-Nitrocarbonyl Compounds Using Copper Thermal Redox Catalysis. Organic letters, 2014, 16, 3166-3169
1516342	CIF	C14 H17 Cl2 N2 O3	P 1 21/c 1	14.922; 11.523; 9.548 90; 98.829; 90	1622	Gietter, Amber A. S.; Gildner, Peter G.; Cinderella, Andrew P.; Watson, Donald A. General Route for Preparing β-Nitrocarbonyl Compounds Using Copper Thermal Redox Catalysis. Organic letters, 2014, 16, 3166-3169
1516343	CIF	C19 H24 N2 O2	P 1 21/c 1	13.7462; 11.9167; 12.602 90; 106.292; 90	1981.4	Tian, Jingjing; Du, Qiuchen; Guo, Rui; Li, Yun; Cheng, Bin; Zhai, Hongbin Total synthesis of indole alkaloid (±)-subincanadine e. Organic letters, 2014, 16, 3173-3175
1516344	CIF	C32 H52 N4 O20	P 21 21 21	4.75; 18.89; 10.333 90; 90; 90	927	Sikorski, Pawel; Hori, Ritsuko; Wada, Masahisa Revisit of alpha-chitin crystal structure using high resolution X-ray diffraction data. Biomacromolecules, 2009, 10, 1100-1105
1516345	CIF	C32 H52 N4 O20	P 21 21 21	4.715; 18.77; 10.333 90; 90; 90	914	Sikorski, Pawel; Hori, Ritsuko; Wada, Masahisa Revisit of alpha-chitin crystal structure using high resolution X-ray diffraction data. Biomacromolecules, 2009, 10, 1100-1105
1516346	CIF	Bi4 Co0.3 O11 V1.7	I 4/m m m	3.92; 3.92; 15.5 90; 90; 90	238.179	Muller, C.; Anne, M.; Bacmann, M. Lattice vibrations and order-disorder transition in the oxide anion conductor BICOVOX.15: a neutron thermodiffractometry study Solid State Ionics, 1998, 111, 27-36
1516347	CIF	C9 H8 O2	P 1 21/n 1	5.6283; 17.9569; 7.7399 90; 96.844; 90	776.67	Benedict, Jason B.; Coppens, Philip Kinetics of the single-crystal to single-crystal two-photon photodimerization of alpha-trans-cinnamic acid to alpha-truxillic acid. The journal of physical chemistry. A, 2009, 113, 3116-3120
1516348	CIF	C9 H9 N O4	P 21 21 21	7.6786; 7.7348; 14.8561 90; 90; 90	882.34	Nelyubina, Yulia V.; Antipin, Mikhail Yu; Lyssenko, Konstantin A. Hydrogen bonds between zwitterions: intermediate between classical and charge-assisted ones. A case study. The journal of physical chemistry. A, 2009, 113, 3615-3620
1516349	CIF	C64 H76 Cl2 P4 Pd2	C 1 2/c 1	26.721; 12.755; 21.264 90; 101.51; 90	7101.59	Vitaliano, Rosa; Fratoddi, Ilaria; Venditti, Iole; Roviello, Giuseppina; Battocchio, Chiara; Polzonetti, Giovanni; Russo, Maria Vittoria Self-assembled monolayers based on Pd-containing organometallic thiols: preparation and structural characterization. The journal of physical chemistry. A, 2009, 113, 14730-14740
1516350	CIF	C66 H104 O2 P4 Pd2 S2	P -1	9.847; 13.52; 15.56 94.1; 106.5; 96.2	1963	Vitaliano, Rosa; Fratoddi, Ilaria; Venditti, Iole; Roviello, Giuseppina; Battocchio, Chiara; Polzonetti, Giovanni; Russo, Maria Vittoria Self-assembled monolayers based on Pd-containing organometallic thiols: preparation and structural characterization. The journal of physical chemistry. A, 2009, 113, 14730-14740
1516351	CIF	C28 H60 O2 P2 Pd S2	P 1	8.538; 10.605; 11.064 67.828; 81.864; 85.056	917.8	Vitaliano, Rosa; Fratoddi, Ilaria; Venditti, Iole; Roviello, Giuseppina; Battocchio, Chiara; Polzonetti, Giovanni; Russo, Maria Vittoria Self-assembled monolayers based on Pd-containing organometallic thiols: preparation and structural characterization. The journal of physical chemistry. A, 2009, 113, 14730-14740
1516352	CIF	C22 H27 Cl2 N3 O4	P -1	7.9275; 11.4889; 13.693 71.003; 73.267; 82.75	1128.55	Dey, Biswajit; Choudhury, Somnath Ray; Gamez, Patrick; Vargiu, Attilio Vittorio; Robertazzi, Arturo; Chen, Chih-Yuan; Lee, Hon Man; Jana, Atish Dipankar; Mukhopadhyay, Subrata Water-chloride and water-bromide hydrogen-bonded networks: influence of the nature of the halide ions on the stability of the supramolecular assemblies. The journal of physical chemistry. A, 2009, 113, 8626-8634
1516353	CIF	C22 H27 Br2 N3 O4	C 1 2/c 1	28.4117; 7.9256; 24.8399 90; 124.153; 90	4628.8	Dey, Biswajit; Choudhury, Somnath Ray; Gamez, Patrick; Vargiu, Attilio Vittorio; Robertazzi, Arturo; Chen, Chih-Yuan; Lee, Hon Man; Jana, Atish Dipankar; Mukhopadhyay, Subrata Water-chloride and water-bromide hydrogen-bonded networks: influence of the nature of the halide ions on the stability of the supramolecular assemblies. The journal of physical chemistry. A, 2009, 113, 8626-8634
1516354	CIF	C19 H18 Cl N5 O S	P 1 21/c 1	7.2743; 24.0163; 11.68 90; 110.354; 90	1913.11	Guo, Jixi; Liu, Lang; Jia, Dianzeng; Wang, Junhua; Xie, Xiaolin Solid-state photochromic properties and mechanism of 1-phenyl-3-methyl-4-(3-chlorobenzal)-5-hydroxypyrazole 4-methylthiosemicarbazone. The journal of physical chemistry. A, 2009, 113, 1255-1258
1516355	CIF	C3 H8 N2 O	P 21 21 2	4.979; 10.775; 4.5764 90; 90; 90	245.52	Martins, David M. S.; Spanswick, Christopher K.; Middlemiss, Derek S.; Abbas, Nasir; Pulham, Colin R.; Morrison, Carole A. A new polymorph of N,N'-dimethylurea characterized by X-ray diffraction and first-principles lattice dynamics calculations. The journal of physical chemistry. A, 2009, 113, 5998-6003
1516356	CIF	C55 H49 Eu F18 O8 P2	P -1	12.9551; 15.832; 16.3342 71.639; 70.877; 73.768	2945.6	Osawa, Masahisa; Hoshino, Mikio; Wada, Tatsuo; Hayashi, Fumi; Osanai, Shuichi Intra-complex energy transfer of europium(III) complexes containing anthracene and phenanthrene moieties. The journal of physical chemistry. A, 2009, 113, 10895-10902
1516357	CIF	C55 H49 Eu F18 O8 P2	P 1 21/n 1	15.804; 20.343; 18.9226 90; 96.2858; 90	6047.1	Osawa, Masahisa; Hoshino, Mikio; Wada, Tatsuo; Hayashi, Fumi; Osanai, Shuichi Intra-complex energy transfer of europium(III) complexes containing anthracene and phenanthrene moieties. The journal of physical chemistry. A, 2009, 113, 10895-10902
1516358	CIF	C14 H14 N4 O6	P -1	3.68; 7.595; 12.501 85.69; 88.01; 84.22	346.5	Schmidtmann, Marc; Farrugia, Louis J.; Middlemiss, Derek S.; Gutmann, Matthias J.; McIntyre, Garry J.; Wilson, Chick C. Experimental and theoretical charge density study of polymorphic isonicotinamide-oxalic acid molecular complexes with strong O...H...N hydrogen bonds. The journal of physical chemistry. A, 2009, 113, 13985-13997
1516359	CIF	C14 H14 N4 O6	C 1 2/c 1	11.72; 10.014; 12.187 90; 102.7; 90	1395.3	Schmidtmann, Marc; Farrugia, Louis J.; Middlemiss, Derek S.; Gutmann, Matthias J.; McIntyre, Garry J.; Wilson, Chick C. Experimental and theoretical charge density study of polymorphic isonicotinamide-oxalic acid molecular complexes with strong O...H...N hydrogen bonds. The journal of physical chemistry. A, 2009, 113, 13985-13997
1516360	CIF	C14 H14 N4 O6	P -1	3.6706; 7.6027; 12.478 85.523; 88.193; 84.252	345.31	Schmidtmann, Marc; Farrugia, Louis J.; Middlemiss, Derek S.; Gutmann, Matthias J.; McIntyre, Garry J.; Wilson, Chick C. Experimental and theoretical charge density study of polymorphic isonicotinamide-oxalic acid molecular complexes with strong O...H...N hydrogen bonds. The journal of physical chemistry. A, 2009, 113, 13985-13997
1516361	CIF	C14 H14 N4 O6	C 1 2/c 1	11.668; 9.9799; 12.1407 90; 102.747; 90	1378.89	Schmidtmann, Marc; Farrugia, Louis J.; Middlemiss, Derek S.; Gutmann, Matthias J.; McIntyre, Garry J.; Wilson, Chick C. Experimental and theoretical charge density study of polymorphic isonicotinamide-oxalic acid molecular complexes with strong O...H...N hydrogen bonds. The journal of physical chemistry. A, 2009, 113, 13985-13997
1516362	CIF	C72 H128.5 Co N14 O29 P	P 21 21 21	15.831; 22.374; 25.304 90; 90; 90	8963	Mebs, Stefan; Henn, Julian; Dittrich, Birger; Paulmann, Carsten; Luger, Peter Electron densities of three B12 vitamins. The journal of physical chemistry. A, 2009, 113, 8366-8378
1516363	CIF	C76 H132 Co N18 O30 P	P 21 21 21	15.12; 21.474; 27.219 90; 90; 90	8838	Mebs, Stefan; Henn, Julian; Dittrich, Birger; Paulmann, Carsten; Luger, Peter Electron densities of three B12 vitamins. The journal of physical chemistry. A, 2009, 113, 8366-8378
1516364	CIF	C63 H91 Co N13 O28.25 P	P 21 21 21	17.3; 17.69; 32.23 90; 90; 90	9864	Mebs, Stefan; Henn, Julian; Dittrich, Birger; Paulmann, Carsten; Luger, Peter Electron densities of three B12 vitamins. The journal of physical chemistry. A, 2009, 113, 8366-8378
1516365	CIF	C6 H5 N5 O6	P 1 c 1	7.309; 5.169; 11.583 90; 95.22; 90	435.8	Kohno, Yuji; Hiyoshi, Reiko I.; Yamaguchi, Yoshitaka; Matsumoto, Shinya; Koseki, Atsushi; Takahashi, Osamu; Yamasaki, Katsuyoshi; Ueda, Kazuyoshi Molecular dynamics studies of the structural change in 1,3-diamino-2,4,6-trinitrobenzene (DATB) in the crystalline state under high pressure. The journal of physical chemistry. A, 2009, 113, 2551-2560
1516366	CIF	C8 H5 Mn O3	P 1 21/n 1	10.7512; 6.9258; 11.6465 90; 115.794; 90	780.8	Borissova, Alexandra O.; Antipin, Mikhail Yu; Lyssenko, Konstantin A. Mutual influence of cyclopentadienyl and carbonyl ligands in cymantrene: QTAIM study. The journal of physical chemistry. A, 2009, 113, 10845-10851
1516367	CIF	C12 H18 N4 O8	P 1 21/c 1	7.2459; 20.9361; 9.7928 90; 97.402; 90	1473.2	Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking. The journal of physical chemistry. A, 2009, 113, 11354-11366
1516368	CIF	C12 H18 N4 O8	P 1 21/c 1	7.2445; 20.901; 9.7813 90; 97.413; 90	1468.7	Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking. The journal of physical chemistry. A, 2009, 113, 11354-11366
1516369	CIF	C10 H14 N4 O6	P 1 21/n 1	10.453; 9.464; 12.557 90; 102.551; 90	1212.5	Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking. The journal of physical chemistry. A, 2009, 113, 11354-11366
1516370	CIF	C16 H26 N4 O6	P -1	4.7244; 12.1071; 15.6874 84.553; 87.211; 88.585	892.01	Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking. The journal of physical chemistry. A, 2009, 113, 11354-11366
1516372	CIF	C10 H14 N4 O6	P 1 21/n 1	13.9814; 15.9511; 22.2275 90; 93.019; 90	4950.27	Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking. The journal of physical chemistry. A, 2009, 113, 11354-11366
1516373	CIF	C14 H22 N4 O6	P 1 21/n 1	8.3906; 14.517; 26.835 90; 91.427; 90	3267.7	Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking. The journal of physical chemistry. A, 2009, 113, 11354-11366
1516374	CIF	C22 H32 N4 O6	P c a 21	7.6093; 18.2086; 17.2841 90; 90; 90	2394.8	Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking. The journal of physical chemistry. A, 2009, 113, 11354-11366
1516375	CIF	C14 H22 N4 O6	P -1	4.8071; 10.6331; 16.15 80.715; 83.144; 87.224	808.5	Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking. The journal of physical chemistry. A, 2009, 113, 11354-11366
1516376	CIF	C10 H14 N4 O6	P b c a	17.4174; 7.0176; 19.344 90; 90; 90	2364.39	Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking. The journal of physical chemistry. A, 2009, 113, 11354-11366
1516377	CIF	C22 H18 N2	P b c n	12.7108; 7.8485; 34.116 90; 90; 90	3403.4	Yang, Jye-Shane; Lin, Cheng-Kai; Lahoti, Anand M.; Tseng, Chung-Kai; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming Effect of ground-state twisting on the trans ‒> cis photoisomerization and TICT state formation of aminostilbenes. The journal of physical chemistry. A, 2009, 113, 4868-4877
1516378	CIF	C22 H18 N2	P 1 21/n 1	10.0075; 28.672; 11.7698 90; 97.202; 90	3350.5	Yang, Jye-Shane; Lin, Cheng-Kai; Lahoti, Anand M.; Tseng, Chung-Kai; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming Effect of ground-state twisting on the trans ‒> cis photoisomerization and TICT state formation of aminostilbenes. The journal of physical chemistry. A, 2009, 113, 4868-4877
1516379	CIF	C22 H18 N2	P -1	9.2398; 9.8013; 19.7269 83.604; 87.026; 70.912	1677.5	Yang, Jye-Shane; Lin, Cheng-Kai; Lahoti, Anand M.; Tseng, Chung-Kai; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming Effect of ground-state twisting on the trans ‒> cis photoisomerization and TICT state formation of aminostilbenes. The journal of physical chemistry. A, 2009, 113, 4868-4877
1516380	CIF	C23 H20 N2	P 1 21/c 1	16.0282; 13.2482; 8.2983 90; 100.83; 90	1730.72	Yang, Jye-Shane; Lin, Cheng-Kai; Lahoti, Anand M.; Tseng, Chung-Kai; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming Effect of ground-state twisting on the trans ‒> cis photoisomerization and TICT state formation of aminostilbenes. The journal of physical chemistry. A, 2009, 113, 4868-4877
1516381	CIF	C23 H18 N2	P b c a	15.7; 6.8425; 33.139 90; 90; 90	3560	Yang, Jye-Shane; Lin, Cheng-Kai; Lahoti, Anand M.; Tseng, Chung-Kai; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming Effect of ground-state twisting on the trans ‒> cis photoisomerization and TICT state formation of aminostilbenes. The journal of physical chemistry. A, 2009, 113, 4868-4877
1516382	CIF	C23 H18 N2	P 1 21/c 1	7.589; 19.3827; 11.5468 90; 94.827; 90	1692.5	Yang, Jye-Shane; Lin, Cheng-Kai; Lahoti, Anand M.; Tseng, Chung-Kai; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming Effect of ground-state twisting on the trans ‒> cis photoisomerization and TICT state formation of aminostilbenes. The journal of physical chemistry. A, 2009, 113, 4868-4877
1516383	CIF	C19 H18 Cl2 N4	P 1 21 1	7.6007; 7.3647; 16.11 90; 93.9836; 90	899.61	Ma, Yan; Hao, Rui; Shao, Guangsheng; Wang, Yuan An excellent fluorescent dye with a twistable aromatic chain and its axially chiral crystals. The journal of physical chemistry. A, 2009, 113, 5066-5072
1516384	CIF	C5 H6 N2 O4	P 1 21/a 1	15.77423; 8.07596; 5.00886 90; 111.009; 90	595.671	Guidoni, Leonardo; Gontrani, Lorenzo; Bencivenni, Luigi; Sadun, Claudia; Ballirano, Paolo Overcoming the inadequacy of X-ray powder diffraction in reliable hydrogen location with the aid of first principles calculations: crystal structure determination of orotaldehyde monohydrate. The journal of physical chemistry. A, 2009, 113, 353-359
1516385	CIF	C14 H9 N O3	P 1 21/c 1	11.4213; 12.9119; 7.4058 90; 99.8483; 90	1076.04	Chen, Chyi-Lin; Lin, Chun-Wei; Hsieh, Cheng-Chih; Lai, Chin-Hung; Lee, Gene-Hsiang; Wang, Chih-Chieh; Chou, Pi-Tai Dual excited-state intramolecular proton transfer reaction in 3-hydroxy-2-(pyridin-2-yl)-4H-chromen-4-one. The journal of physical chemistry. A, 2009, 113, 205-214
1516386	CIF	C3 H5 Li O2	P 1 21/c 1	9.609; 4.941; 8.648 90; 94.99; 90	409.03	Martínez Casado, F J; Ramos Riesco, M.; García Pérez, M V; Redondo, M. I.; López-Andrés, S; Rodríguez Cheda, J A Structural and thermodynamic study on short metal alkanoates: lithium propanoate and pentanoate. The journal of physical chemistry. B, 2009, 113, 12896-12902
1516387	CIF	C3 H5 Li O2	P 1 21/c 1	9.823; 4.933; 8.812 90; 96.86; 90	423.94	Martínez Casado, F J; Ramos Riesco, M.; García Pérez, M V; Redondo, M. I.; López-Andrés, S; Rodríguez Cheda, J A Structural and thermodynamic study on short metal alkanoates: lithium propanoate and pentanoate. The journal of physical chemistry. B, 2009, 113, 12896-12902
1516388	CIF	C3 H5 Li O2	P 1 21/c 1	9.646; 4.932; 8.698 90; 95.36; 90	411.99	Martínez Casado, F J; Ramos Riesco, M.; García Pérez, M V; Redondo, M. I.; López-Andrés, S; Rodríguez Cheda, J A Structural and thermodynamic study on short metal alkanoates: lithium propanoate and pentanoate. The journal of physical chemistry. B, 2009, 113, 12896-12902
1516389	CIF	C5 H9 Li O2	P 1 21/c 1	14.181; 4.889; 8.63 90; 95.81; 90	595.3	Martínez Casado, F J; Ramos Riesco, M.; García Pérez, M V; Redondo, M. I.; López-Andrés, S; Rodríguez Cheda, J A Structural and thermodynamic study on short metal alkanoates: lithium propanoate and pentanoate. The journal of physical chemistry. B, 2009, 113, 12896-12902
1516390	CIF	C5 H9 Li O2	P 1 21/c 1	14.358; 4.941; 8.846 90; 93.92; 90	626.1	Martínez Casado, F J; Ramos Riesco, M.; García Pérez, M V; Redondo, M. I.; López-Andrés, S; Rodríguez Cheda, J A Structural and thermodynamic study on short metal alkanoates: lithium propanoate and pentanoate. The journal of physical chemistry. B, 2009, 113, 12896-12902
1516391	CIF	C39 H39 N5 O6	P 1 21/c 1	10.441; 42.197; 8.299 90; 111.46; 90	3402.9	Ghosh, Kumaresh; Masanta, Goutam; Fröhlich, Roland; Petsalakis, Ioannis D.; Theodorakopoulos, Giannoula Triphenylamine-based receptors in selective recognition of dicarboxylic acids. The journal of physical chemistry. B, 2009, 113, 7800-7809
1516392	CIF	C38 H35 Br Cl3 N5 O6	P 1 21/n 1	11.886; 19.507; 16.746 90; 103.22; 90	3779.8	Ghosh, Kumaresh; Masanta, Goutam; Fröhlich, Roland; Petsalakis, Ioannis D.; Theodorakopoulos, Giannoula Triphenylamine-based receptors in selective recognition of dicarboxylic acids. The journal of physical chemistry. B, 2009, 113, 7800-7809
1516393	CIF	C72 H81 N3 O6	P -1	11.39; 12.106; 24.799 103.162; 95.459; 108.054	3114.6	Chinta, Jugun Prakash; Acharya, Amitabha; Kumar, Amit; Rao, Chebrolu P. Spectroscopy and microscopy studies of the recognition of amino acids and aggregation of proteins by Zn(II) complex of lower rim naphthylidene conjugate of calix[4]arene. The journal of physical chemistry. B, 2009, 113, 12075-12083
1516394	CIF	C92 H156 Br Cl N30 O53	P -1	14.97; 15.11; 29.968 104.6; 102.7; 90	6388	Fedorova, Olga A.; Chernikova, Ekaterina Yu; Fedorov, Yuri V.; Gulakova, Elena N.; Peregudov, Aleksander S.; Lyssenko, Konstantin A.; Jonusauskas, Gediminas; Isaacs, Lyle Cucurbit[7]uril complexes of crown-ether derived styryl and (bis)styryl dyes. The journal of physical chemistry. B, 2009, 113, 10149-10158
1516395	CIF	C6 H6 Eu O9	P n n m	13.4361; 6.625; 10.1416 90; 90; 90	902.75	Rodrigues, Marcelo O.; Paz, Filipe A Almeida; Freire, Ricardo O.; de Sá, Gilberto F; Galembeck, André; Montenegro, Maria C. B. S. M.; Araújo, Alberto N; Alves, S. Modeling, structural, and spectroscopic studies of lanthanide-organic frameworks. The journal of physical chemistry. B, 2009, 113, 12181-12188
1516396	CIF	C6 H6 Gd O9	P n n m	13.3662; 6.5897; 10.1045 90; 90; 90	890	Rodrigues, Marcelo O.; Paz, Filipe A Almeida; Freire, Ricardo O.; de Sá, Gilberto F; Galembeck, André; Montenegro, Maria C. B. S. M.; Araújo, Alberto N; Alves, S. Modeling, structural, and spectroscopic studies of lanthanide-organic frameworks. The journal of physical chemistry. B, 2009, 113, 12181-12188
1516397	CIF	C6 H6 O9 Tb	P n n m	13.341; 6.5718; 10.0912 90; 90; 90	884.74	Rodrigues, Marcelo O.; Paz, Filipe A Almeida; Freire, Ricardo O.; de Sá, Gilberto F; Galembeck, André; Montenegro, Maria C. B. S. M.; Araújo, Alberto N; Alves, S. Modeling, structural, and spectroscopic studies of lanthanide-organic frameworks. The journal of physical chemistry. B, 2009, 113, 12181-12188
1516398	CIF	C21 H15 N6 Ni S4	P 1 21/c 1	12.137; 26.69; 7.526 90; 103.896; 90	2366.6	Tian, Zhengfang; Duan, Haibao; Ren, Xiaoming; Lu, Changsheng; Li, Yizhi; Song, You; Zhu, Huizhen; Meng, Qingjin Two spin-peierls-like compounds exhibiting divergent structural features, lattice compression, and expansion in the low- temperature phase. The journal of physical chemistry. B, 2009, 113, 8278-8283
1516399	CIF	C21 H14 N5 Ni S4	P 1 21/c 1	12.123; 26.446; 7.389 90; 103.168; 90	2306.7	Tian, Zhengfang; Duan, Haibao; Ren, Xiaoming; Lu, Changsheng; Li, Yizhi; Song, You; Zhu, Huizhen; Meng, Qingjin Two spin-peierls-like compounds exhibiting divergent structural features, lattice compression, and expansion in the low- temperature phase. The journal of physical chemistry. B, 2009, 113, 8278-8283
1516400	CIF	C21 H14 N5 Ni S4	P -1	7.239; 12.109; 26.347 88.629; 86.36; 76.992	2245.6	Tian, Zhengfang; Duan, Haibao; Ren, Xiaoming; Lu, Changsheng; Li, Yizhi; Song, You; Zhu, Huizhen; Meng, Qingjin Two spin-peierls-like compounds exhibiting divergent structural features, lattice compression, and expansion in the low- temperature phase. The journal of physical chemistry. B, 2009, 113, 8278-8283
1516401	CIF	C21 H15 N6 Ni S4	P -1	7.311; 12.252; 28.68 91.557; 92.682; 104.625	2481	Tian, Zhengfang; Duan, Haibao; Ren, Xiaoming; Lu, Changsheng; Li, Yizhi; Song, You; Zhu, Huizhen; Meng, Qingjin Two spin-peierls-like compounds exhibiting divergent structural features, lattice compression, and expansion in the low- temperature phase. The journal of physical chemistry. B, 2009, 113, 8278-8283
1516402	CIF	C10 H18 Cl3 Eu N2 O5	P -1	6.9602; 11.046; 11.432 89.2875; 85.9659; 75.6017	849.19	Puntus, Lada N.; Lyssenko, Konstantin A.; Pekareva, Irina S.; Bünzli, Jean-Claude G Intermolecular interactions as actors in energy-transfer processes in lanthanide complexes with 2,2'-bipyridine. The journal of physical chemistry. B, 2009, 113, 9265-9277
1516403	CIF	C10 H18 Cl3 N2 O5 Tb	P -1	6.9347; 10.9975; 11.4293 89.275; 85.846; 75.644	842.2	Puntus, Lada N.; Lyssenko, Konstantin A.; Pekareva, Irina S.; Bünzli, Jean-Claude G Intermolecular interactions as actors in energy-transfer processes in lanthanide complexes with 2,2'-bipyridine. The journal of physical chemistry. B, 2009, 113, 9265-9277
1516404	CIF	C20 H38.3 Cl6 Eu2 N4 O11.15	P -1	8.0772; 9.4719; 24.046 86.23; 87.6618; 75.2674	1774.79	Puntus, Lada N.; Lyssenko, Konstantin A.; Pekareva, Irina S.; Bünzli, Jean-Claude G Intermolecular interactions as actors in energy-transfer processes in lanthanide complexes with 2,2'-bipyridine. The journal of physical chemistry. B, 2009, 113, 9265-9277
1516405	CIF	C20 H38.3 Cl6 N4 O11.15 Tb2	P -1	8.0501; 9.4525; 23.9554 86.419; 87.878; 75.301	1759.33	Puntus, Lada N.; Lyssenko, Konstantin A.; Pekareva, Irina S.; Bünzli, Jean-Claude G Intermolecular interactions as actors in energy-transfer processes in lanthanide complexes with 2,2'-bipyridine. The journal of physical chemistry. B, 2009, 113, 9265-9277
1516406	CIF	C20 H20 Cl3 Eu N4 O2	C 1 2/c 1	15.6601; 11.3228; 13.9002 90; 117.066; 90	2194.8	Puntus, Lada N.; Lyssenko, Konstantin A.; Pekareva, Irina S.; Bünzli, Jean-Claude G Intermolecular interactions as actors in energy-transfer processes in lanthanide complexes with 2,2'-bipyridine. The journal of physical chemistry. B, 2009, 113, 9265-9277
1516407	CIF	C20 H26 Cl3 N4 O5 Tb	P 1 21/n 1	17.0971; 9.2782; 17.1306 90; 116.493; 90	2432.1	Puntus, Lada N.; Lyssenko, Konstantin A.; Pekareva, Irina S.; Bünzli, Jean-Claude G Intermolecular interactions as actors in energy-transfer processes in lanthanide complexes with 2,2'-bipyridine. The journal of physical chemistry. B, 2009, 113, 9265-9277
1516408	CIF	C20 H22 Cl3 Eu N4 O3	P -1	7.4596; 17.774; 19.394 66.106; 88.232; 83.116	2333.6	Puntus, Lada N.; Lyssenko, Konstantin A.; Pekareva, Irina S.; Bünzli, Jean-Claude G Intermolecular interactions as actors in energy-transfer processes in lanthanide complexes with 2,2'-bipyridine. The journal of physical chemistry. B, 2009, 113, 9265-9277
1516409	CIF	C22.5 H28.24 Cl3 Eu N4 O3.62	I 2 3	25.8471; 25.8471; 25.8471 90; 90; 90	17268	Puntus, Lada N.; Lyssenko, Konstantin A.; Pekareva, Irina S.; Bünzli, Jean-Claude G Intermolecular interactions as actors in energy-transfer processes in lanthanide complexes with 2,2'-bipyridine. The journal of physical chemistry. B, 2009, 113, 9265-9277
1516410	CIF	C20 H24 Cl2 Cu N4 O6	P 21 21 21	6.6825; 16.2052; 20.21 90; 90; 90	2188.6	Offenbacher, Adam; White, Kimberly N.; Sen, Indranil; Oliver, Allen G.; Konopelski, Joseph P.; Barry, Bridgette A.; Einarsdóttir, Olöf A spectroscopic investigation of a tridentate Cu-complex mimicking the tyrosine-histidine cross-link of cytochrome C oxidase. The journal of physical chemistry. B, 2009, 113, 7407-7417
1516411	CIF	C6 H5 N O3	P -1	6.976; 11.231; 16.29 82.55; 78.279; 75.166	1203.9	Santos, Rui C.; Figueira, Rita M. B. B. M.; Piedade, M Fátima M; Diogo, Hermínio P; Minas da Piedade, Manuel E. Energetics and structure of hydroxynicotinic acids. Crystal structures of 2-, 4-, 6-hydroxynicotinic and 5-chloro-6-hydroxynicotinic acids. The journal of physical chemistry. B, 2009, 113, 14291-14309
1516412	CIF	C6 H4 Cl N O3	P 1 21/c 1	5.469; 10.529; 11.795 90; 97.72; 90	673	Santos, Rui C.; Figueira, Rita M. B. B. M.; Piedade, M Fátima M; Diogo, Hermínio P; Minas da Piedade, Manuel E. Energetics and structure of hydroxynicotinic acids. Crystal structures of 2-, 4-, 6-hydroxynicotinic and 5-chloro-6-hydroxynicotinic acids. The journal of physical chemistry. B, 2009, 113, 14291-14309
1516413	CIF	C6 H5 N O3	P 1 21/n 1	3.797; 7.354; 20.905 90; 90.007; 90	583.7	Santos, Rui C.; Figueira, Rita M. B. B. M.; Piedade, M Fátima M; Diogo, Hermínio P; Minas da Piedade, Manuel E. Energetics and structure of hydroxynicotinic acids. Crystal structures of 2-, 4-, 6-hydroxynicotinic and 5-chloro-6-hydroxynicotinic acids. The journal of physical chemistry. B, 2009, 113, 14291-14309
1516414	CIF	C6 H5 N O3	P 1 21/c 1	3.804; 14.582; 10.673 90; 94.254; 90	590.4	Santos, Rui C.; Figueira, Rita M. B. B. M.; Piedade, M Fátima M; Diogo, Hermínio P; Minas da Piedade, Manuel E. Energetics and structure of hydroxynicotinic acids. Crystal structures of 2-, 4-, 6-hydroxynicotinic and 5-chloro-6-hydroxynicotinic acids. The journal of physical chemistry. B, 2009, 113, 14291-14309
1516415	CIF	C7 H14 F6 N2 O5 S2	P n a 21	9.657; 11.141; 14.651 90; 90; 90	1576	Nockemann, Peter; Binnemans, Koen; Thijs, Ben; Parac-Vogt, Tatjana N; Merz, Klaus; Mudring, Anja-Verena; Menon, Preethy Chirukandath; Rajesh, Ravindran Nair; Cordoyiannis, George; Thoen, Jan; Leys, Jan; Glorieux, Christ Temperature-driven mixing-demixing behavior of binary mixtures of the ionic liquid choline bis(trifluoromethylsulfonyl)imide and water. The journal of physical chemistry. B, 2009, 113, 1429-1437
1516416	CIF	C23 H125 N O41	P -6 m 2	12.15; 12.15; 12.58 90; 90; 120	1608.3	Terekhova, Irina S.; Manakov, Andrey Yu; Soldatov, Dmitriy V.; Suwinska, Kinga; Skiba, Sergey S.; Stenin, Yuri G.; Villevald, Galina V.; Karpova, Tamara D.; Yunoshev, Alexander S. Calorimetric and X-ray studies of clathrate hydrates of tetraisoamylammonium polyacrylates. The journal of physical chemistry. B, 2009, 113, 5760-5768
1516417	CIF	C54 H78 I2 N26 O20	P 1 21/n 1	11.8818; 24.8098; 22.2737 90; 92.249; 90	6560.9	Khan, Muhammad S. A.; Heger, Dominik; Necas, Marek; Sindelar, Vladimir Remarkable salt effect on stability of supramolecular complex between modified cucurbit[6]uril and methylviologen in aqueous media. The journal of physical chemistry. B, 2009, 113, 11054-11057
1516418	CIF	C45 H92 N24 O32	P -1	11.649; 16.574; 17.187 90.1; 102.57; 98.12	3204	Khan, Muhammad S. A.; Heger, Dominik; Necas, Marek; Sindelar, Vladimir Remarkable salt effect on stability of supramolecular complex between modified cucurbit[6]uril and methylviologen in aqueous media. The journal of physical chemistry. B, 2009, 113, 11054-11057
1516419	CIF	C24 H12 F6 O2 S2	C m c a	6.844; 22.211; 13.877 90; 90; 90	2109	Ie, Yutaka; Nitani, Masashi; Uemura, Takafumi; Tominari, Yukihiro; Takeya, Jun; Honsho, Yoshihito; Saeki, Akinori; Seki, Shu; Aso, Yoshio Comprehensive Evaluation of Electron Mobility for a Trifluoroacetyl-Terminated Electronegative Conjugated Oligomer The Journal of Physical Chemistry C, 2009, 113, 17189
1516420	CIF	C30 H22	P 1 21/n 1	5.25; 9.4591; 20.734 90; 90.7; 90	1029.6	He, Jiating; Xu, Bin; Chen, Feipeng; Xia, Haijian; Li, Kunpeng; Ye, Ling; Tian, Wenjing Aggregation-Induced Emission in the Crystals of 9,10-Distyrylanthracene Derivatives: The Essential Role of Restricted Intramolecular Torsion The Journal of Physical Chemistry C, 2009, 113, 9892
1516421	CIF	C38 H38 O2	P -1	9.5989; 12.563; 14.354 110.05; 107.52; 99.46	1479.8	He, Jiating; Xu, Bin; Chen, Feipeng; Xia, Haijian; Li, Kunpeng; Ye, Ling; Tian, Wenjing Aggregation-Induced Emission in the Crystals of 9,10-Distyrylanthracene Derivatives: The Essential Role of Restricted Intramolecular Torsion The Journal of Physical Chemistry C, 2009, 113, 9892
1516422	CIF	C38 H38 O2	P 1 21/c 1	9.2404; 8.6917; 18.711 90; 97.04; 90	1491.4	He, Jiating; Xu, Bin; Chen, Feipeng; Xia, Haijian; Li, Kunpeng; Ye, Ling; Tian, Wenjing Aggregation-Induced Emission in the Crystals of 9,10-Distyrylanthracene Derivatives: The Essential Role of Restricted Intramolecular Torsion The Journal of Physical Chemistry C, 2009, 113, 9892
1516423	CIF	C32 H26 O2	P -1	6.9598; 8.8751; 10.465 101.5; 99.17; 105.19	595.8	He, Jiating; Xu, Bin; Chen, Feipeng; Xia, Haijian; Li, Kunpeng; Ye, Ling; Tian, Wenjing Aggregation-Induced Emission in the Crystals of 9,10-Distyrylanthracene Derivatives: The Essential Role of Restricted Intramolecular Torsion The Journal of Physical Chemistry C, 2009, 113, 9892
1516424	CIF	H4 Li2.79 Mg2.66 N4	I -4 2 m	5.12981; 5.12981; 9.6191 90; 90; 90	253.13	Weidner, Eveline; Dolci, Francesco; Hu, Jianjiang; Lohstroh, Wiebke; Hansen, Thomas; Bull, Daniel J.; Fichtner, Maximilian Hydrogenation Reaction Pathway in Li2Mg(NH)2 The Journal of Physical Chemistry C, 2009, 113, 15772
1516425	CIF	C23 H33 N S	C 1 2/c 1	38.898; 6.1786; 19.3956 90; 112.449; 90	4308.2	Bourque, Alex N.; Dufresne, Stéphane; Skene, W. G. Thiophene-Phenyl Azomethines with Varying Rotational Barriers - Model Compounds for Examining Imine Fluorescence Deactivation The Journal of Physical Chemistry C, 2009, 113, 19677
1516426	CIF	C166 H64 N12 Ni2	C 1 2/c 1	36.842; 14.498; 24.607 90; 115.396; 90	11873	Nobukuni, Hirofumi; Tani, Fumito; Shimazaki, Yuichi; Naruta, Yoshinori; Ohkubo, Kei; Nakanishi, Tatsuaki; Kojima, Takahiko; Fukuzumi, Shunichi; Seki, Shu Anisotropic High Electron Mobility and Photodynamics of a Self-Assembled Porphyrin Nanotube Including C60Molecules The Journal of Physical Chemistry C, 2009, 113, 19694
1516427	CIF	C21 H21 N Si	P c c n	19.1697; 21.281; 9.166 90; 90; 90	3739.3	Han, Won-Sik; Son, Ho-Jin; Wee, Kyung-Ryang; Min, Kyoung-Tae; Kwon, Soonnam; Suh, Il-Hwan; Choi, Seung-Hoon; Jung, Dong Hyun; Kang, Sang Ook Silicon-Based Blue Phosphorescence Host Materials: Structure and Photophysical Property Relationship on Methyl/Phenylsilanes Adorned with 4-(N-Carbazolyl)phenyl Groups and Optimization of Their Electroluminescence by Peripheral 4-(N-Carbazolyl)phenyl Numbers The Journal of Physical Chemistry C, 2009, 113, 19686
1516428	CIF	C38 H30 N2 Si	P -1	8.4321; 12.7787; 13.8467 88.084; 81.072; 80.929	1455.4	Han, Won-Sik; Son, Ho-Jin; Wee, Kyung-Ryang; Min, Kyoung-Tae; Kwon, Soonnam; Suh, Il-Hwan; Choi, Seung-Hoon; Jung, Dong Hyun; Kang, Sang Ook Silicon-Based Blue Phosphorescence Host Materials: Structure and Photophysical Property Relationship on Methyl/Phenylsilanes Adorned with 4-(N-Carbazolyl)phenyl Groups and Optimization of Their Electroluminescence by Peripheral 4-(N-Carbazolyl)phenyl Numbers The Journal of Physical Chemistry C, 2009, 113, 19686
1516429	CIF	C56 H36 Cl2 N3 Si	P 1 21/c 1	15.3044; 20.9557; 14.1004 90; 97.804; 90	4480.3	Han, Won-Sik; Son, Ho-Jin; Wee, Kyung-Ryang; Min, Kyoung-Tae; Kwon, Soonnam; Suh, Il-Hwan; Choi, Seung-Hoon; Jung, Dong Hyun; Kang, Sang Ook Silicon-Based Blue Phosphorescence Host Materials: Structure and Photophysical Property Relationship on Methyl/Phenylsilanes Adorned with 4-(N-Carbazolyl)phenyl Groups and Optimization of Their Electroluminescence by Peripheral 4-(N-Carbazolyl)phenyl Numbers The Journal of Physical Chemistry C, 2009, 113, 19686
1516430	CIF	C72 H48 N4 Si	P -1	8.2688; 13.798; 23.516 79.314; 80.893; 81.98	2586.4	Han, Won-Sik; Son, Ho-Jin; Wee, Kyung-Ryang; Min, Kyoung-Tae; Kwon, Soonnam; Suh, Il-Hwan; Choi, Seung-Hoon; Jung, Dong Hyun; Kang, Sang Ook Silicon-Based Blue Phosphorescence Host Materials: Structure and Photophysical Property Relationship on Methyl/Phenylsilanes Adorned with 4-(N-Carbazolyl)phenyl Groups and Optimization of Their Electroluminescence by Peripheral 4-(N-Carbazolyl)phenyl Numbers The Journal of Physical Chemistry C, 2009, 113, 19686
1516431	CIF	C36 H27 N Si	P 1 21 1	12.622; 7.267; 16.01 90; 110.752; 90	1373	Han, Won-Sik; Son, Ho-Jin; Wee, Kyung-Ryang; Min, Kyoung-Tae; Kwon, Soonnam; Suh, Il-Hwan; Choi, Seung-Hoon; Jung, Dong Hyun; Kang, Sang Ook Silicon-Based Blue Phosphorescence Host Materials: Structure and Photophysical Property Relationship on Methyl/Phenylsilanes Adorned with 4-(N-Carbazolyl)phenyl Groups and Optimization of Their Electroluminescence by Peripheral 4-(N-Carbazolyl)phenyl Numbers The Journal of Physical Chemistry C, 2009, 113, 19686
1516432	CIF	C48 H34 N2 Si	C 1 2/c 1	17.632; 20.248; 30.81 90; 101.527; 90	10778	Han, Won-Sik; Son, Ho-Jin; Wee, Kyung-Ryang; Min, Kyoung-Tae; Kwon, Soonnam; Suh, Il-Hwan; Choi, Seung-Hoon; Jung, Dong Hyun; Kang, Sang Ook Silicon-Based Blue Phosphorescence Host Materials: Structure and Photophysical Property Relationship on Methyl/Phenylsilanes Adorned with 4-(N-Carbazolyl)phenyl Groups and Optimization of Their Electroluminescence by Peripheral 4-(N-Carbazolyl)phenyl Numbers The Journal of Physical Chemistry C, 2009, 113, 19686
1516433	CIF	C30 H20 N2	P 21 21 21	9.0748; 12.493; 19.025 90; 90; 90	2156.9	Han, Won-Sik; Son, Ho-Jin; Wee, Kyung-Ryang; Min, Kyoung-Tae; Kwon, Soonnam; Suh, Il-Hwan; Choi, Seung-Hoon; Jung, Dong Hyun; Kang, Sang Ook Silicon-Based Blue Phosphorescence Host Materials: Structure and Photophysical Property Relationship on Methyl/Phenylsilanes Adorned with 4-(N-Carbazolyl)phenyl Groups and Optimization of Their Electroluminescence by Peripheral 4-(N-Carbazolyl)phenyl Numbers The Journal of Physical Chemistry C, 2009, 113, 19686
1516434	CIF	B12 H12 Na2	P 1 21/n 1	7.03062; 10.65399; 7.0093 90; 94.6759; 90	523.28	Her, Jae-Hyuk; Zhou, Wei; Stavila, Vitalie; Brown, Craig M.; Udovic, Terrence J. Role of Cation Size on the Structural Behavior of the Alkali-Metal Dodecahydro-closo-Dodecaborates The Journal of Physical Chemistry C, 2009, 113, 11187
1516435	CIF	C32 H28 B F2 N2	P -1	6.7344; 13.4028; 14.985 74.755; 84.053; 76.716	1268.7	Hu, Rongrong; Lager, Erik; Aguilar-Aguilar, Angélica; Liu, Jianzhao; Lam, Jacky W. Y.; Sung, Herman H. Y.; Williams, Ian D.; Zhong, Yongchun; Wong, Kam Sing; Peña-Cabrera, Eduardo; Tang, Ben Zhong Twisted Intramolecular Charge Transfer and Aggregation-Induced Emission of BODIPY Derivatives The Journal of Physical Chemistry C, 2009, 113, 15845
1516436	CIF	C27 H20 B F2 N3	P 1 21/c 1	13.1915; 13.6706; 12.3036 90; 106.822; 90	2123.8	Hu, Rongrong; Lager, Erik; Aguilar-Aguilar, Angélica; Liu, Jianzhao; Lam, Jacky W. Y.; Sung, Herman H. Y.; Williams, Ian D.; Zhong, Yongchun; Wong, Kam Sing; Peña-Cabrera, Eduardo; Tang, Ben Zhong Twisted Intramolecular Charge Transfer and Aggregation-Induced Emission of BODIPY Derivatives The Journal of Physical Chemistry C, 2009, 113, 15845
1516437	CIF	C33 H34 Br N2 O10 Re	P -1	12.019; 12.068; 13.281 109.45; 105.58; 93.4	1726.1	Yam, Vivian Wing-Wah; Song, Hai-Ou; Chan, Steve Tak-Wah; Zhu, Nianyong; Tao, Chi-Hang; Wong, Keith Man-Chung; Wu, Li-Xin Synthesis, Characterization, Ion-Binding Properties, and Fluorescence Resonance Energy Transfer Behavior of Rhenium(I) Complexes Containing a Coumarin-Appended 2,2′-Bipyridine† The Journal of Physical Chemistry C, 2009, 113, 11674
1516438	CIF	C13 H13 N3 O3 S	C 1 2/c 1	29.3274; 6.97802; 16.074 90; 121.103; 90	2816.61	Tohnai, Norimitsu; Kurata, Mitsuru; Nakajima, Hiromi; Yamamoto, Atsushi; Hinoue, Tomoaki; Mizobe, Yuji; Hisaki, Ichiro; Miyata, Mikiji Effect of Steric Complementarity on Solid-State Optical Properties of Ternary CT Complexes: 4,4′-Biphenyldisulfonic Acid, Aliphatic Amines, and Tetracyanoquinodimethane† The Journal of Physical Chemistry C, 2009, 113, 11725
1516439	CIF	C14 H13 N3 O3 S	C 1 2/c 1	29.7095; 7.07728; 16.852 90; 122.519; 90	2987.79	Tohnai, Norimitsu; Kurata, Mitsuru; Nakajima, Hiromi; Yamamoto, Atsushi; Hinoue, Tomoaki; Mizobe, Yuji; Hisaki, Ichiro; Miyata, Mikiji Effect of Steric Complementarity on Solid-State Optical Properties of Ternary CT Complexes: 4,4′-Biphenyldisulfonic Acid, Aliphatic Amines, and Tetracyanoquinodimethane† The Journal of Physical Chemistry C, 2009, 113, 11725
1516440	CIF	C16 H18 N3 O3 S	C 1 2/c 1	30.9476; 6.97466; 17.6192 90; 121.616; 90	3238.63	Tohnai, Norimitsu; Kurata, Mitsuru; Nakajima, Hiromi; Yamamoto, Atsushi; Hinoue, Tomoaki; Mizobe, Yuji; Hisaki, Ichiro; Miyata, Mikiji Effect of Steric Complementarity on Solid-State Optical Properties of Ternary CT Complexes: 4,4′-Biphenyldisulfonic Acid, Aliphatic Amines, and Tetracyanoquinodimethane† The Journal of Physical Chemistry C, 2009, 113, 11725
1516441	CIF	C15 H13 N3 O3 S	P -1	7.0287; 8.6449; 13.1179 93.794; 99.168; 100.054	771.18	Tohnai, Norimitsu; Kurata, Mitsuru; Nakajima, Hiromi; Yamamoto, Atsushi; Hinoue, Tomoaki; Mizobe, Yuji; Hisaki, Ichiro; Miyata, Mikiji Effect of Steric Complementarity on Solid-State Optical Properties of Ternary CT Complexes: 4,4′-Biphenyldisulfonic Acid, Aliphatic Amines, and Tetracyanoquinodimethane† The Journal of Physical Chemistry C, 2009, 113, 11725
1516442	CIF	C48 H39 B Cu F4 N3 O P2 S	P -1	12.3282; 12.4191; 17.625 70.167; 78; 68.64	2353.1	Zhang, Liming; Li, Bin; Su, Zhongmin Realization of High-Energy Emission from [Cu(N−N)(P−P)]+Complexes for Organic Light-Emitting Diode Applications The Journal of Physical Chemistry C, 2009, 113, 13968
1516443	CIF	C48 H37 B Cu F4 N3 O P2	P 1 21/n 1	11.5602; 15.13; 25.815 90; 96.195; 90	4488.8	Zhang, Liming; Li, Bin; Su, Zhongmin Realization of High-Energy Emission from [Cu(N−N)(P−P)]+Complexes for Organic Light-Emitting Diode Applications The Journal of Physical Chemistry C, 2009, 113, 13968
1516444	CIF	C10 H38 Cl3 La O15	P 21 21 21	10.7084; 15.3419; 15.984 90; 90; 90	2626	Lindqvist-Reis, Patric; Walther, Clemens; Klenze, Reinhardt; Edelstein, Norman M. Optical Spectra and Crystal-Field Levels of [Cm(H2O)9]3+Ions withC3hSymmetry in Isotypic Rare-Earth Triflate and Ethyl Sulfate Salts The Journal of Physical Chemistry C, 2009, 113, 449
1516445	CIF	C96 H112 Cl6 Cu3 N24 O23.6	P -1	9.1548; 14.876; 22.3887 78.557; 84.283; 81.915	2950.64	Piepenbrock, Marc-Oliver M.; Clarke, Nigel; Steed, Jonathan W. Metal Ion and Anion-Based “Tuning” of a Supramolecular Metallogel† Langmuir, 2009, 25, 8451
1516446	CIF	C50 H68 Cu N14 O14	P -1	8.9533; 9.5321; 16.993 76.234; 86.011; 84.48	1400.4	Piepenbrock, Marc-Oliver M.; Clarke, Nigel; Steed, Jonathan W. Metal Ion and Anion-Based “Tuning” of a Supramolecular Metallogel† Langmuir, 2009, 25, 8451
1516447	CIF	C15 H10 Cl2 N4 O2	P -1	6.9301; 7.9168; 14.3648 101.341; 101.8; 92.392	753.63	Wackerly, Jay Wm.; Meyer, Joseph M.; Crannell, W. Christian; King, Sarah B.; Katz, Jeffrey L. Selective Synthesis of Poly(m-phenylene oxides) over Oxacalixarenes Macromolecules, 2009, 42, 8181
1516448	CIF	C15 H10 Cl2 N4 O2	C 1 2/c 1	16.219; 14.7254; 6.6795 90; 106.412; 90	1530.3	Wackerly, Jay Wm.; Meyer, Joseph M.; Crannell, W. Christian; King, Sarah B.; Katz, Jeffrey L. Selective Synthesis of Poly(m-phenylene oxides) over Oxacalixarenes Macromolecules, 2009, 42, 8181
1516449	CIF	C27 H38 B F4 N O0.5 P Rh	P -1	9.4341; 9.8954; 14.835 92.365; 107.922; 95.181	1308.84	Jiménez, M. Victoria; Pérez-Torrente, Jesús J.; Bartolomé, M. Isabel; Vispe, Eugenio; Lahoz, Fernando J.; Oro, Luis A. Cationic Rhodium Complexes with Hemilabile Phosphine Ligands as Polymerization Catalyst for High Molecular Weight Stereoregular Poly(phenylacetylene) Macromolecules, 2009, 42, 8146
1516450	CIF	C30 H29 B Cl3 F8 N P Rh	P 1 21/n 1	12.355; 19.72; 12.934 90; 93.83; 90	3144.2	Jiménez, M. Victoria; Pérez-Torrente, Jesús J.; Bartolomé, M. Isabel; Vispe, Eugenio; Lahoz, Fernando J.; Oro, Luis A. Cationic Rhodium Complexes with Hemilabile Phosphine Ligands as Polymerization Catalyst for High Molecular Weight Stereoregular Poly(phenylacetylene) Macromolecules, 2009, 42, 8146
1516451	CIF	C42 H58 N2 O2 Si2	C 1 c 1	26.914; 9.765; 16.289 90; 109.311; 90	4040.1	Salata, Michael R.; Marks, Tobin J. Catalyst Nuclearity Effects in Olefin Polymerization. Enhanced Activity and Comonomer Enchainment in Ethylene + Olefin Copolymerizations Mediated by Bimetallic Group 4 Phenoxyiminato Catalysts Macromolecules, 2009, 42, 1920
1516452	CIF	C36 H42 N2 O2	P 1 21/c 1	10.0592; 23.0731; 13.9928 90; 109.435; 90	3062.6	Salata, Michael R.; Marks, Tobin J. Catalyst Nuclearity Effects in Olefin Polymerization. Enhanced Activity and Comonomer Enchainment in Ethylene + Olefin Copolymerizations Mediated by Bimetallic Group 4 Phenoxyiminato Catalysts Macromolecules, 2009, 42, 1920
1516453	CIF	C48 H50 N8 O5	P c c n	30.312; 20.567; 6.777 90; 90; 90	4225	Ono, Katsuhiko; Tsukamoto, Kenichi; Hosokawa, Ryohei; Kato, Masaki; Suganuma, Motohiro; Tomura, Masaaki; Sako, Katsuya; Taga, Keijiro; Saito, Katsuhiro A linear chain of water molecules accommodated in a macrocyclic nanotube channel. Nano letters, 2009, 9, 122-125
1516456	CIF	Ca3 Cl2 O4 Si	P 1 21/c 1	5.912339; 10.201282; 10.988655 90; 90.3422; 90	662.752	Kim, Tae-Gon; Kim, Taehyung; Kim, Jaegyeom; Kim, Seung-Joo; Im, Seoung-Jae Interplay between Crystal Structure and Photoluminescence Properties of β-Ca3SiO4Cl2:Eu2+ The Journal of Physical Chemistry C, 2014, 118, 12428
1516457	CIF	C14 H19 N O2 S	P 1 21 1	7.3662; 17.2624; 11.3119 90; 107.957; 90	1368.33	Hirner, Sebastian; Kolb, Andreas; Westmeier, Johannes; Gebhardt, Sandra; Middel, Stephen; Harms, Klaus; von Zezschwitz, Paultheo Rhodium-catalyzed enantioselective addition of organoaluminum reagents to N-tosyl ketimines. Organic letters, 2014, 16, 3162-3165
1516458	CIF	C15 H21 N O2 S	P 21 21 21	7.6766; 17.0877; 22.6809 90; 90; 90	2975.2	Hirner, Sebastian; Kolb, Andreas; Westmeier, Johannes; Gebhardt, Sandra; Middel, Stephen; Harms, Klaus; von Zezschwitz, Paultheo Rhodium-catalyzed enantioselective addition of organoaluminum reagents to N-tosyl ketimines. Organic letters, 2014, 16, 3162-3165
1516459	CIF	C19 H21 N O2 S	P 21 21 21	9.7947; 9.9666; 16.9986 90; 90; 90	1659.4	Hirner, Sebastian; Kolb, Andreas; Westmeier, Johannes; Gebhardt, Sandra; Middel, Stephen; Harms, Klaus; von Zezschwitz, Paultheo Rhodium-catalyzed enantioselective addition of organoaluminum reagents to N-tosyl ketimines. Organic letters, 2014, 16, 3162-3165
1516460	CIF	C15 H23 N O2 S	P 1 21 1	10.2019; 13.2716; 11.3946 90; 100.893; 90	1515	Hirner, Sebastian; Kolb, Andreas; Westmeier, Johannes; Gebhardt, Sandra; Middel, Stephen; Harms, Klaus; von Zezschwitz, Paultheo Rhodium-catalyzed enantioselective addition of organoaluminum reagents to N-tosyl ketimines. Organic letters, 2014, 16, 3162-3165
1516461	CIF	C29 H23 N5 O2 S	P -1	9.4716; 10.8769; 11.9856 83.113; 83.385; 87.083	1216.8	Tokimizu, Yusuke; Oishi, Shinya; Fujii, Nobutaka; Ohno, Hiroaki Gold-Catalyzed Cascade Cyclization of (Azido)ynamides: An Efficient Strategy for the Construction of Indoloquinolines. Organic letters, 2014, 16, 3138-3141
1516462	CIF	C29 H22 N2 O2 S	P b c a	19.6725; 18.2791; 12.5149 90; 90; 90	4500.3	Tokimizu, Yusuke; Oishi, Shinya; Fujii, Nobutaka; Ohno, Hiroaki Gold-Catalyzed Cascade Cyclization of (Azido)ynamides: An Efficient Strategy for the Construction of Indoloquinolines. Organic letters, 2014, 16, 3138-3141
1516463	CIF	C140 H116 N12 O15 S20 Zn3	P -1	10.7122; 16.4862; 19.402 101.781; 102.522; 97.189	3222.6	Bill, Nathan L.; Ishida, Masatoshi; Kawashima, Yuki; Ohkubo, Kei; Sung, Young Mo; Lynch, Vincent M.; Lim, Jong Min; Kim, Dongho; Sessler, Jonathan L.; Fukuzumi, Shunichi Long-lived charge-separated states produced in supramolecular complexes between anionic and cationic porphyrins Chemical Science, 2014, 5, 3888
1516464	CIF	C26 H30 Cl N2 O4	C 1 2 1	21.651; 8.9952; 13.072 90; 92.662; 90	2543.1	Xu, Jianfeng; Mou, Chengli; Zhu, Tingshun; Song, Bao-An; Chi, Yonggui Robin N-heterocyclic carbene-catalyzed chemoselective cross-aza-benzoin reaction of enals with isatin-derived ketimines: access to chiral quaternary aminooxindoles. Organic letters, 2014, 16, 3272-3275
1516465	CIF	C65 H71 Cl4 N34 O29 Zn	P -1	17.6178; 18.0031; 18.3649 88.054; 64.192; 73.825	5010.6	Xiao, Xin; Sun, Nana; Qi, Dongdong; Jiang, Jianzhuang Unprecedented Cucurbituril-Based Ternary Host-Guest Supramolecular Polymers Mediated through Included Alkyl Chains Polymer Chemistry, 2014, 5, 5211-5217
1516466	CIF	C134 H142 Cl20 N68 O89 Zn4	P 1 2/n 1	23.2417; 17.5255; 30.5983 90; 108.234; 90	11837.5	Xiao, Xin; Sun, Nana; Qi, Dongdong; Jiang, Jianzhuang Unprecedented Cucurbituril-Based Ternary Host-Guest Supramolecular Polymers Mediated through Included Alkyl Chains Polymer Chemistry, 2014, 5, 5211-5217
1516467	CIF	C17 H12 N6 O3	P 1 21/c 1	14.3995; 12.2923; 17.5766 90; 92.766; 90	3107.49	Graham, Duncan; Fruk, Ljiljana; Ewen Smith, W. Detection of DNA probes using Diels Alder cycloaddition and SERRS The Analyst, 2003, 128, 692
1516468	CIF	C36 H44 K N4 O11.5	P -1	11.7592; 12.747; 13.3933 98.948; 100.21; 97.418	1926.2	Li, Chengjie; Ulrich, Markus; Liu, Xiujun; Wurst, Klaus; Müller, Thomas; Kräutler, Bernhard Blue transition metal complexes of a natural bilin-type chlorophyll catabolite Chemical Science, 2014, 5, 3388
1516469	CIF	C22 H34 N4 O4 Pd S	P 21 21 21	9.374; 14.5468; 19.7294 90; 90; 90	2690.33	Poveda, Ana; Alonso, Inés; Fernández-Ibáñez, M. Ángeles Experimental and computational studies on the mechanism of the Pd-catalyzed C(sp3)‒H γ-arylation of amino acid derivatives assisted by the 2-pyridylsulfonyl group Chemical Science, 2014, 5, 3873
1516470	CIF	C20 H26 O4	P 21 21 21	7.3028; 13.9746; 16.4665 90; 90; 90	1680.5	Chen, Shenxi; Zhang, Yang; Niu, Shubin; Liu, Xingzhong; Che, Yongsheng Cytotoxic Cleistanthane and Cassane Diterpenoids from the Entomogenous Fungus Paraconiothyrium hawaiiense. Journal of natural products, 2014, 77, 1513-1518
1516471	CIF	C20 H30 O5	P 21 21 21	7.2054; 8.0628; 31.8423 90; 90; 90	1849.9	Chen, Shenxi; Zhang, Yang; Niu, Shubin; Liu, Xingzhong; Che, Yongsheng Cytotoxic Cleistanthane and Cassane Diterpenoids from the Entomogenous Fungus Paraconiothyrium hawaiiense. Journal of natural products, 2014, 77, 1513-1518
1516472	CIF	C20 H14 O	P 1 21/c 1	5.584; 12.995; 19.423 90; 93.534; 90	1406.7	Ryerson, Joseph L.; Schrauben, Joel N.; Ferguson, Andrew J.; Sahoo, Subash Chandra; Naumov, Panče; Havlas, Zdenĕk; Michl, Josef; Nozik, Arthur J.; Johnson, Justin C. Two Thin Film Polymorphs of the Singlet Fission Compound 1,3-Diphenylisobenzofuran The Journal of Physical Chemistry C, 2014, 118, 12121
1516473	CIF	C20 H14 O	P 1 2/c 1	12.998; 5.59; 20.271 90; 106.215; 90	1414.3	Ryerson, Joseph L.; Schrauben, Joel N.; Ferguson, Andrew J.; Sahoo, Subash Chandra; Naumov, Panče; Havlas, Zdenĕk; Michl, Josef; Nozik, Arthur J.; Johnson, Justin C. Two Thin Film Polymorphs of the Singlet Fission Compound 1,3-Diphenylisobenzofuran The Journal of Physical Chemistry C, 2014, 118, 12121
1516474	CIF	C24 H43 N2 O Si Y	P 1 21/c 1	14.4575; 16.6903; 10.454 90; 95.093; 90	2512.6	Liu, Siqian; Du, Gaixia; He, Jianyun; Long, Yingyun; Zhang, Shaowen; Li, Xiaofang Cationic Tropidinyl Scandium Catalyst: A Perfectly Acceptable Substitute for Cationic Half-Sandwich Scandium Catalysts incis-1,4-Polymerization of Isoprene and Copolymerization with Norbornene Macromolecules, 2014, 47, 3567
1516475	CIF	C10 H17.5 N0.5 O0.5 Sc0.5 Si	P n m a	12.865; 16.159; 11.71 90; 90; 90	2434.3	Liu, Siqian; Du, Gaixia; He, Jianyun; Long, Yingyun; Zhang, Shaowen; Li, Xiaofang Cationic Tropidinyl Scandium Catalyst: A Perfectly Acceptable Substitute for Cationic Half-Sandwich Scandium Catalysts incis-1,4-Polymerization of Isoprene and Copolymerization with Norbornene Macromolecules, 2014, 47, 3567
1516476	CIF	C32 H62 Lu2 N2 O2 Si2	P n a 21	19.256; 10.164; 18.218 90; 90; 90	3565.6	Liu, Siqian; Du, Gaixia; He, Jianyun; Long, Yingyun; Zhang, Shaowen; Li, Xiaofang Cationic Tropidinyl Scandium Catalyst: A Perfectly Acceptable Substitute for Cationic Half-Sandwich Scandium Catalysts incis-1,4-Polymerization of Isoprene and Copolymerization with Norbornene Macromolecules, 2014, 47, 3567
1516477	CIF	C18 H18 Br N O4 S	P 1 21/c 1	12.50619; 11.55718; 12.58675 90; 97.3759; 90	1804.19	Medina, Florian; Besnard, Céline; Lacour, Jérôme One-Step Synthesis of Nitrogen-Containing Medium-Sized Rings via α-Imino Diazo Intermediates. Organic letters, 2014, 16, 3232-3235
1516478	CIF	C17 H16 Br N O4 S	P 1 21/a 1	12.4111; 11.2306; 12.7572 90; 98.363; 90	1759.24	Medina, Florian; Besnard, Céline; Lacour, Jérôme One-Step Synthesis of Nitrogen-Containing Medium-Sized Rings via α-Imino Diazo Intermediates. Organic letters, 2014, 16, 3232-3235
1516479	CIF	C9 H8 O4	P 1 21/c 1	11.233; 6.544; 11.231 90; 95.89; 90	821.2	Harrison, Andrew; Ibberson, Richard; Robb, Graeme; Whittaker, Gavin; Wilson, Chick; Youngson, Douglas In situ neutron diffraction studies of single crystals and powders during microwave irradiation Faraday Discussions, 2003, 122, 363-379
1516480	CIF	C9 H8 O4	P 1 21/c 1	11.233; 6.544; 11.231 90; 95.89; 90	821.2	Harrison, Andrew; Ibberson, Richard; Robb, Graeme; Whittaker, Gavin; Wilson, Chick; Youngson, Douglas In situ neutron diffraction studies of single crystals and powders during microwave irradiation Faraday Discussions, 2003, 122, 363-379
1516481	CIF	C9 H8 O4	P 1 21/c 1	11.233; 6.544; 11.231 90; 95.89; 90	821.2	Harrison, Andrew; Ibberson, Richard; Robb, Graeme; Whittaker, Gavin; Wilson, Chick; Youngson, Douglas In situ neutron diffraction studies of single crystals and powders during microwave irradiation Faraday Discussions, 2003, 122, 363-379
1516482	CIF	C9 H8 O4	P 1 21/c 1	11.233; 6.544; 11.231 90; 95.89; 90	821.2	Harrison, Andrew; Ibberson, Richard; Robb, Graeme; Whittaker, Gavin; Wilson, Chick; Youngson, Douglas In situ neutron diffraction studies of single crystals and powders during microwave irradiation Faraday Discussions, 2003, 122, 363-379
1516483	CIF	C28 H19 N O2	P 1 21/c 1	11.1602; 8.3306; 21.5276 90; 100.005; 90	1971.01	Reid, Gavin D.; Whittaker, Douglas J.; Roth, Wolfgang; Whitaker, Benjamin J.; Williamson, Matthew J. I.; Beddard, Godfrey S. Excited State Dynamics and Rapid Internal Conversion in a Stable Dipole Molecule Photochemical & Photobiological Sciences, 2003, 2, 585-590
1516484	CIF	C34 H46 N7 O8	P -1	11.154; 12.559; 14.72 73.76; 74.41; 82.1	1902.6	Darcos, Vincent; Griffith, Kirsten; Sallenave, Xavier; Desvergne, Jean-Pierre; Guyard-Duhayon, Carine; Hasenknopf, Bernold; Bassani, Dario M. Supramolecular control of [2 + 2] photodimerization via hydrogen bonding Photochemical & Photobiological Sciences, 2003, 2, 1152-1161
1516485	CIF	C20 H15 N O S	P 1 21/c 1	30.3283; 12.9666; 7.8988 90; 96.205; 90	3088.04	Pérez-Prieto, Julia; Galian, Raquel E.; Morant-Miñana, Maria C.; Miranda, Miguel A. Steady-state and time-resolved studies on the formation of skatolyl radicals photosensitized by 2-benzoylthiophene Photochemical & Photobiological Sciences, 2003, 2, 1200-1204
1516486	CIF	C56 H30 F22 S4	P -1	12.139; 13.875; 15.819 77.15; 83.416; 75.489	2509.9	Morimoto, Masakazu; Kobatake, Seiya; Irie, Masahiro Photochromism of diarylethenes in nanolayers of a single crystal Photochemical & Photobiological Sciences, 2003, 2, 1088-1094
1516487	CIF	C56 H30 F22 S4	P -1	11.737; 13.717; 15.352 76.844; 83.197; 75.445	2325	Morimoto, Masakazu; Kobatake, Seiya; Irie, Masahiro Photochromism of diarylethenes in nanolayers of a single crystal Photochemical & Photobiological Sciences, 2003, 2, 1088-1094
1516488	CIF	C28 H28 O5	P 1 21/n 1	17.2708; 5.714; 23.476 90; 98.234; 90	2292.9	Charette, André B.; Chong, Kenneth C. W.; Fournier, Jean-François; Patrick, Brian; Scheffer, John R. Asymmetric synthesis in a Norrish type II cleavage reaction induced by crystal chirality Photochemical & Photobiological Sciences, 2003, 2, 1052-1055
1516489	CIF	C27 H23 N O	P 1 21/c 1	10.872; 23.494; 24.378 90; 93.585; 90	6215	Yang, Jye-Shane; Wang, Chin-Min; Hwang, Chung-Yu; Liau, Kang-Ling; Chiou, Shih-Yi Origin of the N-methyl and N-phenyl substituent effects on the fluorescence vibronic structures of trans-4-aminostilbene and its derivatives in hexane Photochemical & Photobiological Sciences, 2003, 2, 1225-1231
1516490	CIF	C19 H14 O2	P b c a	26.9628; 15.3036; 6.9176 90; 90; 90	2854.39	Sundaryono, Agus; Nourmamode, Aziz; Gardrat, Christian; Grelier, Stéphane; Bravic, Georges; Chasseau, Daniel; Castellan, Alain Studies on the photochemistry of 1,7-diphenyl-1,6-heptadiene-3,5-dione, a non-phenolic curcuminoid model Photochemical & Photobiological Sciences, 2003, 2, 914-920
1516491	CIF	C6 H4 Cd N6 O2 Pt	F m -3 m	10.166; 10.166; 10.166 90; 90; 90	1050.6	Ware, Mike Prussian Blue: Artists' Pigment and Chemists' Sponge Journal of Chemical Education, 2008, 85, 612
1516492	CIF	C6 Cd N6 Pt	F m -3 m	10.166; 10.166; 10.166 90; 90; 90	1050.6	Ware, Mike Prussian Blue: Artists' Pigment and Chemists' Sponge Journal of Chemical Education, 2008, 85, 612
1516493	CIF	C20 H23 N O6	P 21 21 21	11.2062; 12.595; 12.8803 90; 90; 90	1818	Yan, Meng-Hong; Cheng, Pi; Jiang, Zhi-Yong; Ma, Yun-Bao; Zhang, Xue-Mei; Zhang, Feng-Xue; Yang, Liu-Meng; Zheng, Yong-Tang; Chen, Ji-Jun Periglaucines A-D, anti-HBV and -HIV-1 alkaloids from Pericampylus glaucus. Journal of natural products, 2008, 71, 760-763
1516498	CIF	C34 H28 N2 O4	P b c a	16.1351; 15.7795; 21.2316 90; 90; 90	5405.6	Frischmann, Peter D.; Jiang, Jian; Hui, Joseph K.-H.; Grzybowski, Joseph J.; MacLachlan, Mark J. Reversible-irreversible approach to Schiff base macrocycles: access to isomeric macrocycles with multiple salphen pockets. Organic letters, 2008, 10, 1255-1258
1516499	CIF	C38 H36 P2 S2	P 1 21/c 1	10.201; 19.08; 16.886 90; 98.7827; 90	3248	Furukawa, Shunsuke; Haga, Shunsuke; Kobayashi, Junji; Kawashima, Takayuki Synthesis of π-Extended Dibenzophospholes by Intramolecular Radical Cyclization and Their Properties. Organic letters, 2014, 16, 3228-3231
1516500	CIF	C38 H36 P2 S2	P -1	9.151; 12.814; 15.408 109.378; 91.446; 107.726	1607.4	Furukawa, Shunsuke; Haga, Shunsuke; Kobayashi, Junji; Kawashima, Takayuki Synthesis of π-Extended Dibenzophospholes by Intramolecular Radical Cyclization and Their Properties. Organic letters, 2014, 16, 3228-3231
1516501	CIF	C23 H23 N O6	P 21 21 21	7.4232; 16.138; 16.7378 90; 90; 90	2005.11	Xiao, You-Cai; Yue, Cai-Zhen; Chen, Peng-Qiao; Chen, Ying-Chun Asymmetric Dearomatic Diels-Alder Reactions of Diverse Heteroarenes via π-System Activation. Organic letters, 2014, 16, 3208-3211
1516502	CIF	C12.5 H17.5 Cl2 N2.5 O3 Ru S3	P 1 n 1	11.7724; 13.4968; 12.2285 90; 110.968; 90	1814.32	Chan, Siu-Chung; England, Jason; Wieghardt, Karl; Wong, Chun-Yuen Trapping of the putative 1,2-dinitrosoarene intermediate of benzofuroxan tautomerization by coordination at ruthenium and exploration of its redox non-innocence Chemical Science, 2014, 5, 3883
1516503	CIF	C13 H18 Cl2 N2 O7 Ru S3	P 1 21/c 1	16.4668; 19.6645; 12.6551 90; 106.281; 90	3933.53	Chan, Siu-Chung; England, Jason; Wieghardt, Karl; Wong, Chun-Yuen Trapping of the putative 1,2-dinitrosoarene intermediate of benzofuroxan tautomerization by coordination at ruthenium and exploration of its redox non-innocence Chemical Science, 2014, 5, 3883
1516504	CIF	C27 H22 F12 N6 O3 P2 Ru	P 1 21/c 1	14.059; 14.2401; 15.4559 90; 91.983; 90	3092.44	Chan, Siu-Chung; England, Jason; Wieghardt, Karl; Wong, Chun-Yuen Trapping of the putative 1,2-dinitrosoarene intermediate of benzofuroxan tautomerization by coordination at ruthenium and exploration of its redox non-innocence Chemical Science, 2014, 5, 3883
1516505	CIF	C27 H22 Cl2 F6 N6 O2 P Ru	P 1 21/c 1	13.5677; 14.3521; 15.4809 90; 95.869; 90	2998.7	Chan, Siu-Chung; England, Jason; Wieghardt, Karl; Wong, Chun-Yuen Trapping of the putative 1,2-dinitrosoarene intermediate of benzofuroxan tautomerization by coordination at ruthenium and exploration of its redox non-innocence Chemical Science, 2014, 5, 3883
1516506	CIF	C28 H24 Cl2 F6 N6 O3 P Ru	P b c n	14.1173; 15.5837; 28.1669 90; 90; 90	6196.71	Chan, Siu-Chung; England, Jason; Wieghardt, Karl; Wong, Chun-Yuen Trapping of the putative 1,2-dinitrosoarene intermediate of benzofuroxan tautomerization by coordination at ruthenium and exploration of its redox non-innocence Chemical Science, 2014, 5, 3883
1516507	CIF	C6 H10 Co La N6 O5	P 63/m	7.4597; 7.4597; 14.293 90; 90; 120	688.8	Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J. Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5) Chemical Science, 2014, 5, 3409
1516508	CIF	C6 H8 Fe K La N6 O4	P 63/m	7.3829; 7.3829; 13.871 90; 90; 120	654.78	Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J. Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5) Chemical Science, 2014, 5, 3409
1516509	CIF	C6 Fe K La N6	P -3 1 c	7.1852; 7.1852; 12.238 90; 90; 120	547.2	Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J. Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5) Chemical Science, 2014, 5, 3409
1516510	CIF	C6 H9 Co N6 O4.5 Pr	C m c m	7.431; 12.815; 14.298 90; 90; 90	1362	Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J. Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5) Chemical Science, 2014, 5, 3409
1516511	CIF	C6 H9 Fe N6 O4.5 Pr	C m c m	7.523; 13.117; 14.476 90; 90; 90	1428	Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J. Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5) Chemical Science, 2014, 5, 3409
1516512	CIF	C6 H8 Co N6 O4 Sm	C m c m	7.375; 12.742; 13.653 90; 90; 90	1283	Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J. Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5) Chemical Science, 2014, 5, 3409
1516513	CIF	C6 H8 Co Eu N6 O4	C m c m	7.3394; 12.75; 13.617 90; 90; 90	1274.2	Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J. Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5) Chemical Science, 2014, 5, 3409
1516514	CIF	C6 H6 Fe Lu N6 Na O3	C m c m	7.242; 12.578; 13.361 90; 90; 90	1217.1	Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J. Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5) Chemical Science, 2014, 5, 3409
1516515	CIF	C6 H8 Fe La Li N6 O4	P 63/m	7.2338; 7.2338; 14.2923 90; 90; 120	647.69	Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J. Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5) Chemical Science, 2014, 5, 3409
1516516	CIF	C6 H6 Fe Li Lu N6 O3	C m c m	7.2309; 12.5358; 13.2519 90; 90; 90	1201.2	Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J. Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5) Chemical Science, 2014, 5, 3409
1516517	CIF	C15 H15 N O2	P 1 21/n 1	10.2481; 10.1664; 12.1731 90; 93.195; 90	1266.3	Zhang, Zhi-Jing; Quan, Xue-Jing; Ren, Zhi-Hui; Wang, Yao-Yu; Guan, Zheng-Hui A Facile BPO-Mediated ortho-Hydroxylation and Benzoylation of N-Alkyl Anilines for Synthesis of 2-Benzamidophenols. Organic letters, 2014, 16, 3292-3295
1516518	CIF	C14 H13 N O2	P 1 21/c 1	8.226; 11.711; 13.239 90; 106.88; 90	1220.4	Zhang, Zhi-Jing; Quan, Xue-Jing; Ren, Zhi-Hui; Wang, Yao-Yu; Guan, Zheng-Hui A Facile BPO-Mediated ortho-Hydroxylation and Benzoylation of N-Alkyl Anilines for Synthesis of 2-Benzamidophenols. Organic letters, 2014, 16, 3292-3295
1516519	CIF	C16 H16 N2 O5	P 1 c 1	10.838; 11.225; 13.268 90; 107.879; 90	1536.2	Manin, Alex N.; Voronin, Alexander P.; Manin, Nikolay G.; Vener, Mikhail V.; Shishkina, Anastasia V.; Lermontov, Anatoly S.; Perlovich, German L. Salicylamide cocrystals: screening, crystal structure, sublimation thermodynamics, dissolution, and solid-state DFT calculations. The journal of physical chemistry. B, 2014, 118, 6803-6814
1516520	CIF	C27 H26 Cr F3 N4 O5	P 1 21/c 1	12.2189; 13.6109; 15.9826 90; 102.501; 90	2595.1	Elmas, Sait; Subhani, Muhammad A.; Harrer, Marcus; Leitner, Walter; Sundermeyer, Jörg; Müller, Thomas E. Highly active Cr(iii) catalysts for the reaction of CO2 with epoxides Catalysis Science & Technology, 2014, 4, 1652
1516521	CIF	C28 H33 Cl Cr N5 O4	P 1 21/n 1	9.8802; 14.1274; 19.4439 90; 94.197; 90	2706.73	Elmas, Sait; Subhani, Muhammad A.; Harrer, Marcus; Leitner, Walter; Sundermeyer, Jörg; Müller, Thomas E. Highly active Cr(iii) catalysts for the reaction of CO2 with epoxides Catalysis Science & Technology, 2014, 4, 1652
1516522	CIF	C26 H31 N O5	P 21 21 21	7.495; 10.4454; 35.197 90; 90; 90	2755.5	Letort, Aurélien; Aouzal, Rémi; Ma, Cong; Long, De-Liang; Prunet, Joëlle Highly efficient synthesis of the tricyclic core of taxol by cascade metathesis. Organic letters, 2014, 16, 3300-3303
1516523	CIF	C15 H18 N2 O2	P 1 21 1	6.546; 12.058; 8.846 90; 97.94; 90	691.5	Kise, Naoki; Hamada, Yusuke; Sakurai, Toshihiko Electroreductive Coupling of Optically Active α,β-Unsaturated Carbonyl Compounds with Diaryl Ketones: Asymmetric Synthesis of 4,5,5-Trisubstituted γ-Butyrolactones. Organic letters, 2014, 16, 3348-3351
1516524	CIF	C24 H20 O2	P 21 21 21	8.9315; 9.1942; 21.867 90; 90; 90	1795.7	Kise, Naoki; Hamada, Yusuke; Sakurai, Toshihiko Electroreductive Coupling of Optically Active α,β-Unsaturated Carbonyl Compounds with Diaryl Ketones: Asymmetric Synthesis of 4,5,5-Trisubstituted γ-Butyrolactones. Organic letters, 2014, 16, 3348-3351
1516525	CIF	C35 H34 N2 O3	P 21 21 21	8.284; 13.944; 23.978 90; 90; 90	2770	Kise, Naoki; Hamada, Yusuke; Sakurai, Toshihiko Electroreductive Coupling of Optically Active α,β-Unsaturated Carbonyl Compounds with Diaryl Ketones: Asymmetric Synthesis of 4,5,5-Trisubstituted γ-Butyrolactones. Organic letters, 2014, 16, 3348-3351
1516526	CIF	C28 H30 N2 O3	P 1	6.63; 8.27; 22.07 89.6; 87.7; 80	1191	Kise, Naoki; Hamada, Yusuke; Sakurai, Toshihiko Electroreductive Coupling of Optically Active α,β-Unsaturated Carbonyl Compounds with Diaryl Ketones: Asymmetric Synthesis of 4,5,5-Trisubstituted γ-Butyrolactones. Organic letters, 2014, 16, 3348-3351
1516527	CIF	C19 H22 N2 O4	P 1 21/c 1	7.297; 12.192; 19.971 90; 94.898; 90	1770.2	Patel, Pitambar; Chang, Sukbok N-substituted hydroxylamines as synthetically versatile amino sources in the iridium-catalyzed mild C-h amidation reaction. Organic letters, 2014, 16, 3328-3331
1516528	CIF	C26 H29 F3 Ir N O4	P 1 21/n 1	16.479; 8.855; 17.7803 90; 103.143; 90	2526.6	Patel, Pitambar; Chang, Sukbok N-substituted hydroxylamines as synthetically versatile amino sources in the iridium-catalyzed mild C-h amidation reaction. Organic letters, 2014, 16, 3328-3331
1516529	CIF	C20 H20 N2 O2	P 1 21/n 1	9.508; 10.4245; 17.1939 90; 98.397; 90	1685.92	Patel, Pitambar; Chang, Sukbok N-substituted hydroxylamines as synthetically versatile amino sources in the iridium-catalyzed mild C-h amidation reaction. Organic letters, 2014, 16, 3328-3331
1516530	CIF	C39 H55 F N3 Nb	P -1	10.795; 12.323; 13.68 79.363; 87.377; 88.428	1786.3	Gianetti, Thomas L.; Bergman, Robert G.; Arnold, John Carbon‒fluorine bond cleavage in fluoroarenes via a niobium(iii) imido complex: from stoichiometric to catalytic hydrodefluorination Chemical Science, 2014, 5, 2517
1516531	CIF	C39 H53 F2 N3 Nb	P -1	10.8194; 12.3148; 13.7249 79.695; 87.396; 88.376	1797	Gianetti, Thomas L.; Bergman, Robert G.; Arnold, John Carbon‒fluorine bond cleavage in fluoroarenes via a niobium(iii) imido complex: from stoichiometric to catalytic hydrodefluorination Chemical Science, 2014, 5, 2517
1516532	CIF	C39 H54 F2 N3 Nb	P -1	10.9151; 12.301; 13.7072 79.714; 87.243; 88.804	1808.6	Gianetti, Thomas L.; Bergman, Robert G.; Arnold, John Carbon‒fluorine bond cleavage in fluoroarenes via a niobium(iii) imido complex: from stoichiometric to catalytic hydrodefluorination Chemical Science, 2014, 5, 2517
1516533	CIF	C39 H52 F4 N3 Nb	P 1 21/c 1	12.7898; 11.5223; 24.9612 90; 91.217; 90	3677.7	Gianetti, Thomas L.; Bergman, Robert G.; Arnold, John Carbon‒fluorine bond cleavage in fluoroarenes via a niobium(iii) imido complex: from stoichiometric to catalytic hydrodefluorination Chemical Science, 2014, 5, 2517
1516534	CIF	C30 H40 Cl2 Fe2 N6 O18	P -1	11.473; 12.9171; 14.4931 113.07; 100.094; 90.982	1936.74	Kodera, Masahito; Tsuji, Tomokazu; Yasunaga, Tomohiro; Kawahara, Yuka; Hirano, Tomoya; Hitomi, Yutaka; Nomura, Takashi; Ogura, Takashi; Kobayashi, Yoshio; Sajith, P. K.; Shiota, Yoshihito; Yoshizawa, Kazunari Roles of carboxylate donors in O‒O bond scission of peroxodi-iron(iii) to high-spin oxodi-iron(iv) with a new carboxylate-containing dinucleating ligand Chemical Science, 2014, 5, 2282
1516535	CIF	C32 H38 F6 Fe2 N6 O15 S2	P -1	11.5827; 13.4954; 14.5372 114.729; 99.954; 90.485	2024.6	Kodera, Masahito; Tsuji, Tomokazu; Yasunaga, Tomohiro; Kawahara, Yuka; Hirano, Tomoya; Hitomi, Yutaka; Nomura, Takashi; Ogura, Takashi; Kobayashi, Yoshio; Sajith, P. K.; Shiota, Yoshihito; Yoshizawa, Kazunari Roles of carboxylate donors in O‒O bond scission of peroxodi-iron(iii) to high-spin oxodi-iron(iv) with a new carboxylate-containing dinucleating ligand Chemical Science, 2014, 5, 2282
1516536	CIF	C236 H212 N20 O66 S4 Zn16	P b a n :2	20.78; 34.908; 14.4254 90; 90; 90	10464	Mossine, Andrew V.; Mayhan, Collin M.; Fowler, Drew A.; Teat, Simon J.; Deakyne, Carol A.; Atwood, Jerry L. Zinc-seamed pyrogallol[4]arene dimers as structural components in a two-dimensional MOF Chemical Science, 2014, 5, 2297
1516537	CIF	C40 H60 Cr4 P4	I -4	11.9954; 11.9954; 13.9537 90; 90; 90	2007.79	Reisinger, Sabine; Bodensteiner, Michael; Pineda, Eufemio Moreno; McDouall, Joseph J. W.; Scheer, Manfred; Layfield, Richard A. Addition of pnictogen atoms to chromium(ii): synthesis, structure and magnetic properties of a chromium(iv) phosphide and a chromium(iii) arsenide Chemical Science, 2014, 5, 2443
1516538	CIF	C30 H45 As2 Cr3	P b c a	15.3898; 18.4053; 21.8004 90; 90; 90	6175.05	Reisinger, Sabine; Bodensteiner, Michael; Pineda, Eufemio Moreno; McDouall, Joseph J. W.; Scheer, Manfred; Layfield, Richard A. Addition of pnictogen atoms to chromium(ii): synthesis, structure and magnetic properties of a chromium(iv) phosphide and a chromium(iii) arsenide Chemical Science, 2014, 5, 2443
1516539	CIF	C18 H24 N3 O6 P Ru	P 1 21/n 1	14.595; 9.371; 15.859 90; 114.51; 90	1973.6	Murray, Benjamin S.; Menin, Laure; Scopelliti, Rosario; Dyson, Paul J. Conformational control of anticancer activity: the application of arene-linked dinuclear ruthenium(ii) organometallics Chemical Science, 2014, 5, 2536
1516540	CIF	C21 H31 N4 O5 P Ru	P 1 21/c 1	11.58624; 15.39855; 13.23391 90; 98.3744; 90	2335.9	Murray, Benjamin S.; Menin, Laure; Scopelliti, Rosario; Dyson, Paul J. Conformational control of anticancer activity: the application of arene-linked dinuclear ruthenium(ii) organometallics Chemical Science, 2014, 5, 2536
1516541	CIF	C50 H68 N8 O14 P2 Ru2	P -1	9.8881; 12.5811; 12.6829 72.028; 67.58; 67.069	1319.4	Murray, Benjamin S.; Menin, Laure; Scopelliti, Rosario; Dyson, Paul J. Conformational control of anticancer activity: the application of arene-linked dinuclear ruthenium(ii) organometallics Chemical Science, 2014, 5, 2536
1516542	CIF	C50 H62 N8 O11 P2 Ru2	P -1	13.7555; 14.6826; 16.8467 70.736; 76.491; 64.286	2877.47	Murray, Benjamin S.; Menin, Laure; Scopelliti, Rosario; Dyson, Paul J. Conformational control of anticancer activity: the application of arene-linked dinuclear ruthenium(ii) organometallics Chemical Science, 2014, 5, 2536
1516543	CIF	C19 H28 Cl Ir N2	P 1 21/c 1	14.111; 17.412; 15.429 90; 90.833; 90	3790.5	Carr, Kevin J. T.; Davies, David L.; Macgregor, Stuart A.; Singh, Kuldip; Villa-Marcos, Barbara Metal control of selectivity in acetate-assisted C‒H bond activation: an experimental and computational study of heterocyclic, vinylic and phenylic C(sp2)‒H bonds at Ir and Rh Chemical Science, 2014, 5, 2340
1516544	CIF	C18 H25 Cl Ir N S	P 1 21/n 1	7.6461; 8.621; 27.688 90; 92.184; 90	1823.8	Carr, Kevin J. T.; Davies, David L.; Macgregor, Stuart A.; Singh, Kuldip; Villa-Marcos, Barbara Metal control of selectivity in acetate-assisted C‒H bond activation: an experimental and computational study of heterocyclic, vinylic and phenylic C(sp2)‒H bonds at Ir and Rh Chemical Science, 2014, 5, 2340
1516545	CIF	C24 H29 Cl3 Ir N S	P 1 21/c 1	10.73; 14.462; 16.791 90; 104.557; 90	2521.9	Carr, Kevin J. T.; Davies, David L.; Macgregor, Stuart A.; Singh, Kuldip; Villa-Marcos, Barbara Metal control of selectivity in acetate-assisted C‒H bond activation: an experimental and computational study of heterocyclic, vinylic and phenylic C(sp2)‒H bonds at Ir and Rh Chemical Science, 2014, 5, 2340
1516546	CIF	C22 H29 Cl Ir N	P 1 21/n 1	12.207; 25.172; 13.887 90; 108.18; 90	4054	Carr, Kevin J. T.; Davies, David L.; Macgregor, Stuart A.; Singh, Kuldip; Villa-Marcos, Barbara Metal control of selectivity in acetate-assisted C‒H bond activation: an experimental and computational study of heterocyclic, vinylic and phenylic C(sp2)‒H bonds at Ir and Rh Chemical Science, 2014, 5, 2340
1516547	CIF	C20 H27 Cl Ir N	P 1 21/c 1	8.1332; 27.444; 17.333 90; 95.18; 90	3853.1	Carr, Kevin J. T.; Davies, David L.; Macgregor, Stuart A.; Singh, Kuldip; Villa-Marcos, Barbara Metal control of selectivity in acetate-assisted C‒H bond activation: an experimental and computational study of heterocyclic, vinylic and phenylic C(sp2)‒H bonds at Ir and Rh Chemical Science, 2014, 5, 2340
1516548	CIF	C18 H25 Cl N Rh S	P 1 21/n 1	7.5951; 8.5873; 28.051 90; 92.441; 90	1827.9	Carr, Kevin J. T.; Davies, David L.; Macgregor, Stuart A.; Singh, Kuldip; Villa-Marcos, Barbara Metal control of selectivity in acetate-assisted C‒H bond activation: an experimental and computational study of heterocyclic, vinylic and phenylic C(sp2)‒H bonds at Ir and Rh Chemical Science, 2014, 5, 2340
1516549	CIF	C24 H29 Cl3 N Rh S	P 1 21/c 1	10.631; 14.413; 16.681 90; 104.834; 90	2470.8	Carr, Kevin J. T.; Davies, David L.; Macgregor, Stuart A.; Singh, Kuldip; Villa-Marcos, Barbara Metal control of selectivity in acetate-assisted C‒H bond activation: an experimental and computational study of heterocyclic, vinylic and phenylic C(sp2)‒H bonds at Ir and Rh Chemical Science, 2014, 5, 2340
1516550	CIF	C22 H29 Cl N Rh	P 1 21/n 1	12.211; 25.326; 13.879 90; 108.751; 90	4064.4	Carr, Kevin J. T.; Davies, David L.; Macgregor, Stuart A.; Singh, Kuldip; Villa-Marcos, Barbara Metal control of selectivity in acetate-assisted C‒H bond activation: an experimental and computational study of heterocyclic, vinylic and phenylic C(sp2)‒H bonds at Ir and Rh Chemical Science, 2014, 5, 2340
1516551	CIF	C31 H40 B2 F8 Fe N6 O5	P -1	11.904; 12.224; 13.994 107.153; 110.035; 103.564	1695.5	Jeon, Ie-Rang; Park, Jesse G.; Haney, Chad R.; Harris, T. David Spin crossover iron(ii) complexes as PARACEST MRI thermometers Chemical Science, 2014, 5, 2461
1516552	CIF	C69.8 H92.54 B2 Cl8 F3.27 Ir N P2	P 1 21/c 1	13.2199; 34.9437; 18.4595 90; 105.914; 90	8200.57	Kumar, Amit; Johnson, Heather C.; Hooper, Thomas N.; Weller, Andrew S.; Algarra, Andrés G.; Macgregor, Stuart A. Multiple metal-bound oligomers from Ir-catalysed dehydropolymerisation of H3B·NH3 as probed by experiment and computation Chemical Science, 2014, 5, 2546
1516553	CIF	C112.5 H163 B2 F25 Ir2 P4	P 21 2 21	16.435; 17.3; 20.951 90; 90; 90	5957	Kumar, Amit; Johnson, Heather C.; Hooper, Thomas N.; Weller, Andrew S.; Algarra, Andrés G.; Macgregor, Stuart A. Multiple metal-bound oligomers from Ir-catalysed dehydropolymerisation of H3B·NH3 as probed by experiment and computation Chemical Science, 2014, 5, 2546
1516554	CIF	C70 H118 B4 Cl8 Ir N3 P2	P -1	12.7377; 12.8491; 25.1406 99.5231; 98.255; 95.4001	3986.57	Kumar, Amit; Johnson, Heather C.; Hooper, Thomas N.; Weller, Andrew S.; Algarra, Andrés G.; Macgregor, Stuart A. Multiple metal-bound oligomers from Ir-catalysed dehydropolymerisation of H3B·NH3 as probed by experiment and computation Chemical Science, 2014, 5, 2546
1516555	CIF	C15 H23 B Mn O3 P	P 63/m	16.5774; 16.5774; 10.5446 90; 90; 120	2509.54	Braunschweig, Holger; Kramer, Thomas; Radacki, Krzysztof; Shang, Rong; Siedler, Eva; Werner, Christine Isolation of the key intermediates of base-promoted borylene‒carbonyl coupling reactions Chemical Science, 2014, 5, 2271
1516556	CIF	C18 H24 B Mn N2 O2	P 1 21/c 1	24.302; 7.8695; 21.291 90; 115.979; 90	3660.4	Braunschweig, Holger; Kramer, Thomas; Radacki, Krzysztof; Shang, Rong; Siedler, Eva; Werner, Christine Isolation of the key intermediates of base-promoted borylene‒carbonyl coupling reactions Chemical Science, 2014, 5, 2271
1516557	CIF	C18 H24 B Mn N2 O2	P n a 21	21.1662; 7.9276; 21.8218 90; 90; 90	3661.6	Braunschweig, Holger; Kramer, Thomas; Radacki, Krzysztof; Shang, Rong; Siedler, Eva; Werner, Christine Isolation of the key intermediates of base-promoted borylene‒carbonyl coupling reactions Chemical Science, 2014, 5, 2271
1516558	CIF	C18 H23 B Mn N O2	C 1 2/c 1	24.5671; 8.1978; 18.4064 90; 111.169; 90	3456.8	Braunschweig, Holger; Kramer, Thomas; Radacki, Krzysztof; Shang, Rong; Siedler, Eva; Werner, Christine Isolation of the key intermediates of base-promoted borylene‒carbonyl coupling reactions Chemical Science, 2014, 5, 2271
1516559	CIF	C16 H22 B Mn N2 O2	P 1 21/c 1	14.4606; 12.5027; 18.2085 90; 93.815; 90	3284.7	Braunschweig, Holger; Kramer, Thomas; Radacki, Krzysztof; Shang, Rong; Siedler, Eva; Werner, Christine Isolation of the key intermediates of base-promoted borylene‒carbonyl coupling reactions Chemical Science, 2014, 5, 2271
1516560	CIF	C76 H100 B4 Mn4 N8 O8	P 1 21/c 1	15.2676; 8.5852; 15.8554 90; 113.848; 90	1900.81	Braunschweig, Holger; Kramer, Thomas; Radacki, Krzysztof; Shang, Rong; Siedler, Eva; Werner, Christine Isolation of the key intermediates of base-promoted borylene‒carbonyl coupling reactions Chemical Science, 2014, 5, 2271
1516561	CIF	C26 H32 B Mn N2 O3	P n m a	13.024; 9.225; 19.975 90; 90; 90	2400	Braunschweig, Holger; Kramer, Thomas; Radacki, Krzysztof; Shang, Rong; Siedler, Eva; Werner, Christine Isolation of the key intermediates of base-promoted borylene‒carbonyl coupling reactions Chemical Science, 2014, 5, 2271
1516562	CIF	C15 H29 B N2	P b c a	14.3661; 12.0848; 18.962 90; 90; 90	3292	Braunschweig, Holger; Kramer, Thomas; Radacki, Krzysztof; Shang, Rong; Siedler, Eva; Werner, Christine Isolation of the key intermediates of base-promoted borylene‒carbonyl coupling reactions Chemical Science, 2014, 5, 2271
1516563	CIF	C14 H12 F N O2	P 1 21/c 1	17.7553; 4.9562; 13.1145 90; 95.52; 90	1148.71	Jin, Li-Mei; Lu, Hongjian; Cui, Yuan; Lizardi, Christopher L.; Arzua, Thiago N.; Wojtas, Lukasz; Cui, Xin; Zhang, X. Peter Selective Radical Amination of Aldehydic C(sp(2))-H Bonds with Fluoroaryl Azides via Co(II)-Based Metalloradical Catalysis: Synthesis of N-Fluoroaryl Amides from Aldehydes under Neutral and Nonoxidative Conditions. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 2422-2427
1516564	CIF	C20 H15 F5 N2 O3	R -3 :H	24.8585; 24.8585; 16.8633 90; 90; 120	9024.5	Jin, Li-Mei; Lu, Hongjian; Cui, Yuan; Lizardi, Christopher L.; Arzua, Thiago N.; Wojtas, Lukasz; Cui, Xin; Zhang, X. Peter Selective Radical Amination of Aldehydic C(sp(2))-H Bonds with Fluoroaryl Azides via Co(II)-Based Metalloradical Catalysis: Synthesis of N-Fluoroaryl Amides from Aldehydes under Neutral and Nonoxidative Conditions. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 2422-2427
1516565	CIF	C52 H70 N O4 P	P 21 21 21	13.3371; 19.9237; 34.7236 90; 90; 90	9226.9	Zeng, Bi-Shun; Yu, Xinyi; Siu, Paul W.; Scheidt, Karl A. Catalytic enantioselective synthesis of 2-aryl-chromenes Chemical Science, 2014, 5, 2277
1516566	CIF	C60 H69 B Cl2 F4 N O4 P Pd	P 21 21 21	12.2225; 20.8872; 21.6966 90; 90; 90	5539.01	Zeng, Bi-Shun; Yu, Xinyi; Siu, Paul W.; Scheidt, Karl A. Catalytic enantioselective synthesis of 2-aryl-chromenes Chemical Science, 2014, 5, 2277
1516567	CIF	C22 H18 N4 O12 Zn2	P b a n	16.2647; 14.5206; 9.6475 90; 90; 90	2278.48	Henke, Sebastian; Li, Wei; Cheetham, Anthony K. Guest-dependent mechanical anisotropy in pillared-layered soft porous crystals ‒ a nanoindentation study Chemical Science, 2014, 5, 2392
1516568	CIF	C22 H18 N4 O12 Zn2	I 4/m c m	15.25553; 15.25553; 19.3129 90; 90; 90	4494.71	Henke, Sebastian; Li, Wei; Cheetham, Anthony K. Guest-dependent mechanical anisotropy in pillared-layered soft porous crystals ‒ a nanoindentation study Chemical Science, 2014, 5, 2392
1516569	CIF	C22 H18 N4 O12 Zn2	P 4/m m m	10.94325; 10.94325; 9.67577 90; 90; 90	1158.72	Henke, Sebastian; Li, Wei; Cheetham, Anthony K. Guest-dependent mechanical anisotropy in pillared-layered soft porous crystals ‒ a nanoindentation study Chemical Science, 2014, 5, 2392
1516570	CIF	C22 H18 N4 O12 Zn2	P 4/m m m	10.90313; 10.90313; 9.649 90; 90; 90	1147.06	Henke, Sebastian; Li, Wei; Cheetham, Anthony K. Guest-dependent mechanical anisotropy in pillared-layered soft porous crystals ‒ a nanoindentation study Chemical Science, 2014, 5, 2392
1516571	CIF	C34 H48 N6 O12 Zn2	I 4/m c m	15.0609; 15.0609; 19.2433 90; 90; 90	4365	Henke, Sebastian; Li, Wei; Cheetham, Anthony K. Guest-dependent mechanical anisotropy in pillared-layered soft porous crystals ‒ a nanoindentation study Chemical Science, 2014, 5, 2392
1516572	CIF	C30 H24 N2 O8 Zn2	P 4/m b m	15.4195; 15.4195; 9.6416 90; 90; 90	2292.4	Henke, Sebastian; Li, Wei; Cheetham, Anthony K. Guest-dependent mechanical anisotropy in pillared-layered soft porous crystals ‒ a nanoindentation study Chemical Science, 2014, 5, 2392
1516573	CIF	C22 H18 Br2 N2 O8 Zn2	P b a n	16.3684; 14.4237; 9.6406 90; 90; 90	2276.08	Henke, Sebastian; Li, Wei; Cheetham, Anthony K. Guest-dependent mechanical anisotropy in pillared-layered soft porous crystals ‒ a nanoindentation study Chemical Science, 2014, 5, 2392
1516574	CIF	C22 H18 I N3 O4 S	P 21 21 21	7.7904; 14.7; 19.469 90; 90; 90	2229.6	Tripathi, Chandra Bhushan; Mukherjee, Santanu Catalytic enantioselective iodoaminocyclization of hydrazones. Organic letters, 2014, 16, 3368-3371
1516575	CIF	C79 H68 B2 F24 N O P2 Rh Si	P -1	16.6243; 16.8939; 17.7667 110.65; 107.187; 106.29	4026.5	Johnson, Heather C.; Torry-Harris, Rebecca; Ortega, Laura; Theron, Robin; McIndoe, J. Scott; Weller, Andrew S. Exploring the mechanism of the hydroboration of alkenes by amine‒boranes catalysed by [Rh(xantphos)]+ Catal. Sci. Technol., 2014, 4, 3486
1516576	CIF	C89 H77 B F24 O P3 Rh	P -1	12.9076; 17.803; 19.959 87.9991; 74.6948; 87.0039	4416.68	Johnson, Heather C.; Torry-Harris, Rebecca; Ortega, Laura; Theron, Robin; McIndoe, J. Scott; Weller, Andrew S. Exploring the mechanism of the hydroboration of alkenes by amine‒boranes catalysed by [Rh(xantphos)]+ Catal. Sci. Technol., 2014, 4, 3486
1516577	CIF	Bi4 Co0.3 O11 V1.7	I 4/m m m	3.929; 3.929; 15.476 90; 90; 90	238.9	Muller, C.; Anne, M.; Bacmann, M.; Bonnet, M. Structural Studies of the Fast Oxygen Ion Conductor BICOVOX.15 by Single-Crystal Neutron Diffraction at Room Temperature Journal of Solid State Chemistry, 1998, 141, 241-247
1516578	CIF	Ba2 Cu2.92 O6 Y	P 4/m m m	3.864; 3.864; 11.782 90; 90; 90	175.91	Odier, Philippe; Gotor, Francisco J.; Pellerin, Nadia; Lobo, Ricardo P.S.M.; Dembinski, Kristof; Ayache, Jeanne; Noel, Henry; Potel, Michel; Chaminade, Jean Pierre; Collin, Gaston Copper deficiency in YBa2Cu3O7-x ceramics, textured and single crystals Materials Science and Engineering B, 1998, 52, 117-122
1516579	CIF	C22 H25 N2 O4 S2	P -1	6.6422; 8.0514; 20.8031 89.74; 87.881; 83.068	1103.64	Zhang, Jie; Shao, Ying; Wang, Hongxiang; Luo, Qiang; Chen, Jijun; Xu, Dongmei; Wan, Xiaobing Dual Roles of Sulfonyl Hydrazides: A Three-Component Reaction To Construct Fully Substituted Pyrazoles Using TBAI/TBHP. Organic letters, 2014, 16, 3312-3315
1516580	CIF	C24 H12 S2	P 1 21/c 1	12.0564; 12.1122; 12.1107 90; 110.407; 90	1657.5	Xiong, Xiao-Dong; Deng, Chun-Lin; Peng, Xiao-Shui; Miao, Qian; Wong, Henry N. C. Heteroatom-bridged tetraphenylenes: synthesis, structures, and properties. Organic letters, 2014, 16, 3252-3255
1516581	CIF	C24 H12 Se4	P 1 21/c 1	12.7769; 20.4663; 16.3532 90; 109.347; 90	4034.8	Xiong, Xiao-Dong; Deng, Chun-Lin; Peng, Xiao-Shui; Miao, Qian; Wong, Henry N. C. Heteroatom-bridged tetraphenylenes: synthesis, structures, and properties. Organic letters, 2014, 16, 3252-3255
1516582	CIF	C38 H26 N2	P 1 21/n 1	10.4127; 18.6669; 13.9771 90; 107.068; 90	2597.1	Xiong, Xiao-Dong; Deng, Chun-Lin; Peng, Xiao-Shui; Miao, Qian; Wong, Henry N. C. Heteroatom-bridged tetraphenylenes: synthesis, structures, and properties. Organic letters, 2014, 16, 3252-3255
1516583	CIF	C24 H8 O2	P m m n :2	12.3385; 15.6948; 3.8193 90; 90; 90	739.61	Xiong, Xiao-Dong; Deng, Chun-Lin; Peng, Xiao-Shui; Miao, Qian; Wong, Henry N. C. Heteroatom-bridged tetraphenylenes: synthesis, structures, and properties. Organic letters, 2014, 16, 3252-3255
1516584	CIF	C24 H12 Se2	P b c n	28.5952; 7.5369; 15.6922 90; 90; 90	3382	Xiong, Xiao-Dong; Deng, Chun-Lin; Peng, Xiao-Shui; Miao, Qian; Wong, Henry N. C. Heteroatom-bridged tetraphenylenes: synthesis, structures, and properties. Organic letters, 2014, 16, 3252-3255
1516585	CIF	C36 H22 N2	C 1 2/c 1	18.0254; 10.3777; 12.614 90; 101.085; 90	2315.6	Xiong, Xiao-Dong; Deng, Chun-Lin; Peng, Xiao-Shui; Miao, Qian; Wong, Henry N. C. Heteroatom-bridged tetraphenylenes: synthesis, structures, and properties. Organic letters, 2014, 16, 3252-3255
1516586	CIF	C34 H45 Br N2 O6 Si	P -1	8.0482; 14.1277; 15.3665 99.073; 94.101; 91.448	1719.75	Han, Seo-Jung; Vogt, Florian; Krishnan, Shyam; May, Jeremy A.; Gatti, Michele; Virgil, Scott C.; Stoltz, Brian M. A diastereodivergent synthetic strategy for the syntheses of communesin f and perophoramidine. Organic letters, 2014, 16, 3316-3319
1516587	CIF	C22 H19 Br N2 O5	P 21 21 21	9.1581; 12.6857; 16.703 90; 90; 90	1940.5	Han, Seo-Jung; Vogt, Florian; Krishnan, Shyam; May, Jeremy A.; Gatti, Michele; Virgil, Scott C.; Stoltz, Brian M. A diastereodivergent synthetic strategy for the syntheses of communesin f and perophoramidine. Organic letters, 2014, 16, 3316-3319
1516588	CIF	C47 H73 N Si Th	P b c a	10.4251; 20.765; 44.289 90; 90; 90	9587.6	Ren, Wenshan; Zhou, Enwei; Fang, Bo; Zi, Guofu; Fang, De-Cai; Walter, Marc D. Si‒H addition followed by C‒H bond activation induced by a terminal thorium imido metallocene: a combined experimental and computational study Chemical Science, 2014, 5, 3165
1516589	CIF	C53 H75 N Si Th	P 1 21/c 1	16.578; 16.572; 17.515 90; 97.936; 90	4765.8	Ren, Wenshan; Zhou, Enwei; Fang, Bo; Zi, Guofu; Fang, De-Cai; Walter, Marc D. Si‒H addition followed by C‒H bond activation induced by a terminal thorium imido metallocene: a combined experimental and computational study Chemical Science, 2014, 5, 3165
1516590	CIF	C54 H87 N3 Th	P -1	10.436; 15.509; 20.314 92.787; 92.25; 109.072	3098.4	Ren, Wenshan; Zhou, Enwei; Fang, Bo; Zi, Guofu; Fang, De-Cai; Walter, Marc D. Si‒H addition followed by C‒H bond activation induced by a terminal thorium imido metallocene: a combined experimental and computational study Chemical Science, 2014, 5, 3165
1516591	CIF	C50 H62 Cl2 N8 O6 Zn2	P -1	13.4923; 13.5958; 15.0327 108.107; 104.82; 90.868	2520.35	Li, Chi-Huan; Chuang, Hui-Ju; Li, Chen-Yu; Ko, Bao-Tsan; Lin, Chia-Her Bimetallic nickel and cobalt complexes as high-performance catalysts for copolymerization of carbon dioxide with cyclohexene oxide Polymer Chemistry, 2014, 5, 4875
1516592	CIF	C118 H116 Co4 N16 O13	P -1	11.7828; 14.8129; 17.4408 94.041; 107.638; 95.432	2872.13	Li, Chi-Huan; Chuang, Hui-Ju; Li, Chen-Yu; Ko, Bao-Tsan; Lin, Chia-Her Bimetallic nickel and cobalt complexes as high-performance catalysts for copolymerization of carbon dioxide with cyclohexene oxide Polymer Chemistry, 2014, 5, 4875
1516593	CIF	C50 H62 Cl2 N8 Ni2 O6	P -1	12.0189; 14.7702; 14.7768 107.972; 96.642; 95.331	2455.4	Li, Chi-Huan; Chuang, Hui-Ju; Li, Chen-Yu; Ko, Bao-Tsan; Lin, Chia-Her Bimetallic nickel and cobalt complexes as high-performance catalysts for copolymerization of carbon dioxide with cyclohexene oxide Polymer Chemistry, 2014, 5, 4875
1516594	CIF	C26 H28 N4 O	C 1 2/c 1	30.8673; 14.8514; 10.3727 90; 94.543; 90	4740.14	Li, Chi-Huan; Chuang, Hui-Ju; Li, Chen-Yu; Ko, Bao-Tsan; Lin, Chia-Her Bimetallic nickel and cobalt complexes as high-performance catalysts for copolymerization of carbon dioxide with cyclohexene oxide Polymer Chemistry, 2014, 5, 4875
1516595	CIF	C18 H26 O8	P 1 21 1	9.9116; 7.094; 26.0972 90; 94.539; 90	1829.21	Yurchenko, Anton N.; Smetanina, Olga F.; Kalinovsky, Anatoly I.; Pushilin, Michael A.; Glazunov, Valeriy P.; Khudyakova, Yuliya V.; Kirichuk, Natalya N.; Ermakova, Svetlana P.; Dyshlovoy, Sergey A.; Yurchenko, Ekaterina A.; Afiyatullov, Shamil Sh Oxirapentyns F-K from the Marine-Sediment-Derived Fungus Isaria felina KMM 4639. Journal of natural products, 2014, 77, 1321-1328
1516596	CIF	C19 H26 O6	P 21 21 21	9.1403; 12.3986; 15.0582 90; 90; 90	1706.5	Chen, Jian-Jun; Chen, Chao-Jun; Yao, Xiao-Jun; Jin, Xiao-Jie; Gao, Kun Eremophilane-Type Sesquiterpenoids with Diverse Skeletons from Ligularia sagitta. Journal of natural products, 2014, 77, 1329-1335
1516597	CIF	C30 H25 Br N2 O3 S	P -1	10.8564; 14.3921; 18.5751 77.707; 84.454; 69.815	2660.74	Li, Long; Shu, Chao; Zhou, Bo; Yu, Yong-Fei; Xiao, Xin-Yu; Ye, Long-Wu Generation of gold carbenes in water: efficient intermolecular trapping of the α-oxo gold carbenoids by indoles and anilines Chemical Science, 2014, 5, 4057
1516598	CIF	C29 H27 Br N2 O3 S	P 1 21/n 1	12.621; 9.6352; 21.5566 90; 94.967; 90	2611.6	Li, Long; Shu, Chao; Zhou, Bo; Yu, Yong-Fei; Xiao, Xin-Yu; Ye, Long-Wu Generation of gold carbenes in water: efficient intermolecular trapping of the α-oxo gold carbenoids by indoles and anilines Chemical Science, 2014, 5, 4057
1516599	CIF	C24 H72 Cl2 In2 N4 Si8	P -1	8.9952; 12.0644; 23.969 80.621; 83.006; 66.929	2356.3	Yamashita, Yasuhiro; Saito, Yuki; Imaizumi, Takaki; Kobayashi, Shū A Lewis acid/metal amide hybrid as an efficient catalyst for carbon‒carbon bond formation Chem. Sci., 2014, 5, 3958
1516600	CIF	C33 H31 La O11	P -1	9.1684; 13.5704; 17.837 86.182; 87.019; 84.413	2201.5	Zhan, Chao; Ou, Sha; Zou, Chao; Zhao, Min; Wu, Chuan-De A luminescent mixed-lanthanide-organic framework sensor for decoding different volatile organic molecules. Analytical chemistry, 2014, 86, 6648-6653
1516601	CIF	C33 H31 Eu O11	P -1	9.1035; 13.6438; 17.732 87.62; 85.388; 86.422	2189.5	Zhan, Chao; Ou, Sha; Zou, Chao; Zhao, Min; Wu, Chuan-De A luminescent mixed-lanthanide-organic framework sensor for decoding different volatile organic molecules. Analytical chemistry, 2014, 86, 6648-6653
1516602	CIF	C33 H31 O11 Tb	P -1	9.1308; 13.6503; 17.7229 87.558; 85.382; 86.398	2195.86	Zhan, Chao; Ou, Sha; Zou, Chao; Zhao, Min; Wu, Chuan-De A luminescent mixed-lanthanide-organic framework sensor for decoding different volatile organic molecules. Analytical chemistry, 2014, 86, 6648-6653
1516603	CIF	C20 H20 B N O	P 1 21/c 1	23.009; 5.4564; 13.699 90; 103.943; 90	1669.2	Brown, Alec N.; Zakharov, Lev N.; Mikulas, Tanya; Dixon, David A.; Liu, Shih-Yuan Rhodium-Catalyzed B-H Activation of 1,2-Azaborines: Synthesis and Characterization of BN Isosteres of Stilbenes. Organic letters, 2014, 16, 3340-3343
1516604	CIF	C21 H24 O3	P 1 21/n 1	6.7908; 8.8056; 28.0909 90; 95.65; 90	1671.59	Lee, Jihoon; Panek, James S. Synthesis of Isochromene-Type Scaffolds via Single-Flask Diels-Alder-[4 + 2]-Annulation Sequence of a Silyl-Substituted Diene with Menadione. Organic letters, 2014, 16, 3320-3323
1516605	CIF	C25 H36 O5	I 1 2 1	13.9471; 8.2238; 19.675 90; 93.918; 90	2251.4	Williams, Russell B.; Du, Lin; Norman, Vanessa L.; Goering, Matt G.; O'Neil-Johnson, Mark; Woodbury, Scott; Albrecht, Matthew A.; Powell, Douglas R.; Cichewicz, Robert H.; Eldridge, Gary R.; Starks, Courtney M. Diterpenes from the Endangered Goldenrod Solidago shortii. Journal of natural products, 2014, 77, 1438-1444
1516606	CIF	C30 H24	P 1 21/n 1	10.58564; 6.27352; 16.626 90; 95.2712; 90	1099.45	Horino, Yoshikazu; Takahashi, Yu; Koketsu, Kaori; Abe, Hitoshi; Tsuge, Kiyoshi Practical and Convenient Synthesis of 1,6-Di- or 1,2,5,6-Tetra-arylhexa-1,3,5-trienes by the Dimerization of Pd(0)-Complexed Alkenylcarbenes Generated from π-Allylpalladium Intermediates. Organic letters, 2014, 16, 3184-3187
1516607	CIF	C11 H14 Br N O4 S	P 21 21 21	6.8751; 8.4919; 22.997 90; 90; 90	1342.6	Chen, Ya-Jing; Chen, Ya-Heng; Feng, Chen-Guo; Lin, Guo-Qiang Enantioselective Rhodium-Catalyzed Arylation of Cyclic N-Sulfamidate Alkylketimines: A New Access to Chiral β-Alkyl-β-aryl Amino Alcohols. Organic letters, 2014, 16, 3400-3403
1516608	CIF	C19 H19 O5 P	P 1 21/n 1	10.365; 11.372; 15.121 90; 96.49; 90	1770.9	Mi, Xia; Wang, Chenyang; Huang, Mengmeng; Zhang, Jianye; Wu, Yusheng; Wu, Yangjie Silver-Catalyzed Synthesis of 3-Phosphorated Coumarins via Radical Cyclization of Alkynoates and Dialkyl H-Phosphonates. Organic letters, 2014, 16, 3356-3359
1516609	CIF	C28 H18 F10 Ir N6 P	C 1 2/c 1	25.778; 15.759; 16.308 90; 105.245; 90	6392	Henwood, Adam F.; Evariste, Sloane; Slawin, Alexandra M. Z.; Zysman-Colman, Eli Rigid biimidazole ancillary ligands as an avenue to bright deep blue cationic iridium(iii) complexes. Faraday discussions, 2014, 174, 165-182
1516610	CIF	C36 H24 F10 Ir N6 P	P -1	9.1029; 12.8618; 15.38 69.58; 88.64; 71.81	1595.8	Henwood, Adam F.; Evariste, Sloane; Slawin, Alexandra M. Z.; Zysman-Colman, Eli Rigid biimidazole ancillary ligands as an avenue to bright deep blue cationic iridium(iii) complexes. Faraday discussions, 2014, 174, 165-182
1516611	CIF	C17 H14 N2 O3	P b c a	11.398; 15.357; 16.312 90; 90; 90	2855.2	Griesbeck, Axel G.; Kramer, Wolfgang; Heinrich, Thomas; Lex, Johann Photocyclization of N,N-phthaloylanthranilic amides coupled to ω-amino acids with increasing chain lengths Photochemical & Photobiological Sciences, 2002, 1, 237
1516612	CIF	C17 H11 F O2	P 1 c 1	6.879; 3.929; 23.459 90; 90.35; 90	634	Vishnumurthy, Kodumuru; Guru Row, Tayur N.; Venkatesan, Kailasam Photochemical behaviour of 4-styrylcoumarin polymorphs in the crystalline state Photochemical & Photobiological Sciences, 2002, 1, 799
1516613	CIF	C17 H12 O2	P 1 21/n 1	17.057; 8.229; 18.261 90; 96.33; 90	2547.5	Vishnumurthy, Kodumuru; Guru Row, Tayur N.; Venkatesan, Kailasam Photochemical behaviour of 4-styrylcoumarin polymorphs in the crystalline state Photochemical & Photobiological Sciences, 2002, 1, 799
1516614	CIF	C25 H29 N O2	P 1 21 1	8.464; 25.375; 10.154 90; 90.42; 90	2180.8	Hopfner, Matthias; Weiß, Harald; Meissner, Dieter; Heinemann, Frank W.; Kisch, Horst Semiconductor photocatalysis type B: synthesis of unsaturated α-amino esters from imines and olefins photocatalyzed by silica-supported cadmium sulfide Photochemical & Photobiological Sciences, 2002, 1, 696-703
1516615	CIF	C22 H25 N O2	P 1 21/n 1	14.56; 6.584; 20.801 90; 109.42; 90	1880.6	Hopfner, Matthias; Weiß, Harald; Meissner, Dieter; Heinemann, Frank W.; Kisch, Horst Semiconductor photocatalysis type B: synthesis of unsaturated α-amino esters from imines and olefins photocatalyzed by silica-supported cadmium sulfide Photochemical & Photobiological Sciences, 2002, 1, 696-703
1516616	CIF	C20 H23 N O2	P 1 21/n 1	9.801; 17.753; 10.068 90; 91.02; 90	1751.5	Hopfner, Matthias; Weiß, Harald; Meissner, Dieter; Heinemann, Frank W.; Kisch, Horst Semiconductor photocatalysis type B: synthesis of unsaturated α-amino esters from imines and olefins photocatalyzed by silica-supported cadmium sulfide Photochemical & Photobiological Sciences, 2002, 1, 696-703
1516617	CIF	C23 H25 N O2	P b c a	17.47; 11.704; 18.731 90; 90; 90	3829.9	Hopfner, Matthias; Weiß, Harald; Meissner, Dieter; Heinemann, Frank W.; Kisch, Horst Semiconductor photocatalysis type B: synthesis of unsaturated α-amino esters from imines and olefins photocatalyzed by silica-supported cadmium sulfide Photochemical & Photobiological Sciences, 2002, 1, 696-703
1516618	CIF	C35 H42.4 O13.2	P 21 21 21	11.2634; 15.8807; 21.1556 90; 90; 90	3784.1	Nothias-Scaglia, Louis-Félix; Retailleau, Pascal; Paolini, Julien; Pannecouque, Christophe; Neyts, Johan; Dumontet, Vincent; Roussi, Fanny; Leyssen, Pieter; Costa, Jean; Litaudon, Marc Jatrophane diterpenes as inhibitors of chikungunya virus replication: structure-activity relationship and discovery of a potent lead. Journal of natural products, 2014, 77, 1505-1512
1516619	CIF	C32 H44 O13	P 1 21 1	11.3186; 15.8687; 20.1536 90; 101.153; 90	3551.5	Nothias-Scaglia, Louis-Félix; Retailleau, Pascal; Paolini, Julien; Pannecouque, Christophe; Neyts, Johan; Dumontet, Vincent; Roussi, Fanny; Leyssen, Pieter; Costa, Jean; Litaudon, Marc Jatrophane diterpenes as inhibitors of chikungunya virus replication: structure-activity relationship and discovery of a potent lead. Journal of natural products, 2014, 77, 1505-1512
1516620	CIF	C30 H40 O13	P 21 21 21	12.868; 14.089; 17.366 90; 90; 90	3148.4	Nothias-Scaglia, Louis-Félix; Retailleau, Pascal; Paolini, Julien; Pannecouque, Christophe; Neyts, Johan; Dumontet, Vincent; Roussi, Fanny; Leyssen, Pieter; Costa, Jean; Litaudon, Marc Jatrophane diterpenes as inhibitors of chikungunya virus replication: structure-activity relationship and discovery of a potent lead. Journal of natural products, 2014, 77, 1505-1512
1516621	CIF	C33 H44 O13	P 21 21 21	13.373; 14.2814; 17.794 90; 90; 90	3398.4	Nothias-Scaglia, Louis-Félix; Retailleau, Pascal; Paolini, Julien; Pannecouque, Christophe; Neyts, Johan; Dumontet, Vincent; Roussi, Fanny; Leyssen, Pieter; Costa, Jean; Litaudon, Marc Jatrophane diterpenes as inhibitors of chikungunya virus replication: structure-activity relationship and discovery of a potent lead. Journal of natural products, 2014, 77, 1505-1512
1516622	CIF	C30 H28 O13	P 61 2 2	21.4292; 21.4292; 21.4162 90; 90; 120	8517	Ren, Yulin; Lantvit, Daniel D.; Deng, Youcai; Kanagasabai, Ragu; Gallucci, Judith C.; Ninh, Tran Ngoc; Chai, Hee-Byung; Soejarto, Djaja D.; Fuchs, James R.; Yalowich, Jack C.; Yu, Jianhua; Swanson, Steven M.; Kinghorn, A. Douglas Potent Cytotoxic Arylnaphthalene Lignan Lactones from Phyllanthus poilanei. Journal of natural products, 2014, 77, 1494-1504
1516623	CIF	C15 H6 F19 N O2	P -1	9.777; 10.96; 19.356 96.59; 100.37; 91.1	2025.1	O'Neal, Kristi L; Geib, Steven; Weber, Stephen G. Extraction of pyridines into fluorous solvents based on hydrogen bond complex formation with carboxylic acid receptors. Analytical chemistry, 2007, 79, 3117-3125
1516624	CIF	C55.22 H54.8 Cl3.65 N12 O6.79	P 1 21/c 1	12.0326; 13.7368; 18.1386 90; 94.679; 90	2988.13	Muranaka, Atsuya; Ohira, Shino; Toriumi, Naoyuki; Hirayama, Machiko; Kyotani, Fumiko; Mori, Yukie; Hashizume, Daisuke; Uchiyama, Masanobu Unraveling the Electronic Structure of Azolehemiporphyrazines: Direct Spectroscopic Observation of Magnetic Dipole Allowed Nature of the Lowest π-π* Transition of 20π-Electron Porphyrinoids. The journal of physical chemistry. A, 2014, 118, 4415-4424
1516625	CIF	C64 H56 Cl6 N14 O4	P -1	8.1267; 12.3186; 15.8366 93.4245; 100.543; 92.7206	1553.09	Muranaka, Atsuya; Ohira, Shino; Toriumi, Naoyuki; Hirayama, Machiko; Kyotani, Fumiko; Mori, Yukie; Hashizume, Daisuke; Uchiyama, Masanobu Unraveling the Electronic Structure of Azolehemiporphyrazines: Direct Spectroscopic Observation of Magnetic Dipole Allowed Nature of the Lowest π-π* Transition of 20π-Electron Porphyrinoids. The journal of physical chemistry. A, 2014, 118, 4415-4424
1516626	CIF	C36 H38 N8	P 1 21/n 1	15.3095; 5.0915; 20.1111 90; 109.532; 90	1477.41	Muranaka, Atsuya; Ohira, Shino; Toriumi, Naoyuki; Hirayama, Machiko; Kyotani, Fumiko; Mori, Yukie; Hashizume, Daisuke; Uchiyama, Masanobu Unraveling the Electronic Structure of Azolehemiporphyrazines: Direct Spectroscopic Observation of Magnetic Dipole Allowed Nature of the Lowest π-π* Transition of 20π-Electron Porphyrinoids. The journal of physical chemistry. A, 2014, 118, 4415-4424
1516627	CIF	C16 H14 Cl2	P 21 21 21	5.6849; 7.6858; 32.425 90; 90; 90	1416.7	Srinivas, Harathi D.; Zhou, Qi; Watson, Mary P. Enantiospecific, nickel-catalyzed cross-couplings of allylic pivalates and arylboroxines. Organic letters, 2014, 16, 3596-3599
1516628	CIF	C10 H15 N O4 S	P 21 21 21	6.5056; 8.2425; 21.78 90; 90; 90	1167.9	Choudhary, Amit; Newberry, Robert W.; Raines, Ronald T. n→π* Interactions Engender Chirality in Carbonyl Groups. Organic letters, 2014, 16, 3421-3423
1516629	CIF	C10 H15 N O4 S	P 21 21 21	8.4606; 9.8014; 14.3985 90; 90; 90	1194.01	Choudhary, Amit; Newberry, Robert W.; Raines, Ronald T. n→π* Interactions Engender Chirality in Carbonyl Groups. Organic letters, 2014, 16, 3421-3423
1516630	CIF	C8 H13 N O3 S	P 21 21 21	7.9045; 10.8117; 11.4208 90; 90; 90	976.03	Choudhary, Amit; Newberry, Robert W.; Raines, Ronald T. n→π* Interactions Engender Chirality in Carbonyl Groups. Organic letters, 2014, 16, 3421-3423
1516631	CIF	C9 H15 N O3 S	P 1 21 1	6.3034; 6.8102; 12.5634 90; 99.245; 90	532.31	Choudhary, Amit; Newberry, Robert W.; Raines, Ronald T. n→π* Interactions Engender Chirality in Carbonyl Groups. Organic letters, 2014, 16, 3421-3423
1516632	CIF	C8 H13 N O3 S	P 21 21 21	6.4374; 11.8996; 12.6886 90; 90; 90	971.98	Choudhary, Amit; Newberry, Robert W.; Raines, Ronald T. n→π* Interactions Engender Chirality in Carbonyl Groups. Organic letters, 2014, 16, 3421-3423
1516633	CIF	C9 H15 N O3 S	C 1 2 1	14.493; 6.393; 11.849 90; 96.568; 90	1090.6	Choudhary, Amit; Newberry, Robert W.; Raines, Ronald T. n→π* Interactions Engender Chirality in Carbonyl Groups. Organic letters, 2014, 16, 3421-3423
1516634	CIF	C16 H14 O4	P 21 21 21	8.7505; 9.3028; 15.4206 90; 90; 90	1255.3	Li, Xin; Lin, Mao-Hui; Han, Yu; Wang, Feng; Cheng, Jin-Pei Correction to Asymmetric Diels-Alder Reaction of 3-Olefinic Benzofuran-2-ones and Polyenals: Construction of Chiral Spirocyclic Benzofuran-2-ones. Organic letters, 2014, 16, 3847
1516636	CIF	C19 H14	P 1 21/c 1	7.5875; 11.1085; 14.9042 90; 92.772; 90	1254.74	Wolstenholme, David J.; Matta, Chérif F; Cameron, T. Stanley Experimental and theoretical electron density study of a highly twisted polycyclic aromatic hydrocarbon: 4-methyl-[4]helicene. The journal of physical chemistry. A, 2007, 111, 8803-8813
1516637	CIF	C5 H5 Br2 N	P c a 21	14.273; 4.6009; 10.7534 90; 90; 90	706.16	Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan The nature of halogen...halide synthons: theoretical and crystallographic studies. The journal of physical chemistry. A, 2007, 111, 2319-2328
1516638	CIF	C5 H5 Br Cl N	P c a 21	14.274; 4.4396; 10.581 90; 90; 90	670.5	Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan The nature of halogen...halide synthons: theoretical and crystallographic studies. The journal of physical chemistry. A, 2007, 111, 2319-2328
1516639	CIF	C5 H5 Br I N	P c a 21	14.2891; 4.8298; 10.9546 90; 90; 90	756.02	Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan The nature of halogen...halide synthons: theoretical and crystallographic studies. The journal of physical chemistry. A, 2007, 111, 2319-2328
1516641	CIF	C5 H5 Cl I N	P 1 21/m 1	6.9272; 6.6251; 8.512 90; 103.19; 90	380.34	Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan The nature of halogen...halide synthons: theoretical and crystallographic studies. The journal of physical chemistry. A, 2007, 111, 2319-2328
1516642	CIF	C5 H5 Br Cl N	P -1	4.7691; 7.7441; 9.1529 84.26; 76.91; 86.06	327.23	Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan The nature of halogen...halide synthons: theoretical and crystallographic studies. The journal of physical chemistry. A, 2007, 111, 2319-2328
1516643	CIF	C5 H5 Br I N	P 1 21/c 1	4.805; 14.391; 11.121 90; 94.69; 90	766.4	Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan The nature of halogen...halide synthons: theoretical and crystallographic studies. The journal of physical chemistry. A, 2007, 111, 2319-2328
1516644	CIF	C5 H5 Br Cl N	P -1	4.9079; 7.8016; 9.2523 83.626; 77.592; 86.92	343.69	Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan The nature of halogen...halide synthons: theoretical and crystallographic studies. The journal of physical chemistry. A, 2007, 111, 2319-2328
1516645	CIF	C5 H5 Cl I N	P -1	5.1279; 8.224; 9.276 83.82; 74.66; 86.82	374.9	Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan The nature of halogen...halide synthons: theoretical and crystallographic studies. The journal of physical chemistry. A, 2007, 111, 2319-2328
1516646	CIF	C5 H5 Br Cl N	P 1 21/m 1	4.3924; 8.1794; 9.4338 90; 95.83; 90	337.18	Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan The nature of halogen...halide synthons: theoretical and crystallographic studies. The journal of physical chemistry. A, 2007, 111, 2319-2328
1516647	CIF	C5 H5 Br I N	P -1	4.981; 8.5067; 9.4529 80.18; 79.48; 88.909	388	Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan The nature of halogen...halide synthons: theoretical and crystallographic studies. The journal of physical chemistry. A, 2007, 111, 2319-2328
1516648	CIF	C5 H5 Br Cl N	P 1 21/m 1	4.6993; 8.1822; 9.1028 90; 100.045; 90	344.64	Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan The nature of halogen...halide synthons: theoretical and crystallographic studies. The journal of physical chemistry. A, 2007, 111, 2319-2328
1516649	CIF	C5 H5 Cl I N	P -1	5.09; 8.5759; 9.1018 83.513; 76.39; 89.059	383.66	Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan The nature of halogen...halide synthons: theoretical and crystallographic studies. The journal of physical chemistry. A, 2007, 111, 2319-2328
1516650	CIF	C51 H68 O5	P 1 21/c 1	12.8482; 18.7165; 19.2753 90; 108.773; 90	4388.6	Yang, Yong; Swager, Timothy M. Main-Chain Calix[4]arene Elastomers by Ring-Opening Metathesis Polymerization Macromolecules, 2007, 40, 7437
1516651	CIF	C86.5 H118 O4	P -1	14.9565; 15.7696; 17.7243 82.483; 88.559; 65.016	3754.6	Yang, Yong; Swager, Timothy M. Main-Chain Calix[4]arene Elastomers by Ring-Opening Metathesis Polymerization Macromolecules, 2007, 40, 7437
1516653	CIF	C24 H33 N O6	P 1 21 1	13.576; 8.049; 10.772 90; 109.89; 90	1106.9	Li, Chun-Shun; Di, Ying-Tong; He, Hong-Ping; Gao, Suo; Wang, Yue-Hu; Lu, Yang; Zhong, Jia-Liang; Hao, Xiao-Jiang Daphlongeranines A and B, two novel alkaloids possessing unprecedented skeletons from Daphniphyllum longeracemosum. Organic letters, 2007, 9, 2509-2512
1516654	CIF	C19 H34 F6 N2 O10 S2 Zn	P 21 21 21	9.332; 12.2796; 25.7432 90; 90; 90	2950	Monge, David; Martín-Zamora, Eloísa; Vazquez, Juan; Alcarazo, Manuel; Alvarez, Eleuterio; Fernandez, Rosario; Lassaletta, José M Enantioselective conjugate addition of N,N-dialkylhydrazones to alpha-hydroxy enones. Organic letters, 2007, 9, 2867-2870
1516655	CIF	C53 H35 Cl3 N4 O2	P -1	11.9304; 13.1965; 14.3418 85.259; 78.176; 79.079	2167.77	Leung, Man-kit; Yang, Chih-Chiang; Lee, Jiun-Haw; Tsai, Hsin-Hung; Lin, Chi-Feng; Huang, Chih-Yen; Su, Yuhlong Oliver; Chiu, Chi-Feng The unusual electrochemical and photophysical behavior of 2,2'-bis(1,3,4-oxadiazol-2-yl)biphenyls, effective electron transport hosts for phosphorescent organic light emitting diodes. Organic letters, 2007, 9, 235-238
1516656	CIF	C40 H26 N4 O2	P 1 2/n 1	14.9947; 7.2016; 15.2457 90; 113.94; 90	1504.69	Leung, Man-kit; Yang, Chih-Chiang; Lee, Jiun-Haw; Tsai, Hsin-Hung; Lin, Chi-Feng; Huang, Chih-Yen; Su, Yuhlong Oliver; Chiu, Chi-Feng The unusual electrochemical and photophysical behavior of 2,2'-bis(1,3,4-oxadiazol-2-yl)biphenyls, effective electron transport hosts for phosphorescent organic light emitting diodes. Organic letters, 2007, 9, 235-238
1516657	CIF	C28 H18 N4 O2	P b c n	11.3862; 10.0904; 18.8335 90; 90; 90	2163.81	Leung, Man-kit; Yang, Chih-Chiang; Lee, Jiun-Haw; Tsai, Hsin-Hung; Lin, Chi-Feng; Huang, Chih-Yen; Su, Yuhlong Oliver; Chiu, Chi-Feng The unusual electrochemical and photophysical behavior of 2,2'-bis(1,3,4-oxadiazol-2-yl)biphenyls, effective electron transport hosts for phosphorescent organic light emitting diodes. Organic letters, 2007, 9, 235-238
1516658	CIF	C53 H33 Cl3 N6 O2	P 1 2/c 1	11.0052; 13.4251; 14.8416 90; 102.384; 90	2141.76	Leung, Man-kit; Yang, Chih-Chiang; Lee, Jiun-Haw; Tsai, Hsin-Hung; Lin, Chi-Feng; Huang, Chih-Yen; Su, Yuhlong Oliver; Chiu, Chi-Feng The unusual electrochemical and photophysical behavior of 2,2'-bis(1,3,4-oxadiazol-2-yl)biphenyls, effective electron transport hosts for phosphorescent organic light emitting diodes. Organic letters, 2007, 9, 235-238
1516659	CIF	C18 H17 N O2	P 1 21/c 1	12.063; 11.771; 11.209 90; 106.55; 90	1525.7	Yang, Luo; Deng, Gang; Wang, De-Xian; Huang, Zhi-Tang; Zhu, Jie-Ping; Wang, Mei-Xiang Highly efficient and stereoselective N-vinylation of oxiranecarboxamides and unprecedented 8-endo-epoxy-arene cyclization: expedient and biomimetic synthesis of some Clausena alkaloids. Organic letters, 2007, 9, 1387-1390
1516660	CIF	C28 H27 N O3 S	P 1 21/c 1	11.1671; 16.1513; 13.1889 90; 95.155; 90	2369.2	Tsuchikama, Kyoji; Kuwata, Yusuke; Tahara, Yu-ki; Yoshinami, Yusuke; Shibata, Takanori Rh-catalyzed cyclization of diynes and enynes initiated by carbonyl-directed activation of aromatic and vinylic C-H bonds. Organic letters, 2007, 9, 3097-3099
1516661	CIF	C18 H21 N O3	P 1 21/c 1	9.6928; 10.3932; 15.2434 90; 100.477; 90	1510.01	Su, Shun; Porco, Jr, John A 1,2-dihydroisoquinolines as templates for cascade reactions to access isoquinoline alkaloid frameworks. Organic letters, 2007, 9, 4983-4986
1516662	CIF	C32 H44 O11	P 1 21 1	8.2919; 18.2388; 10.7413 90; 106.478; 90	1557.7	Yin, Sheng; Wang, Xiao-Ning; Fan, Cheng-Qi; Liao, Shang-Gao; Yue, Jian-Min The first limonoid peroxide in the Meliaceae family: walsuronoid A from Walsura robusta. Organic letters, 2007, 9, 2353-2356
1516663	CIF	C13 H16 O3 S	P 1 21 1	16.0338; 5.4918; 16.9616 90; 117.095; 90	1329.6	Jung, Jae Hoon; Kim, Yong Wook; Kim, Min Ah; Choi, Soo Young; Chung, Young Keun; Kim, Tae-Rae; Shin, Seokmin; Lee, Eun Efficient chirality transfer in the SmI2-mediated cyclization of aldehydo beta-alkoxyvinyl sulfoxides: asymmetric synthesis of 3-hydroxyoxanes. Organic letters, 2007, 9, 3225-3228
1516664	CIF	C22 H17 N	C 1 2/c 1	16.4531; 12.9636; 15.6226 90; 102.578; 90	3252.2	Han, Wenjia; Zhang, Guoying; Li, Guangxing; Huang, Hanmin Rh-catalyzed sequential oxidative C-h and N-N bond activation: conversion of azines into isoquinolines with air at room temperature. Organic letters, 2014, 16, 3532-3535
1516665	CIF	C30 H36 O4	P 1 21 1	10.7866; 7.7855; 14.9348 90; 99.41; 90	1237.33	Tian, Wen-Jing; Yu, Yang; Yao, Xiao-Jun; Chen, Hai-Feng; Dai, Yi; Zhang, Xiao-Kun; Yao, Xin-Sheng Norsampsones A-D, Four New Decarbonyl Polycyclic Polyprenylated Acylphloroglucinols from Hypericum sampsonii. Organic letters, 2014, 16, 3448-3451
1516666	CIF	C5 I O5 Re	C m c m	7.6549; 11.1028; 10.9893 90; 90; 90	933.99	Hernández, José G.; Butler, Ian S.; Friščić, Tomislav Multi-step and multi-component organometallic synthesis in one pot using orthogonal mechanochemical reactions Chemical Science, 2014, 5, 3576
1516667	CIF	C5 Br Mn O5	P n m a	11.7723; 11.5071; 6.1089 90; 90; 90	827.54	Hernández, José G.; Butler, Ian S.; Friščić, Tomislav Multi-step and multi-component organometallic synthesis in one pot using orthogonal mechanochemical reactions Chemical Science, 2014, 5, 3576
1516668	CIF	C28 H19 N5 O6 Re2	P 1 21/n 1	12.6739; 11.2202; 19.9289 90; 104.719; 90	2741	Hernández, José G.; Butler, Ian S.; Friščić, Tomislav Multi-step and multi-component organometallic synthesis in one pot using orthogonal mechanochemical reactions Chemical Science, 2014, 5, 3576
1516669	CIF	C40 H50 S Si2	P -1	8.3989; 12.4017; 17.7936 88.626; 88.89; 81.912	1834.2	Rudebusch, Gabriel E.; Fix, Aaron G.; Henthorn, Hillary A.; Vonnegut, Chris L.; Zakharov, Lev N.; Haley, Michael M. Quinoidal diindenothienoacenes: synthesis and properties of new functional organic materials Chemical Science, 2014, 5, 3627
1516670	CIF	C42 H50 S2 Si2	P -1	7.4177; 14.5332; 18.922 73.889; 84.135; 78.229	1916.3	Rudebusch, Gabriel E.; Fix, Aaron G.; Henthorn, Hillary A.; Vonnegut, Chris L.; Zakharov, Lev N.; Haley, Michael M. Quinoidal diindenothienoacenes: synthesis and properties of new functional organic materials Chemical Science, 2014, 5, 3627
1516671	CIF	C34 H38 S Si2	P -1	7.0866; 16.2124; 26.849 85.812; 84.502; 77.978	2998.7	Rudebusch, Gabriel E.; Fix, Aaron G.; Henthorn, Hillary A.; Vonnegut, Chris L.; Zakharov, Lev N.; Haley, Michael M. Quinoidal diindenothienoacenes: synthesis and properties of new functional organic materials Chemical Science, 2014, 5, 3627
1516672	CIF	C44 H50 S3 Si2	P -1	7.5217; 14.0563; 20.336 73.188; 81.718; 82.685	2028.4	Rudebusch, Gabriel E.; Fix, Aaron G.; Henthorn, Hillary A.; Vonnegut, Chris L.; Zakharov, Lev N.; Haley, Michael M. Quinoidal diindenothienoacenes: synthesis and properties of new functional organic materials Chemical Science, 2014, 5, 3627
1516673	CIF	C18 H8 O2 S	P c a 21	15.913; 11.398; 6.921 90; 90; 90	1255.3	Rudebusch, Gabriel E.; Fix, Aaron G.; Henthorn, Hillary A.; Vonnegut, Chris L.; Zakharov, Lev N.; Haley, Michael M. Quinoidal diindenothienoacenes: synthesis and properties of new functional organic materials Chemical Science, 2014, 5, 3627
1516674	CIF	C20 H8 O2 S2	P 1 21/c 1	12.983; 3.9148; 14.969 90; 111.93; 90	705.8	Rudebusch, Gabriel E.; Fix, Aaron G.; Henthorn, Hillary A.; Vonnegut, Chris L.; Zakharov, Lev N.; Haley, Michael M. Quinoidal diindenothienoacenes: synthesis and properties of new functional organic materials Chemical Science, 2014, 5, 3627
1516675	CIF	C28 H33 Fe N4 O3 S	P 1 21/c 1	27.927; 8.0895; 38.227 90; 98.822; 90	8534	Pulukkody, Randara; Kyran, Samuel J.; Drummond, Michael J.; Hsieh, Chung-Hung; Darensbourg, Donald J.; Darensbourg, Marcetta Y. Hammett correlations as test of mechanism of CO-induced disulfide elimination from dinitrosyl iron complexes Chemical Science, 2014, 5, 3795
1516676	CIF	C31 H39 Fe N4 O2 S	P 1 21/c 1	16.745; 8.1442; 22.278 90; 93.72; 90	3031.8	Pulukkody, Randara; Kyran, Samuel J.; Drummond, Michael J.; Hsieh, Chung-Hung; Darensbourg, Donald J.; Darensbourg, Marcetta Y. Hammett correlations as test of mechanism of CO-induced disulfide elimination from dinitrosyl iron complexes Chemical Science, 2014, 5, 3795
1516677	CIF	C27 H30 Cl Fe N4 O2 S	P 1 21/n 1	12.028; 14.71; 16.167 90; 104.944; 90	2763.7	Pulukkody, Randara; Kyran, Samuel J.; Drummond, Michael J.; Hsieh, Chung-Hung; Darensbourg, Donald J.; Darensbourg, Marcetta Y. Hammett correlations as test of mechanism of CO-induced disulfide elimination from dinitrosyl iron complexes Chemical Science, 2014, 5, 3795
1516678	CIF	C27 H30 Fe N5 O4 S	P 1 21/c 1	15.596; 7.9152; 23.348 90; 107.772; 90	2744.7	Pulukkody, Randara; Kyran, Samuel J.; Drummond, Michael J.; Hsieh, Chung-Hung; Darensbourg, Donald J.; Darensbourg, Marcetta Y. Hammett correlations as test of mechanism of CO-induced disulfide elimination from dinitrosyl iron complexes Chemical Science, 2014, 5, 3795
1516679	CIF	C70 H98 Mg O13 Zn2	P 43 21 2	12.1808; 12.1808; 44.474 90; 90; 90	6598.7	Bluemke, Tobias D.; Clegg, William; García-Alvarez, Pablo; Kennedy, Alan R.; Koszinowski, Konrad; McCall, Matthew D.; Russo, Luca; Hevia, Eva Structural and reactivity insights in Mg‒Zn hybrid chemistry: Zn‒I exchange and Pd-catalysed cross-coupling applications of aromatic substrates Chemical Science, 2014, 5, 3552
1516680	CIF	C34 H48 Cl I Mg N2 O5 Zn	P 1 21/c 1	16.1212; 9.5045; 24.1563 90; 98.132; 90	3664.1	Bluemke, Tobias D.; Clegg, William; García-Alvarez, Pablo; Kennedy, Alan R.; Koszinowski, Konrad; McCall, Matthew D.; Russo, Luca; Hevia, Eva Structural and reactivity insights in Mg‒Zn hybrid chemistry: Zn‒I exchange and Pd-catalysed cross-coupling applications of aromatic substrates Chemical Science, 2014, 5, 3552
1516681	CIF	C91.81 H109.81 Cl6.44 Cu F N4 O10	P -1	17.7109; 28.5979; 31.0744 67.271; 79.167; 84.672	14254.5	Brugnara, Andrea; Topić, Filip; Rissanen, Kari; Lande, Aurélien de la; Colasson, Benoit; Reinaud, Olivia Selective recognition of fluoride anion in water by a copper(ii) center embedded in a hydrophobic cavity Chemical Science, 2014, 5, 3897
1516682	CIF	C42 H28	P -1	14.2395; 6.7738; 11.281 81.264; 100.378; 101.773	1040.3	Bergantin, Stefano; Moret, Massimo; Buth, Gernot; Fabbiani, Francesca P. A. Pressure-Induced Conformational Change in Organic Semiconductors: Triggering a Reversible Phase Transition in Rubrene The Journal of Physical Chemistry C, 2014, 118, 13476
1516683	CIF	C42 H28	P -1	6.6779; 7.9256; 11.3415 89.367; 104.46; 96.321	577.63	Bergantin, Stefano; Moret, Massimo; Buth, Gernot; Fabbiani, Francesca P. A. Pressure-Induced Conformational Change in Organic Semiconductors: Triggering a Reversible Phase Transition in Rubrene The Journal of Physical Chemistry C, 2014, 118, 13476
1516684	CIF	C42 H28	P -1	7.0883; 8.5994; 12.0059 93.486; 105.642; 95.977	697.86	Bergantin, Stefano; Moret, Massimo; Buth, Gernot; Fabbiani, Francesca P. A. Pressure-Induced Conformational Change in Organic Semiconductors: Triggering a Reversible Phase Transition in Rubrene The Journal of Physical Chemistry C, 2014, 118, 13476
1516685	CIF	C42 H28	P -1	6.635; 7.7995; 11.2182 88.437; 104.348; 96.316	559.02	Bergantin, Stefano; Moret, Massimo; Buth, Gernot; Fabbiani, Francesca P. A. Pressure-Induced Conformational Change in Organic Semiconductors: Triggering a Reversible Phase Transition in Rubrene The Journal of Physical Chemistry C, 2014, 118, 13476
1516686	CIF	C42 H28	P -1	6.8535; 8.2642; 11.6573 91.614; 104.921; 96.311	633.03	Bergantin, Stefano; Moret, Massimo; Buth, Gernot; Fabbiani, Francesca P. A. Pressure-Induced Conformational Change in Organic Semiconductors: Triggering a Reversible Phase Transition in Rubrene The Journal of Physical Chemistry C, 2014, 118, 13476
1516687	CIF	C42 H28	P -1	6.7392; 8.0591; 11.4641 90.271; 104.627; 96.329	598.44	Bergantin, Stefano; Moret, Massimo; Buth, Gernot; Fabbiani, Francesca P. A. Pressure-Induced Conformational Change in Organic Semiconductors: Triggering a Reversible Phase Transition in Rubrene The Journal of Physical Chemistry C, 2014, 118, 13476
1516688	CIF	C42 H28	P -1	7.0478; 8.5495; 11.9485 93.201; 105.501; 96.079	687.2	Bergantin, Stefano; Moret, Massimo; Buth, Gernot; Fabbiani, Francesca P. A. Pressure-Induced Conformational Change in Organic Semiconductors: Triggering a Reversible Phase Transition in Rubrene The Journal of Physical Chemistry C, 2014, 118, 13476
1516689	CIF	C42 H28	P -1	6.6162; 7.6757; 11.1002 87.399; 104.322; 96.289	542.81	Bergantin, Stefano; Moret, Massimo; Buth, Gernot; Fabbiani, Francesca P. A. Pressure-Induced Conformational Change in Organic Semiconductors: Triggering a Reversible Phase Transition in Rubrene The Journal of Physical Chemistry C, 2014, 118, 13476
1516690	CIF	C60 H52 N2 S4	P 1 21/c 1	12.86; 26.508; 15.338 90; 110.628; 90	4893	Karthik, Ganesan; Srinivasan, A.; Chandrashekar, Tavarekere K. meso-Aryl Core-Modified Fused Sapphyrins: Syntheses and Structural Diversity. Organic letters, 2014, 16, 3472-3475
1516691	CIF	C18 H19 N O2	P -1	10.9901; 11.6965; 13.3134 66.633; 67.953; 82.977	1455.43	Zhao, Chen; Li, Ping; Smith, Mark D.; Pellechia, Perry J.; Shimizu, Ken D. Experimental Study of the Cooperativity of CH-π Interactions. Organic letters, 2014, 16, 3520-3523
1516692	CIF	C42 H31 N O3	P -1	10.1567; 12.264; 13.09 76.602; 73.82; 74.329	1486	Zhao, Chen; Li, Ping; Smith, Mark D.; Pellechia, Perry J.; Shimizu, Ken D. Experimental Study of the Cooperativity of CH-π Interactions. Organic letters, 2014, 16, 3520-3523
1516693	CIF	C43 H32 N2 O3	P 1 21/n 1	10.6344; 13.5264; 22.2337 90; 94.961; 90	3186.2	Zhao, Chen; Li, Ping; Smith, Mark D.; Pellechia, Perry J.; Shimizu, Ken D. Experimental Study of the Cooperativity of CH-π Interactions. Organic letters, 2014, 16, 3520-3523
1516694	CIF	C43 H29 Cl2 N O3	P 1 21/c 1	16.9467; 12.1612; 31.646 90; 97.377; 90	6468	Zhao, Chen; Li, Ping; Smith, Mark D.; Pellechia, Perry J.; Shimizu, Ken D. Experimental Study of the Cooperativity of CH-π Interactions. Organic letters, 2014, 16, 3520-3523
1516695	CIF	C19 H23 Cl N2 O4	P -1	7.662; 11.01; 11.473 90.434; 106.459; 103.436	900	Bayliss, Sam L.; Cole, Jacqueline M.; Waddell, Paul G.; McKechnie, Scott; Liu, Xiaogang Predicting Solar-Cell Dyes for Cosensitization The Journal of Physical Chemistry C, 2014, 118, 14082
1516696	CIF	C26 H27 Cl N2 O6	P -1	7.91; 11.892; 13.602 76.675; 77.828; 72.459	1173.3	Bayliss, Sam L.; Cole, Jacqueline M.; Waddell, Paul G.; McKechnie, Scott; Liu, Xiaogang Predicting Solar-Cell Dyes for Cosensitization The Journal of Physical Chemistry C, 2014, 118, 14082
1516697	CIF	C23 H27 Cl N2 O4	C 1 2/c 1	30.833; 7.2235; 22.094 90; 119.936; 90	4264.3	Bayliss, Sam L.; Cole, Jacqueline M.; Waddell, Paul G.; McKechnie, Scott; Liu, Xiaogang Predicting Solar-Cell Dyes for Cosensitization The Journal of Physical Chemistry C, 2014, 118, 14082
1516698	CIF	C25 H30 Cl N3 O4	P 1 21/n 1	8.0856; 12.518; 22.631 90; 95.377; 90	2280.5	Bayliss, Sam L.; Cole, Jacqueline M.; Waddell, Paul G.; McKechnie, Scott; Liu, Xiaogang Predicting Solar-Cell Dyes for Cosensitization The Journal of Physical Chemistry C, 2014, 118, 14082
1516699	CIF	C23 H25 Cl N2 O4	P 1 21/n 1	11.101; 16.452; 12.347 90; 108.375; 90	2140	Bayliss, Sam L.; Cole, Jacqueline M.; Waddell, Paul G.; McKechnie, Scott; Liu, Xiaogang Predicting Solar-Cell Dyes for Cosensitization The Journal of Physical Chemistry C, 2014, 118, 14082
1516700	CIF	C28.5 H33 Cl2 N2 O4 S	P -1	9.77; 12.728; 13.24 99.575; 111.36; 105.87	1408.4	Bayliss, Sam L.; Cole, Jacqueline M.; Waddell, Paul G.; McKechnie, Scott; Liu, Xiaogang Predicting Solar-Cell Dyes for Cosensitization The Journal of Physical Chemistry C, 2014, 118, 14082
1516701	CIF	C31.5 H29 Cl N2 O5.125 S	P -1	8.027; 11.283; 17.69 92.665; 102.552; 99.03	1539	Bayliss, Sam L.; Cole, Jacqueline M.; Waddell, Paul G.; McKechnie, Scott; Liu, Xiaogang Predicting Solar-Cell Dyes for Cosensitization The Journal of Physical Chemistry C, 2014, 118, 14082
1516702	CIF	C16 H17 N O4	C 1 2/c 1	10.4651; 12.0555; 22.0874 90; 91.79; 90	2785.23	Mukhina, Olga A.; Cronk, W. Cole; Kumar, N. N. Bhuvan; Sekhar, M. Chandra; Samanta, Anunay; Kutateladze, Andrei G. Intramolecular cycloadditions of photogenerated azaxylylenes: an experimental and theoretical study. The journal of physical chemistry. A, 2014, 118, 10487-10496
1516703	CIF	C16 H12 N2 O3	P 1 21/n 1	9.8869; 8.4979; 17.1534 90; 103.026; 90	1404.1	Zheng, Jing; Zhang, Yan; Cui, Sunliang Rh(III)-Catalyzed Selective Coupling of N-Methoxy-1H-indole-1-carboxamides and Aryl Boronic Acids. Organic letters, 2014, 16, 3560-3563
1516704	CIF	C17 H22 Cl3 N O3	P -1	7.1463; 10.177; 13.3296 99.67; 92.942; 99.295	940.04	Manikandan, Rajendran; Jeganmohan, Masilamani Ruthenium-catalyzed cyclization of anilides with substituted propiolates or acrylates: an efficient route to 2-quinolinones. Organic letters, 2014, 16, 3568-3571
1516705	CIF	C22 H21 N O2	P 21 21 21	5.9003; 14.002; 21.7297 90; 90; 90	1795.22	Yu, Yuanyuan; Wang, Chunyu; He, Xinze; Yao, Xiaotong; Zu, Liansuo Efficient Assembly of Polysubstituted Pyrroles via a (3 + 2) Cycloaddition/Skeletal Rearrangement/Redox Isomerization Cascade Reaction. Organic letters, 2014, 16, 3580-3583
1516706	CIF	C25 H41 N3 O5 Si2	P 1 21/c 1	10.7784; 30.335; 10.6785 90; 115.168; 90	3160	Liu, Yang; Jin, Shiyu; Wang, Zi; Song, Linhua; Hu, Youhong Microwave Assisted Tandem Heck-Sonogashira Reactions of N,N-Di-Boc-Protected 6-Amino-5-iodo-2-methyl Pyrimidin-4-ol in An Efficient Approach to Functionalized Pyrido[2,3-d]Pyrimidines. Organic letters, 2014, 16, 3524-3527
1516707	CIF	C30 H21 N	P -1	11.0471; 12.0602; 16.587 79.775; 77.726; 86.565	2124.5	Wang, Shaoyin; Chai, Zhuo; Wei, Yun; Zhu, Xiancui; Zhou, Shuangliu; Wang, Shaowu Lewis Acid Catalyzed Cascade Reaction to Carbazoles and Naphthalenes via Dehydrative [3 + 3]-Annulation. Organic letters, 2014, 16, 3592-3595
1516708	CIF	C31 H23 N O	P -1	10.6667; 12.2374; 18.702 73.907; 82.088; 76.905	2277.2	Wang, Shaoyin; Chai, Zhuo; Wei, Yun; Zhu, Xiancui; Zhou, Shuangliu; Wang, Shaowu Lewis Acid Catalyzed Cascade Reaction to Carbazoles and Naphthalenes via Dehydrative [3 + 3]-Annulation. Organic letters, 2014, 16, 3592-3595
1516709	CIF	C30 H22 O2	P n a 21	7.5251; 13.3225; 21.8161 90; 90; 90	2187.1	Wang, Shaoyin; Chai, Zhuo; Wei, Yun; Zhu, Xiancui; Zhou, Shuangliu; Wang, Shaowu Lewis Acid Catalyzed Cascade Reaction to Carbazoles and Naphthalenes via Dehydrative [3 + 3]-Annulation. Organic letters, 2014, 16, 3592-3595
1516710	CIF	C23 H16 O4	P -1	6.737; 10.853; 12.232 80.759; 86.793; 73.199	845	Bhojgude, Sachin Suresh; Thangaraj, Manikandan; Suresh, Eringathodi; Biju, Akkattu T. Tandem [4 + 2]/[2 + 2] cycloaddition reactions involving indene or benzofurans and arynes. Organic letters, 2014, 16, 3576-3579
1516711	CIF	C24 H22 O	P n a 21	7.9519; 12.792; 17.476 90; 90; 90	1777.7	Bhojgude, Sachin Suresh; Thangaraj, Manikandan; Suresh, Eringathodi; Biju, Akkattu T. Tandem [4 + 2]/[2 + 2] cycloaddition reactions involving indene or benzofurans and arynes. Organic letters, 2014, 16, 3576-3579
1516712	CIF	C28 H27 N O3 S	P 1 21/n 1	12.055; 8.557; 23.454 90; 90.843; 90	2419.1	Feng, Xin; Wang, Huiqing; Yang, Bo; Fan, Renhua One-Pot Synthesis of Highly Substituted 4-Acetonylindoles via Sequential Dearomatization and Silver-Catalyzed Domino Reaction. Organic letters, 2014, 16, 3600-3603
1516713	CIF	C21 H22 N2 O6	P 1 21/c 1	8.762; 27.035; 8.561 90; 99.436; 90	2000.5	Li, Deng Yuan; Mao, Xiao Feng; Chen, Hao Jie; Chen, Guo Rong; Liu, Pei Nian Rhodium-Catalyzed Addition-Cyclization of Hydrazines with Alkynes: Pyrazole Synthesis via Unexpected C-N Bond Cleavage. Organic letters, 2014, 16, 3476-3479
1516714	CIF	C19 H15 Cl N2 O4	P -1	8.9238; 10.559; 11.636 63.623; 88.104; 66.937	890.5	Li, Deng Yuan; Mao, Xiao Feng; Chen, Hao Jie; Chen, Guo Rong; Liu, Pei Nian Rhodium-Catalyzed Addition-Cyclization of Hydrazines with Alkynes: Pyrazole Synthesis via Unexpected C-N Bond Cleavage. Organic letters, 2014, 16, 3476-3479
1516715	CIF	C21 H22 N2 O6	P -1	9.0549; 10.608; 11.805 71.659; 87.306; 73.948	1033.4	Li, Deng Yuan; Mao, Xiao Feng; Chen, Hao Jie; Chen, Guo Rong; Liu, Pei Nian Rhodium-Catalyzed Addition-Cyclization of Hydrazines with Alkynes: Pyrazole Synthesis via Unexpected C-N Bond Cleavage. Organic letters, 2014, 16, 3476-3479
1516716	CIF	C68 H44 Ir2 N8 O9 Y	P -1	9.059; 15.197; 23.751 73.595; 88.406; 81.684	3103	Li, Lina; Zhang, Shuquan; Xu, Liangjin; Wang, Jinyun; Shi, Lin-Xi; Chen, Zhong-Ning; Hong, Maochun; Luo, Junhua Effective visible-light driven CO2photoreduction via a promising bifunctional iridium coordination polymer Chemical Science, 2014, 5, 3808
1516717	CIF	C30 H24 N2 O	P 1 21/n 1	11.0962; 21.8; 19.774 90; 105.379; 90	4612	Li, Ruohan; Xiao, Shuzhang; Li, Yi; Lin, Qifei; Zhang, Ronghua; Zhao, Jun; Yang, Changying; Zou, Kun; Li, Dongsheng; Yi, Tao Polymorphism-dependent and piezochromic luminescence based on molecular packing of a conjugated molecule Chemical Science, 2014, 5, 3922
1516718	CIF	C33 H28 N2 O2	P b c a	12.859; 15.737; 25.688 90; 90; 90	5198	Li, Ruohan; Xiao, Shuzhang; Li, Yi; Lin, Qifei; Zhang, Ronghua; Zhao, Jun; Yang, Changying; Zou, Kun; Li, Dongsheng; Yi, Tao Polymorphism-dependent and piezochromic luminescence based on molecular packing of a conjugated molecule Chemical Science, 2014, 5, 3922
1516719	CIF	C29 H20.6667 N2 O0.3333	P 1 21/n 1	19.548; 18.292; 21.819 90; 108.996; 90	7377	Li, Ruohan; Xiao, Shuzhang; Li, Yi; Lin, Qifei; Zhang, Ronghua; Zhao, Jun; Yang, Changying; Zou, Kun; Li, Dongsheng; Yi, Tao Polymorphism-dependent and piezochromic luminescence based on molecular packing of a conjugated molecule Chemical Science, 2014, 5, 3922
1516720	CIF	C33 H28 N2 O2	P b c a	12.852; 15.692; 25.641 90; 90; 90	5171	Li, Ruohan; Xiao, Shuzhang; Li, Yi; Lin, Qifei; Zhang, Ronghua; Zhao, Jun; Yang, Changying; Zou, Kun; Li, Dongsheng; Yi, Tao Polymorphism-dependent and piezochromic luminescence based on molecular packing of a conjugated molecule Chemical Science, 2014, 5, 3922
1516721	CIF	C19 H17 N3 O2	P 1 21/n 1	16.482; 4.96; 18.568 90; 91.72; 90	1517.3	Johnston, Priscilla; Nishikami, Yuki; Saito, Kei Synthesis of thyminyl stilbazoles and their photo-reactivity. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 1290-1296
1516722	CIF	C19 H17 N3 O2	P -1	4.87; 10.62; 15.26 100.47; 94.59; 93.98	770.8	Johnston, Priscilla; Nishikami, Yuki; Saito, Kei Synthesis of thyminyl stilbazoles and their photo-reactivity. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 1290-1296
1516723	CIF	C20 H19 N3 O2	P 1 21/c 1	13.101; 14.414; 8.998 90; 103.68; 90	1651	Johnston, Priscilla; Nishikami, Yuki; Saito, Kei Synthesis of thyminyl stilbazoles and their photo-reactivity. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 1290-1296
1516724	CIF	C20 H19 N3 O2	C 1 2/c 1	30.165; 4.4; 24.6 90; 93.83; 90	3257.8	Johnston, Priscilla; Nishikami, Yuki; Saito, Kei Synthesis of thyminyl stilbazoles and their photo-reactivity. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 1290-1296
1516725	CIF	C40 H38 N6 O4	P 1 21/n 1	8.188; 12.063; 17.14 90; 103.02; 90	1649.4	Johnston, Priscilla; Nishikami, Yuki; Saito, Kei Synthesis of thyminyl stilbazoles and their photo-reactivity. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2014, 13, 1290-1296
1516726	CIF	C26 H23 N O2	P 21 21 21	9.115; 10.756; 19.937 90; 90; 90	1954.6	Marsh, Barrie J.; Adams, Harry; Barker, Mike D.; Kutama, Ibrahim U.; Jones, Simon Enantioselective Catalytic Desymmetrization of Maleimides by Temporary Removal of an Internal Mirror Plane and Stereoablative Over-reduction: Synthesis of (R)-Pyrrolam A. Organic letters, 2014, 16, 3780
1516727	CIF	C26 H23 N O3	P 21 21 21	8.755; 11.955; 19.235 90; 90; 90	2013.3	Marsh, Barrie J.; Adams, Harry; Barker, Mike D.; Kutama, Ibrahim U.; Jones, Simon Enantioselective Catalytic Desymmetrization of Maleimides by Temporary Removal of an Internal Mirror Plane and Stereoablative Over-reduction: Synthesis of (R)-Pyrrolam A. Organic letters, 2014, 16, 3780
1516728	CIF	C17 H14 Cu2 I2 N P	P -1	7.9805; 8.5298; 14.3667 78.092; 85.576; 86.494	953.05	Maini, Lucia; Mazzeo, Paolo P.; Farinella, Francesco; Fattori, Valeria; Braga, Dario Mechanochemical preparation of copper iodide clusters of interest for luminescent devices. Faraday discussions, 2014, 170, 93-107
1516729	CIF	C51 H42 Cu I N3 P3	P -3	13.64705; 13.64705; 14.73999 90; 90; 120	2377.42	Maini, Lucia; Mazzeo, Paolo P.; Farinella, Francesco; Fattori, Valeria; Braga, Dario Mechanochemical preparation of copper iodide clusters of interest for luminescent devices. Faraday discussions, 2014, 170, 93-107
1516730	CIF	C34 H28 Cu4 I4 N2 P2	P 1 21/c 1	16.7222; 13.9164; 16.4466 90; 99.688; 90	3772.75	Maini, Lucia; Mazzeo, Paolo P.; Farinella, Francesco; Fattori, Valeria; Braga, Dario Mechanochemical preparation of copper iodide clusters of interest for luminescent devices. Faraday discussions, 2014, 170, 93-107
1516731	CIF	C23 H15 Cr O5 P	I 1 2/a 1	11.247; 15.014; 25.636 90; 102.346; 90	4228.8	Ndiaye, Bassirou; Bhat, Shrinivasa; Jouaiti, Abdelaziz; Berclaz, Théo; Bernardinelli, Gérald; Geoffroy, Michel EPR and DFT studies of the structure of phosphinyl radicals complexed by a pentacarbonyl transition metal. The journal of physical chemistry. A, 2006, 110, 9736-9742
1516732	CIF	C17 H11 Cr O5 P	P 1 21/c 1	13.2726; 15.6622; 8.6557 90; 106.297; 90	1727	Ndiaye, Bassirou; Bhat, Shrinivasa; Jouaiti, Abdelaziz; Berclaz, Théo; Bernardinelli, Gérald; Geoffroy, Michel EPR and DFT studies of the structure of phosphinyl radicals complexed by a pentacarbonyl transition metal. The journal of physical chemistry. A, 2006, 110, 9736-9742
1516733	CIF	C17 H11 O5 P W	P 1 21/c 1	13.352; 15.931; 8.707 90; 105.98; 90	1780.5	Ndiaye, Bassirou; Bhat, Shrinivasa; Jouaiti, Abdelaziz; Berclaz, Théo; Bernardinelli, Gérald; Geoffroy, Michel EPR and DFT studies of the structure of phosphinyl radicals complexed by a pentacarbonyl transition metal. The journal of physical chemistry. A, 2006, 110, 9736-9742
1516734	CIF	C108 H170 N2 O100	P 1	18.071; 15.375; 15.554 104.07; 113.02; 98.53	3711.9	Clark, Joanna L.; Peinado, Jessica; Stezowski, John J.; Vold, Robert L.; Huang, Yuanyuan; Hoatson, Gina L. Molecular recognition in cyclodextrin complexes of amino acid derivatives: the effects of kinetic energy on the molecular recognition of a pseudopeptide in a nonconstraining host environment as revealed by a temperature-dependent crystallographic study. The journal of physical chemistry. B, 2006, 110, 26375-26387
1516735	CIF	C108 H170 N2 O97	P 1	18.025; 15.364; 15.541 103.83; 113.06; 98.61	3699.8	Clark, Joanna L.; Peinado, Jessica; Stezowski, John J.; Vold, Robert L.; Huang, Yuanyuan; Hoatson, Gina L. Molecular recognition in cyclodextrin complexes of amino acid derivatives: the effects of kinetic energy on the molecular recognition of a pseudopeptide in a nonconstraining host environment as revealed by a temperature-dependent crystallographic study. The journal of physical chemistry. B, 2006, 110, 26375-26387
1516736	CIF	C108 H170 N2 O99	P 1	17.97; 15.393; 15.514 103.18; 113.22; 98.91	3693.4	Clark, Joanna L.; Peinado, Jessica; Stezowski, John J.; Vold, Robert L.; Huang, Yuanyuan; Hoatson, Gina L. Molecular recognition in cyclodextrin complexes of amino acid derivatives: the effects of kinetic energy on the molecular recognition of a pseudopeptide in a nonconstraining host environment as revealed by a temperature-dependent crystallographic study. The journal of physical chemistry. B, 2006, 110, 26375-26387
1516737	CIF	C108 H170 N2 O102	P 1	17.915; 15.405; 15.542 103.04; 113.35; 99.15	3685.5	Clark, Joanna L.; Peinado, Jessica; Stezowski, John J.; Vold, Robert L.; Huang, Yuanyuan; Hoatson, Gina L. Molecular recognition in cyclodextrin complexes of amino acid derivatives: the effects of kinetic energy on the molecular recognition of a pseudopeptide in a nonconstraining host environment as revealed by a temperature-dependent crystallographic study. The journal of physical chemistry. B, 2006, 110, 26375-26387
1516738	CIF	C108 H170 N2 O100	P 1	17.896; 15.389; 15.519 103.01; 113.43; 99.07	3672	Clark, Joanna L.; Peinado, Jessica; Stezowski, John J.; Vold, Robert L.; Huang, Yuanyuan; Hoatson, Gina L. Molecular recognition in cyclodextrin complexes of amino acid derivatives: the effects of kinetic energy on the molecular recognition of a pseudopeptide in a nonconstraining host environment as revealed by a temperature-dependent crystallographic study. The journal of physical chemistry. B, 2006, 110, 26375-26387
1516739	CIF	C108 H154 N2 O101	P 1	17.78; 15.31; 15.35 102.76; 113.31; 99.24	3596	Clark, Joanna L.; Peinado, Jessica; Stezowski, John J.; Vold, Robert L.; Huang, Yuanyuan; Hoatson, Gina L. Molecular recognition in cyclodextrin complexes of amino acid derivatives: the effects of kinetic energy on the molecular recognition of a pseudopeptide in a nonconstraining host environment as revealed by a temperature-dependent crystallographic study. The journal of physical chemistry. B, 2006, 110, 26375-26387
1516741	CIF	C17 H12 O3 S2	P b c a	11.2885; 14.123; 17.4374 90; 90; 90	2780	Sugiyasu, Kazunori; Song, Changsik; Swager, Timothy M. Aromaticity in Tropone-Containing Polythiophene Macromolecules, 2006, 39, 5598
1516742	CIF	C27 H33 F O8	C 1 2 1	38.884; 8.6698; 7.8123 90; 92.945; 90	2630.2	Morton, Gillian E.; Barrett, Anthony G. M. Iterative benzyne-furan cycloaddition reactions: studies toward the total synthesis of ent-Sch 47554 and ent-Sch 47555. Organic letters, 2006, 8, 2859-2861
1516743	CIF	C39 H36 N3 O P	P 21 21 21	10.6365; 16.1655; 18.138 90; 90; 90	3118.7	Fekner, Tomasz; Müller-Bunz, Helge; Guiry, Patrick J. Synthesis and application of quinazoline-oxazoline-containing (quinazox) ligands. Organic letters, 2006, 8, 5109-5112
1516744	CIF	C40 H38 N3 O P	P 21 21 21	10.9951; 16.296; 18.095 90; 90; 90	3242.2	Fekner, Tomasz; Müller-Bunz, Helge; Guiry, Patrick J. Synthesis and application of quinazoline-oxazoline-containing (quinazox) ligands. Organic letters, 2006, 8, 5109-5112
1516745	CIF	C38 H42 O2 Si2	P 1 21/c 1	19.596; 7.5959; 12.4831 90; 107.84; 90	1768.8	Liu, Yuanhong; Gao, Hongjun New zirconium-mediated approach toward regio- and stereocontrolled synthesis of trans-enediynes. Organic letters, 2006, 8, 309-311
1516746	CIF	C24 H18 B N O3	P b c a	14.8638; 15.4624; 16.3768 90; 90; 90	3763.9	Yasuda, Makoto; Yoshioka, Sachiko; Yamasaki, Satoshi; Somyo, Toshio; Chiba, Kouji; Baba, Akio Cage-shaped borate esters with enhanced Lewis acidity and catalytic activity. Organic letters, 2006, 8, 761-764
1516747	CIF	C3 H8 N6	C 1 2/c 1	13.574; 4.9473; 36.772 90; 96.297; 90	2454.5	Tominey, Alan F.; Docherty, Paul H.; Rosair, Georgina M.; Quenardelle, Romain; Kraft, Arno Unusually weak binding interactions in tetrazole-amidine complexes. Organic letters, 2006, 8, 1279-1282
1516748	CIF	C8 H10 N6	P 1 21/c 1	7.2044; 8.5549; 15.472 90; 99.564; 90	940.3	Tominey, Alan F.; Docherty, Paul H.; Rosair, Georgina M.; Quenardelle, Romain; Kraft, Arno Unusually weak binding interactions in tetrazole-amidine complexes. Organic letters, 2006, 8, 1279-1282
1516749	CIF	C3 H8 N2 O2	P 43 21 2	6.4456; 6.4456; 12.53 90; 90; 90	520.57	Tominey, Alan F.; Docherty, Paul H.; Rosair, Georgina M.; Quenardelle, Romain; Kraft, Arno Unusually weak binding interactions in tetrazole-amidine complexes. Organic letters, 2006, 8, 1279-1282
1516751	CIF	C107 H47 Cl4 F40 N9 O	P -1	15.037; 18.91; 19.84 81.38; 87.14; 66.8	5126	Hata, Hiroshi; Kamimura, Yiho; Shinokubo, Hiroshi; Osuka, Atsuhiro Synthesis of pyrrolidine-fused [34]- and [36]octaphyrins via 1,3-dipolar cycloaddition. Organic letters, 2006, 8, 1169-1172
1516752	CIF	C8 H12 O2	P 1 21 1	7.773; 6.401; 8.075 90; 103.792; 90	390.2	Hong, Bor-Cherng; Wu, Ming-Fun; Tseng, Hsing-Chang; Liao, Ju-Hsiou Enantioselective organocatalytic formal [3 + 3]-cycloaddition of alpha,beta-unsaturated aldehydes and application to the asymmetric synthesis of (-)-isopulegol hydrate and (-)-cubebaol. Organic letters, 2006, 8, 2217-2220
1516753	CIF	C35 H59 N O2 Si2	P 21 21 21	7.6565; 16.5845; 27.3457 90; 90; 90	3472.3	Smith, 3rd, Amos B; Davulcu, Akin H.; Kürti, Laszló Indole diterpenoid synthetic studies. The total synthesis of (+)-nodulisporic acid F. Organic letters, 2006, 8, 1665-1668
1516755	CIF	C29 H45 N O4 Si	P 1 21 1	15.255; 10.757; 9.418 90; 101.43; 90	1514.8	Kobayashi, Toyoharu; Hasegawa, Futoshi; Tanaka, Katsunori; Katsumura, Shigeo Synthesis of 2,4,6-trisubstituted chiral piperidines and (-)-dendroprimine by one-pot asymmetric azaelectrocyclization protocol. Organic letters, 2006, 8, 3813-3816
1516757	CIF	C15 H20 O2 S	P 1 21/c 1	6.4053; 15.414; 14.888 90; 101.497; 90	1440.4	Weatherhead-Kloster, Robin A; Corey, E. J. Theory-guided discovery of unique chemical transformations of cyclopropenes. Organic letters, 2006, 8, 171-174
1516758	CIF	C35 H34 O3 S	P 1 21 1	10.4287; 9.2211; 15.589 90; 95.126; 90	1493.1	Weatherhead-Kloster, Robin A; Corey, E. J. Theory-guided discovery of unique chemical transformations of cyclopropenes. Organic letters, 2006, 8, 171-174
1516759	CIF	C14 H18 O2 S	P 1 21/c 1	6.248; 16.63; 13.443 90; 103.304; 90	1359.3	Weatherhead-Kloster, Robin A; Corey, E. J. Theory-guided discovery of unique chemical transformations of cyclopropenes. Organic letters, 2006, 8, 171-174
1516760	CIF	C11 H11 Br O2 S	P b c a	7.4039; 12.927; 24.736 90; 90; 90	2367.5	Weatherhead-Kloster, Robin A; Corey, E. J. Theory-guided discovery of unique chemical transformations of cyclopropenes. Organic letters, 2006, 8, 171-174
1516761	CIF	C18 H18 O4 S2	P 1 21/n 1	10.1655; 11.398; 15.36 90; 102.624; 90	1736.7	Weatherhead-Kloster, Robin A; Corey, E. J. Theory-guided discovery of unique chemical transformations of cyclopropenes. Organic letters, 2006, 8, 171-174
1516762	CIF	C11 H11 Br O2 S	P -1	4.9466; 9.9378; 12.6847 105.346; 96.246; 102.488	577.9	Weatherhead-Kloster, Robin A; Corey, E. J. Theory-guided discovery of unique chemical transformations of cyclopropenes. Organic letters, 2006, 8, 171-174
1516763	CIF	C12 H11 N O2 S	P 1 21/c 1	11.05; 6.388; 16.42 90; 93.997; 90	1156.2	Weatherhead-Kloster, Robin A; Corey, E. J. Theory-guided discovery of unique chemical transformations of cyclopropenes. Organic letters, 2006, 8, 171-174
1516764	CIF	C13 H17 N O S	P 1	6.208; 7.7318; 14 100.602; 91.28; 104.16	638.8	Guntreddi, Tirumaleswararao; Vanjari, Rajeshwer; Singh, Krishna Nand Decarboxylative Thioamidation of Arylacetic and Cinnamic Acids: A New Approach to Thioamides. Organic letters, 2014, 16, 3624
1516765	CIF	C11 H13 N O S	P 21 21 21	5.6661; 10.9417; 17.4225 90; 90; 90	1080.14	Guntreddi, Tirumaleswararao; Vanjari, Rajeshwer; Singh, Krishna Nand Decarboxylative Thioamidation of Arylacetic and Cinnamic Acids: A New Approach to Thioamides. Organic letters, 2014, 16, 3624
1516766	CIF	C26 H22 N2 O	P -1	7.4266; 8.8041; 15.597 95.741; 95.028; 105.542	970.6	Cong, Xuefeng; Zeng, Xiaoming Iron-Catalyzed, Chelation-Induced Remote C-H Allylation of Quinolines via 8-Amido Assistance. Organic letters, 2014, 16, 3716
1516767	CIF	C22 H21 N2 O	P 1 21/c 1	16.8889; 5.4753; 19.842 90; 108.531; 90	1739.7	Cong, Xuefeng; Zeng, Xiaoming Iron-Catalyzed, Chelation-Induced Remote C-H Allylation of Quinolines via 8-Amido Assistance. Organic letters, 2014, 16, 3716
1516768	CIF	C40 H32 Cl F12 N5 S4	P -1	8.0301; 16.9861; 17.595 64.243; 80.825; 77.765	2106.2	Busschaert, Nathalie; Elmes, Robert B. P.; Czech, Dawid D.; Wu, Xin; Kirby, Isabelle L.; Peck, Evan M.; Hendzel, Kevin D.; Shaw, Scott K.; Chan, Bun; Smith, Bradley D.; Jolliffe, Katrina A.; Gale, Philip A. Thiosquaramides: pH switchable anion transporters Chemical Science, 2014, 5, 3617
1516769	CIF	C34 H50 N2 O3 S	P -1	11.0175; 12.8086; 12.9025 91.871; 113.774; 96.73	1648.39	Busschaert, Nathalie; Elmes, Robert B. P.; Czech, Dawid D.; Wu, Xin; Kirby, Isabelle L.; Peck, Evan M.; Hendzel, Kevin D.; Shaw, Scott K.; Chan, Bun; Smith, Bradley D.; Jolliffe, Katrina A.; Gale, Philip A. Thiosquaramides: pH switchable anion transporters Chemical Science, 2014, 5, 3617
1516770	CIF	C18 H18 N2 O S3	P 1 21/n 1	8.0488; 11.6233; 19.2104 90; 90.883; 90	1796.99	Busschaert, Nathalie; Elmes, Robert B. P.; Czech, Dawid D.; Wu, Xin; Kirby, Isabelle L.; Peck, Evan M.; Hendzel, Kevin D.; Shaw, Scott K.; Chan, Bun; Smith, Bradley D.; Jolliffe, Katrina A.; Gale, Philip A. Thiosquaramides: pH switchable anion transporters Chemical Science, 2014, 5, 3617
1516771	CIF	C36 H56 N2 O2 S4	P 1 21/c 1	18.2073; 11.9379; 19.5492 90; 115.355; 90	3839.8	Busschaert, Nathalie; Elmes, Robert B. P.; Czech, Dawid D.; Wu, Xin; Kirby, Isabelle L.; Peck, Evan M.; Hendzel, Kevin D.; Shaw, Scott K.; Chan, Bun; Smith, Bradley D.; Jolliffe, Katrina A.; Gale, Philip A. Thiosquaramides: pH switchable anion transporters Chemical Science, 2014, 5, 3617
1516772	CIF	C12 H23 Cl O11	P 1 21 1	8.048; 8.682; 12.059 90; 107.03; 90	805.6	Takashi Fujimoto; Daisuke Miura; Akari Iwamoto; Tomoya Machinami; Mitsuru Tashiro Crystal Structure of β-D-Fructofuranosyl 4-chloro-4-deoxy-α-D-galactopyranoside X-ray Structure Analysis Online, 2013, 29, 43-44
1516773	CIF	C22 H20 N2 O2	P 1 21 1	10.6163; 8.2221; 20.1917 90; 97.374; 90	1747.92	Wu, Xiang; Chen, Shu-Sen; Hu, Yue; Gong, Liu-Zhu Gold-Catalyzed [1,5]-Hydride Shift onto Unactivated Alkynes To Trigger an Intermolecular Diels-Alder Reaction. Organic letters, 2014, 16, 3820
1516774	CIF	C23 H23 Cl F6 N4 O5 S2	P 1 21/c 1	8.7957; 24.5476; 12.65 90; 96.1755; 90	2715.5	Berry, Matthew T.; Castrejon, Disnay; Hein, Jason E. Oxidative Esterification of Aldehydes Using Mesoionic 1,2,3-Triazolyl Carbene Organocatalysts. Organic letters, 2014, 16, 3676
1516775	CIF	C26 H22 O9	P -1	7.6867; 9.696; 15.7952 100.828; 98.209; 102.819	1106.3	Wright, Nathan E.; ElSohly, Adel M.; Snyder, Scott A. Syntheses of Cyclotriveratrylene Analogues and Their Long Elusive Triketone Congeners. Organic letters, 2014, 16, 3644
1516776	CIF	C27 H26 O8	P 1 21/n 1	12.7447; 11.7233; 15.8897 90; 96.2678; 90	2359.9	Wright, Nathan E.; ElSohly, Adel M.; Snyder, Scott A. Syntheses of Cyclotriveratrylene Analogues and Their Long Elusive Triketone Congeners. Organic letters, 2014, 16, 3644
1516777	CIF	C27 H30 O6	P 3	20.637; 20.637; 4.4453 90; 90; 120	1639.6	Wright, Nathan E.; ElSohly, Adel M.; Snyder, Scott A. Syntheses of Cyclotriveratrylene Analogues and Their Long Elusive Triketone Congeners. Organic letters, 2014, 16, 3644
1516778	CIF	C30 H22 Br2 N2 O	P -1	8.514; 11.9243; 13.0666 75.732; 89.44; 86.411	1283.1	Dawande, Sudam Ganpat; Kanchupalli, Vinaykumar; Lad, Bapurao Sudam; Rai, Jyoti; Katukojvala, Sreenivas Synergistic Rhodium(II) Carboxylate and Brønsted Acid Catalyzed Multicomponent Reactions of Enalcarbenoids: Direct Synthesis of α-Pyrrolylbenzylamines. Organic letters, 2014, 16, 3700
1516779	CIF	C15 H14 O2 S	C 1 c 1	14.341; 11.316; 17.625 90; 114.01; 90	2612.8	Liu, Feng-Lei; Chen, Jia-Rong; Zou, You-Quan; Wei, Qiang; Xiao, Wen-Jing Three-Component Coupling Reaction Triggered by Insertion of Arynes into the S═O Bond of DMSO. Organic letters, 2014, 16, 3768
1516780	CIF	C26 H19 Br N2 O2	P 1 21 1	11.2046; 5.9421; 15.3755 90; 92.792; 90	1022.47	Yang, Limin; Wang, Fei; Lee, Richmond; Lv, Yunbo; Huang, Kuo-Wei; Zhong, Guofu Asymmetric NHC-Catalyzed Aza-Diels-Alder Reactions: Highly Enantioselective Route to α-Amino Acid Derivatives and DFT Calculations. Organic letters, 2014, 16, 3872-3875
1516781	CIF	C22 H26 N2 O2 S	P 1 21/c 1	8.324; 15.6431; 15.7979 90; 94.896; 90	2049.6	Jiang, Bo; Tu, Xing-Jun; Wang, Xue; Tu, Shu-Jiang; Li, Guigen Copper(I)-Catalyzed Multicomponent Reaction Providing a New Access to Fully Substituted Thiophene Derivatives. Organic letters, 2014, 16, 3656
1516782	CIF	C31 H22 N2 O3 S2	P 1 21/c 1	14.552; 9.7511; 19.559 90; 105.499; 90	2674.5	Jiang, Bo; Tu, Xing-Jun; Wang, Xue; Tu, Shu-Jiang; Li, Guigen Copper(I)-Catalyzed Multicomponent Reaction Providing a New Access to Fully Substituted Thiophene Derivatives. Organic letters, 2014, 16, 3656
1516783	CIF	C61 H51 N7 O6	P -1	9.6372; 13.2613; 20.4245 79.8271; 76.8586; 86.464	2501.34	Veliks, Janis; Tseng, Jui-Chang; Arias, Karla I.; Weisshar, Florian; Linden, Anthony; Siegel, Jay S. Linear bilateral extended 2,2′:6′,2′′-terpyridine ligands, their coordination complexes and heterometallic supramolecular networks Chem. Sci., 2014, 5, 4317
1516784	CIF	C51 H45 N5 O6	P 1 21/n 1	11.64397; 24.31232; 15.4118 90; 104.526; 90	4223.49	Veliks, Janis; Tseng, Jui-Chang; Arias, Karla I.; Weisshar, Florian; Linden, Anthony; Siegel, Jay S. Linear bilateral extended 2,2′:6′,2′′-terpyridine ligands, their coordination complexes and heterometallic supramolecular networks Chem. Sci., 2014, 5, 4317
1516785	CIF	C31 H19 N3 O2	P 1 21/c 1	30.3556; 5.611; 13.1495 90; 92.9605; 90	2236.7	Veliks, Janis; Tseng, Jui-Chang; Arias, Karla I.; Weisshar, Florian; Linden, Anthony; Siegel, Jay S. Linear bilateral extended 2,2′:6′,2′′-terpyridine ligands, their coordination complexes and heterometallic supramolecular networks Chem. Sci., 2014, 5, 4317
1516786	CIF	C72 H61 F12 Fe N7 O6 P2	P -1	14.2809; 15.6419; 17.7181 100.41; 107.925; 94.131	3669.16	Veliks, Janis; Tseng, Jui-Chang; Arias, Karla I.; Weisshar, Florian; Linden, Anthony; Siegel, Jay S. Linear bilateral extended 2,2′:6′,2′′-terpyridine ligands, their coordination complexes and heterometallic supramolecular networks Chem. Sci., 2014, 5, 4317
1516787	CIF	C76 H67 F12 N9 O6 P2 Ru	P -1	14.138; 14.332; 19.077 91.222; 108.825; 93.257	3650	Veliks, Janis; Tseng, Jui-Chang; Arias, Karla I.; Weisshar, Florian; Linden, Anthony; Siegel, Jay S. Linear bilateral extended 2,2′:6′,2′′-terpyridine ligands, their coordination complexes and heterometallic supramolecular networks Chem. Sci., 2014, 5, 4317
1516788	CIF	C78 H66 F12 N12 O5 P2 Zn	P -1	14.38087; 14.4368; 19.8 96.8363; 107.786; 91.1601	3879.48	Veliks, Janis; Tseng, Jui-Chang; Arias, Karla I.; Weisshar, Florian; Linden, Anthony; Siegel, Jay S. Linear bilateral extended 2,2′:6′,2′′-terpyridine ligands, their coordination complexes and heterometallic supramolecular networks Chem. Sci., 2014, 5, 4317
1516789	CIF	C47 H37 N5 O4	C 1 2/c 1	32.6617; 8.8705; 25.8704 90; 93.738; 90	7479.4	Veliks, Janis; Tseng, Jui-Chang; Arias, Karla I.; Weisshar, Florian; Linden, Anthony; Siegel, Jay S. Linear bilateral extended 2,2′:6′,2′′-terpyridine ligands, their coordination complexes and heterometallic supramolecular networks Chem. Sci., 2014, 5, 4317
1516790	CIF	C142 H107 Ag2 F36 Fe2 N33 O8 P6	P -1	17.3266; 21.9786; 23.2172 99.59; 108.832; 107.228	7649.13	Veliks, Janis; Tseng, Jui-Chang; Arias, Karla I.; Weisshar, Florian; Linden, Anthony; Siegel, Jay S. Linear bilateral extended 2,2′:6′,2′′-terpyridine ligands, their coordination complexes and heterometallic supramolecular networks Chem. Sci., 2014, 5, 4317
1516791	CIF	C69 H50.5 Cu F18 Fe N15.5 O4 P3	P -1	14.9414; 15.3956; 18.3235 94.4451; 91.636; 113.008	3860.05	Veliks, Janis; Tseng, Jui-Chang; Arias, Karla I.; Weisshar, Florian; Linden, Anthony; Siegel, Jay S. Linear bilateral extended 2,2′:6′,2′′-terpyridine ligands, their coordination complexes and heterometallic supramolecular networks Chem. Sci., 2014, 5, 4317
1516792	CIF	C34 H26 I2 N2 O8	P -1	6.6274; 9.4654; 12.3549 82.12; 80.651; 79.408	747.1	Cao, Dennis; Hong, Michael; Blackburn, Anthea K.; Liu, Zhichang; Holcroft, James M.; Stoddart, J. Fraser Two-point halogen bonding between 3,6-dihalopyromellitic diimides Chem. Sci., 2014, 5, 4242
1516793	CIF	C28 H28 Br2 N4 O8	P 1 21/c 1	6.7598; 22.6656; 9.1153 90; 101.623; 90	1367.96	Cao, Dennis; Hong, Michael; Blackburn, Anthea K.; Liu, Zhichang; Holcroft, James M.; Stoddart, J. Fraser Two-point halogen bonding between 3,6-dihalopyromellitic diimides Chem. Sci., 2014, 5, 4242
1516794	CIF	C28 H28 Cl2 N4 O8	P 1 21/c 1	6.6819; 22.978; 8.8554 90; 101.576; 90	1331.97	Cao, Dennis; Hong, Michael; Blackburn, Anthea K.; Liu, Zhichang; Holcroft, James M.; Stoddart, J. Fraser Two-point halogen bonding between 3,6-dihalopyromellitic diimides Chem. Sci., 2014, 5, 4242
1516795	CIF	C15 H13 I2 N3 O6	P -1	7.2221; 9.4868; 13.2822 93.245; 102.205; 99.769	872.51	Cao, Dennis; Hong, Michael; Blackburn, Anthea K.; Liu, Zhichang; Holcroft, James M.; Stoddart, J. Fraser Two-point halogen bonding between 3,6-dihalopyromellitic diimides Chem. Sci., 2014, 5, 4242
1516796	CIF	C10 H2 Br2 N2 O4	P 1 21/c 1	7.3668; 5.4181; 12.525 90; 92.257; 90	499.54	Cao, Dennis; Hong, Michael; Blackburn, Anthea K.; Liu, Zhichang; Holcroft, James M.; Stoddart, J. Fraser Two-point halogen bonding between 3,6-dihalopyromellitic diimides Chem. Sci., 2014, 5, 4242
1516797	CIF	C10 H2 Cl2 N2 O4	P 1 21/c 1	7.1051; 5.4752; 12.252 90; 90.693; 90	476.59	Cao, Dennis; Hong, Michael; Blackburn, Anthea K.; Liu, Zhichang; Holcroft, James M.; Stoddart, J. Fraser Two-point halogen bonding between 3,6-dihalopyromellitic diimides Chem. Sci., 2014, 5, 4242
1516798	CIF	C14 H15 Br O4	P 21 21 21	6.2502; 7.11208; 31.0868 90; 90; 90	1381.87	Choi, Jae-Hoon; Suzuki, Tomohiro; Okumura, Hiroshi; Noguchi, Keiichi; Kondo, Mitsuru; Nagai, Kaoru; Hirai, Hirofumi; Kawagishi, Hirokazu Endoplasmic Reticulum Stress Suppressive Compounds from the Edible Mushroom Mycoleptodonoides aitchisonii. Journal of natural products, 2014, 77, 1729-1733
1516799	CIF	C32 H25 Br3 O6	P 1 21 1	14.899; 5.697; 17.092 90; 93.694; 90	1447.7	Choi, Jae-Hoon; Suzuki, Tomohiro; Okumura, Hiroshi; Noguchi, Keiichi; Kondo, Mitsuru; Nagai, Kaoru; Hirai, Hirofumi; Kawagishi, Hirokazu Endoplasmic Reticulum Stress Suppressive Compounds from the Edible Mushroom Mycoleptodonoides aitchisonii. Journal of natural products, 2014, 77, 1729-1733
1516800	CIF	C4 H9 N O2 S	P -1	5.1951; 5.5041; 11.4271 102.665; 90.998; 107.131	303.48	Minkov, Vasily S.; Boldyreva, Elena V. Contribution of Weak S-H···O Hydrogen Bonds to the Side Chain Motions in d,l-Homocysteine on Cooling. The journal of physical chemistry. B, 2014, 118, 8513-8523
1516801	CIF	C4 H9 N O2 S	P -1	5.1915; 5.5032; 11.411 102.745; 91.059; 107.105	302.7	Minkov, Vasily S.; Boldyreva, Elena V. Contribution of Weak S-H···O Hydrogen Bonds to the Side Chain Motions in d,l-Homocysteine on Cooling. The journal of physical chemistry. B, 2014, 118, 8513-8523
1516802	CIF	C4 H9 N O2 S	P -1	5.1897; 5.5033; 11.3966 102.817; 91.102; 107.1	302.1	Minkov, Vasily S.; Boldyreva, Elena V. Contribution of Weak S-H···O Hydrogen Bonds to the Side Chain Motions in d,l-Homocysteine on Cooling. The journal of physical chemistry. B, 2014, 118, 8513-8523
1516803	CIF	C4 H9 N O2 S	P -1	5.185; 5.5008; 11.3777 102.875; 91.152; 107.075	301.13	Minkov, Vasily S.; Boldyreva, Elena V. Contribution of Weak S-H···O Hydrogen Bonds to the Side Chain Motions in d,l-Homocysteine on Cooling. The journal of physical chemistry. B, 2014, 118, 8513-8523
1516804	CIF	C4 H9 N O2 S	P -1	5.1838; 5.5014; 11.3669 102.934; 91.19; 107.073	300.71	Minkov, Vasily S.; Boldyreva, Elena V. Contribution of Weak S-H···O Hydrogen Bonds to the Side Chain Motions in d,l-Homocysteine on Cooling. The journal of physical chemistry. B, 2014, 118, 8513-8523
1516805	CIF	C4 H9 N O2 S	P -1	5.1788; 5.499; 11.3501 102.992; 91.237; 107.058	299.77	Minkov, Vasily S.; Boldyreva, Elena V. Contribution of Weak S-H···O Hydrogen Bonds to the Side Chain Motions in d,l-Homocysteine on Cooling. The journal of physical chemistry. B, 2014, 118, 8513-8523
1516806	CIF	C4 H9 N O2 S	P -1	5.1785; 5.5003; 11.3433 103.032; 91.273; 107.054	299.58	Minkov, Vasily S.; Boldyreva, Elena V. Contribution of Weak S-H···O Hydrogen Bonds to the Side Chain Motions in d,l-Homocysteine on Cooling. The journal of physical chemistry. B, 2014, 118, 8513-8523
1516807	CIF	C4 H9 N O2 S	P -1	5.1741; 5.4977; 11.3292 103.079; 91.286; 107.046	298.75	Minkov, Vasily S.; Boldyreva, Elena V. Contribution of Weak S-H···O Hydrogen Bonds to the Side Chain Motions in d,l-Homocysteine on Cooling. The journal of physical chemistry. B, 2014, 118, 8513-8523
1516808	CIF	C4 H9 N O2 S	P -1	5.1725; 5.4987; 11.3229 103.123; 91.313; 107.03	298.5	Minkov, Vasily S.; Boldyreva, Elena V. Contribution of Weak S-H···O Hydrogen Bonds to the Side Chain Motions in d,l-Homocysteine on Cooling. The journal of physical chemistry. B, 2014, 118, 8513-8523
1516809	CIF	C4 H9 N O2 S	P -1	5.1707; 5.4969; 11.3141 103.133; 91.352; 107.033	298.02	Minkov, Vasily S.; Boldyreva, Elena V. Contribution of Weak S-H···O Hydrogen Bonds to the Side Chain Motions in d,l-Homocysteine on Cooling. The journal of physical chemistry. B, 2014, 118, 8513-8523
1516810	CIF	C4 H9 N O2 S	P -1	5.1682; 5.4961; 11.3055 103.162; 91.377; 107.022	297.58	Minkov, Vasily S.; Boldyreva, Elena V. Contribution of Weak S-H···O Hydrogen Bonds to the Side Chain Motions in d,l-Homocysteine on Cooling. The journal of physical chemistry. B, 2014, 118, 8513-8523
1516811	CIF	C20 H22 Br N O5	P 1 21 1	6.9109; 13.975; 10.4052 90; 106.962; 90	961.2	Gao, Run-Duo; Liu, Chuan; Dai, Li-Xin; Zhang, Wei; You, Shu-Li Pd(0)-Catalyzed Alkenylation and Allylic Dearomatization Reactions between Nucleophile-Bearing Indoles and Propargyl Carbonate. Organic letters, 2014, 16, 3919-3921
1516812	CIF	C18 H16 N2 O3	F d d 2	27.454; 32.678; 6.833 90; 90; 90	6130	Gould, Eoin; Walden, Daniel M.; Kasten, Kevin; Johnston, Ryne C.; Wu, Jiufeng; Slawin, Alexandra M. Z.; Mustard, Thomas J. L.; Johnston, Brittany; Davies, Tony; Ha-Yeon Cheong, Paul; Smith, Andrew D. Catalyst selective and regiodivergent O- to C- or N-carboxyl transfer of pyrazolyl carbonates: synthetic and computational studies Chemical Science, 2014, 5, 3651
1516813	CIF	C13 H14 N2 O3	P 1 21 1	6.2771; 11.7706; 8.7028 90; 97.826; 90	637.02	Gould, Eoin; Walden, Daniel M.; Kasten, Kevin; Johnston, Ryne C.; Wu, Jiufeng; Slawin, Alexandra M. Z.; Mustard, Thomas J. L.; Johnston, Brittany; Davies, Tony; Ha-Yeon Cheong, Paul; Smith, Andrew D. Catalyst selective and regiodivergent O- to C- or N-carboxyl transfer of pyrazolyl carbonates: synthetic and computational studies Chemical Science, 2014, 5, 3651
1516814	CIF	C18 H16 N2 O3	P c a 21	28.94; 5.9109; 9.179 90; 90; 90	1570.2	Gould, Eoin; Walden, Daniel M.; Kasten, Kevin; Johnston, Ryne C.; Wu, Jiufeng; Slawin, Alexandra M. Z.; Mustard, Thomas J. L.; Johnston, Brittany; Davies, Tony; Ha-Yeon Cheong, Paul; Smith, Andrew D. Catalyst selective and regiodivergent O- to C- or N-carboxyl transfer of pyrazolyl carbonates: synthetic and computational studies Chemical Science, 2014, 5, 3651
1516815	CIF	C19 H18 N2 O3	P 1 21/c 1	5.504; 26.45; 11.354 90; 94.55; 90	1647.7	Gould, Eoin; Walden, Daniel M.; Kasten, Kevin; Johnston, Ryne C.; Wu, Jiufeng; Slawin, Alexandra M. Z.; Mustard, Thomas J. L.; Johnston, Brittany; Davies, Tony; Ha-Yeon Cheong, Paul; Smith, Andrew D. Catalyst selective and regiodivergent O- to C- or N-carboxyl transfer of pyrazolyl carbonates: synthetic and computational studies Chemical Science, 2014, 5, 3651
1516816	CIF	C19 H10 Cl4 N3 O6 P3	P -1	7.6291; 10.2522; 16.241 83.071; 87.666; 69.357	1180.05	Gonul Yenilmez Ciftci; Esra Tanriverdi Ecik; Mustafa Bulut; Fatma Yuksel; Adem Kilic; Mahmut Durmus Synthesis and characterization of dicoumarol substituted cyclotriphosphazenes Inorganica Chimica Acta, 2013, 398, 106-112
1516817	CIF	C38 H20 Cl2 N3 O12 P3	P 1 21/n 1	14.3683; 16.4258; 15.8683 90; 103.739; 90	3637.93	Gonul Yenilmez Ciftci; Esra Tanriverdi Ecik; Mustafa Bulut; Fatma Yuksel; Adem Kilic; Mahmut Durmus Synthesis and characterization of dicoumarol substituted cyclotriphosphazenes Inorganica Chimica Acta, 2013, 398, 106-112
1516818	CIF	C85 H86 N3 O25 P3	P -1	14.5715; 17.2507; 17.2596 82.89; 75.604; 73.08	4014.2	Gonul Yenilmez Ciftci; Esra Tanriverdi Ecik; Mustafa Bulut; Fatma Yuksel; Adem Kilic; Mahmut Durmus Synthesis and characterization of dicoumarol substituted cyclotriphosphazenes Inorganica Chimica Acta, 2013, 398, 106-112
1516819	CIF	C80 H124 N4 O15 Re2 Ti2	P 1 21 1	19.9022; 17.8522; 24.9096 90; 90.652; 90	8849.76	Chen Li; Xiao Peng; Shou-Chun Zhang; Li-Yuan Chai; Xiao-Yi Yi Heteropolymetallic complexes containing ReO4-: Catalytic oxidation of sulfide Inorganica Chimica Acta, 2013, 398, 113-116
1516820	CIF	C42 H34 N2 O5 P2 Pd S4	P -1	10.9755; 11.1596; 18.1144 75.397; 77.504; 82.693	2089.95	Subhi A. Al-Jibori; Mohamed H.S. Al-Jibori; Graeme Hogarth Thiosaccharinate binding to palladium(II) and platinum(II): Synthesis and molecular structures of sulfur-bound complexes [M(?1-tsac)2(?2-diphosphane)] Inorganica Chimica Acta, 2013, 398, 117-123
1516821	CIF	C41.25 H41 Cl1.5 N2 O7 P2 Pt S4	C 1 2/c 1	29.031; 20.477; 15.281 90; 105.325; 90	8761	Subhi A. Al-Jibori; Mohamed H.S. Al-Jibori; Graeme Hogarth Thiosaccharinate binding to palladium(II) and platinum(II): Synthesis and molecular structures of sulfur-bound complexes [M(?1-tsac)2(?2-diphosphane)] Inorganica Chimica Acta, 2013, 398, 117-123
1516822	CIF	C23 H18 F18 N2 O8 Y	P 1 21/n 1	10.796; 16.078; 19.198 90; 93.815; 90	3325	Peng Hu; Congming Zhang; Yuanyuan Gao; Yungai Li; Yue Ma; Licun Li; Daizheng Liao Lanthanide-radical linear chain compounds based on 2,4,4,5,5-pentamethylimidazoline-1-oxyl-3-oxide: Structure and magnetic properties Inorganica Chimica Acta, 2013, 398, 136-140
1516823	CIF	C23 H18 Dy F18 N2 O8	P 1 21/n 1	10.775; 16.108; 19.189 90; 93.768; 90	3323.3	Peng Hu; Congming Zhang; Yuanyuan Gao; Yungai Li; Yue Ma; Licun Li; Daizheng Liao Lanthanide-radical linear chain compounds based on 2,4,4,5,5-pentamethylimidazoline-1-oxyl-3-oxide: Structure and magnetic properties Inorganica Chimica Acta, 2013, 398, 136-140
1516824	CIF	C26 H20 Cu N6 O4	A b a 2	12.576; 17.8297; 10.7632 90; 90; 90	2413.39	Satyajit Mondal; Sumita Naskar; Ayan Kumar Dey; Ekkehard Sinn; Carla Eribal; Steven R. Herron; Shyamal Kumar Chattopadhyay Mononuclear and binuclear Cu(II) complexes of some tridentate aroyl hydrazones. X-ray crystal structures of a mononuclear and a binuclear complex Inorganica Chimica Acta, 2013, 398, 98-105
1516825	CIF	C28 H24 Cl2 Cu2 N6 O4	P -1	8.3; 9.1116; 10.8269 71.369; 74.335; 68.143	709.41	Satyajit Mondal; Sumita Naskar; Ayan Kumar Dey; Ekkehard Sinn; Carla Eribal; Steven R. Herron; Shyamal Kumar Chattopadhyay Mononuclear and binuclear Cu(II) complexes of some tridentate aroyl hydrazones. X-ray crystal structures of a mononuclear and a binuclear complex Inorganica Chimica Acta, 2013, 398, 98-105
1516826	CIF	C32 H46 O6	P 21 21 21	9.264; 10.161; 30.399 90; 90; 90	2861.5	Lakornwong, Waranya; Kanokmedhakul, Kwanjai; Kanokmedhakul, Somdej; Kongsaeree, Palangpon; Prabpai, Samran; Sibounnavong, Phoutthasone; Soytong, Kasem Triterpene Lactones from Cultures of Ganoderma sp. KM01. Journal of natural products, 2014, 77, 1545-1553
1516827	CIF	C30 H38 O5	P 1 21 1	7.304; 15.576; 11.301 90; 100.378; 90	1264.65	Lakornwong, Waranya; Kanokmedhakul, Kwanjai; Kanokmedhakul, Somdej; Kongsaeree, Palangpon; Prabpai, Samran; Sibounnavong, Phoutthasone; Soytong, Kasem Triterpene Lactones from Cultures of Ganoderma sp. KM01. Journal of natural products, 2014, 77, 1545-1553
1516828	CIF	C30 H36 O6	P 21 21 21	7.13; 15.575; 22.969 90; 90; 90	2550.7	Lakornwong, Waranya; Kanokmedhakul, Kwanjai; Kanokmedhakul, Somdej; Kongsaeree, Palangpon; Prabpai, Samran; Sibounnavong, Phoutthasone; Soytong, Kasem Triterpene Lactones from Cultures of Ganoderma sp. KM01. Journal of natural products, 2014, 77, 1545-1553
1516829	CIF	C35 H38 Cl3 N O7	P -1	10.4484; 12.9132; 14.4521 105.509; 110.788; 101.371	1661.72	Noor, Asif; Moratti, Stephen C.; Crowley, James D. Active-template synthesis of “click” [2]rotaxane ligands: self-assembly of mechanically interlocked metallo-supramolecular dimers, macrocycles and oligomers Chem. Sci., 2014, 5, 4283
1516830	CIF	C72 H82 Ag2 F6 N2 O22 S2	P -1	11.0298; 12.4731; 15.6946 87.5; 72.011; 67.114	1884.8	Noor, Asif; Moratti, Stephen C.; Crowley, James D. Active-template synthesis of “click” [2]rotaxane ligands: self-assembly of mechanically interlocked metallo-supramolecular dimers, macrocycles and oligomers Chem. Sci., 2014, 5, 4283
1516831	CIF	C44 H32 B2 Cl2 F8 Fe N6	P 1 21/c 1	17.892; 14.886; 15.952 90; 110.371; 90	3983	Noor, Asif; Moratti, Stephen C.; Crowley, James D. Active-template synthesis of “click” [2]rotaxane ligands: self-assembly of mechanically interlocked metallo-supramolecular dimers, macrocycles and oligomers Chem. Sci., 2014, 5, 4283
1516832	CIF	C36 H30 O6	P -1	11.7263; 13.0863; 19.3723 85.925; 79.517; 76.411	2840.06	Bruzek, Matthew J.; Anthony, John E. Synthesis and optical properties of dioxolane-functionalized hexacenes and heptacenes. Organic letters, 2014, 16, 3608-3610
1516833	CIF	C48 H48 O6	P -1	6.0156; 8.3441; 18.7234 95.527; 97.68; 99.574	911.63	Bruzek, Matthew J.; Anthony, John E. Synthesis and optical properties of dioxolane-functionalized hexacenes and heptacenes. Organic letters, 2014, 16, 3608-3610
1516834	CIF	C51 H52 O6	P 1 21/n 1	6.0151; 17.0075; 20.7444 90; 95.875; 90	2111.04	Bruzek, Matthew J.; Anthony, John E. Synthesis and optical properties of dioxolane-functionalized hexacenes and heptacenes. Organic letters, 2014, 16, 3608-3610
1516835	CIF	C76 H48 Cl4 N8 O12 Pb4 S4	P -1	11.6469; 12.2824; 14.1122 82.427; 72.489; 84.915	1905.87	Jennifer, Samson; Thomas Muthiah, Packianathan Syntheses and characterization of two novel tetranuclear lead(II) clusters self-assembled by hydrogen bonded interactions Chemistry Central Journal, 2014, 8, 39
1516836	CIF	C80 H48 Cl4 N8 O12 Pb4 S4	P -1	11.5185; 12.225; 14.7743 81.913; 72.349; 84.455	1959.55	Jennifer, Samson; Thomas Muthiah, Packianathan Syntheses and characterization of two novel tetranuclear lead(II) clusters self-assembled by hydrogen bonded interactions Chemistry Central Journal, 2014, 8, 39
1516837	CIF	C21 H23 N O4	C 1 2/c 1	26.838; 9.9597; 18.698 90; 133.339; 90	3635	Yuan, Ji-Wen; Qiu, Han-Yue; Wang, Peng-Fei; Makawana, Jigar A.; Yang, Yong-An; Zhang, Fei; Yin, Yong; Lin, Jie; Wang, Zhong-Chang; Zhu, Hai-Liang Synthesis of caffeic acid amides bearing 2,3,4,5-tetra-hydrobenzo[b][1,4]dioxocine moieties and their biological evaluation as antitumor agents. Molecules (Basel, Switzerland), 2014, 19, 7269-7286
1516838	CIF	C19 H27 N4 O3	P 1 21/c 1	18.93; 5.8718; 18.364 90; 105.364; 90	1968.3	Price, Jacquelyn T.; Paquette, Joseph A.; Harrison, Christopher S.; Bauld, Reg; Fanchini, Giovanni; Gilroy, Joe B. 6-Oxoverdazyl radical polymers with tunable electrochemical properties Polymer Chemistry, 2014
1516839	CIF	C14 H19 N4 O	P n a 21	16.219; 15.484; 5.7192 90; 90; 90	1436.3	Price, Jacquelyn T.; Paquette, Joseph A.; Harrison, Christopher S.; Bauld, Reg; Fanchini, Giovanni; Gilroy, Joe B. 6-Oxoverdazyl radical polymers with tunable electrochemical properties Polymer Chemistry, 2014
1516840	CIF	C14 H19 B F4 N4 O	P 1 21/c 1	8.1059; 13.501; 15.435 90; 99.864; 90	1664.2	Price, Jacquelyn T.; Paquette, Joseph A.; Harrison, Christopher S.; Bauld, Reg; Fanchini, Giovanni; Gilroy, Joe B. 6-Oxoverdazyl radical polymers with tunable electrochemical properties Polymer Chemistry, 2014
1516841	CIF	C30 H32 Cl2 N6 O5	P 1 21/n 1	11.884; 19.7413; 14.4839 90; 112.994; 90	3128	Kuldeep Mahiya; Pavan Mathur Morphology dependant oxidation of aromatic alcohols by new symmetrical copper(II) metallatriangles formed by self-assembly of a shared bis-benzimidazolyl diamide ligand Inorganica Chimica Acta, 2013, 399, 36-44
1516842	CIF	C90 H72 Cl6 Cu3 N18 O13.5	R -3 :H	27.3168; 27.3168; 49.6611 90; 90; 120	32092.7	Kuldeep Mahiya; Pavan Mathur Morphology dependant oxidation of aromatic alcohols by new symmetrical copper(II) metallatriangles formed by self-assembly of a shared bis-benzimidazolyl diamide ligand Inorganica Chimica Acta, 2013, 399, 36-44
1516843	CIF	C30 H24 N6 O2	C 1 2/c 1	18.406; 14.735; 9.95 90; 116.08; 90	2423.8	Kuldeep Mahiya; Pavan Mathur Morphology dependant oxidation of aromatic alcohols by new symmetrical copper(II) metallatriangles formed by self-assembly of a shared bis-benzimidazolyl diamide ligand Inorganica Chimica Acta, 2013, 399, 36-44
1516844	CIF	C15 H6 N7 O2 Zn2	I 41 3 2	14.834; 14.834; 14.834 90; 90; 90	3264.19	Yu-Hui Tan; Ji-Si Wu; Chang-Shan Yang; Qiang-Ren Liu; Yun-Zhi Tang; Yong-Rui Zhong; Bao-Hui Ye Spontaneous resolution of novel Zn complexes in the formation of 3D metal-organic frameworks based on 2,2'-biimidazole ligand Inorganica Chimica Acta, 2013, 399, 45-49
1516845	CIF	C15 H6 N7 O2 Zn2	I 41 3 2	14.8352; 14.8352; 14.8352 90; 90; 90	3264.98	Yu-Hui Tan; Ji-Si Wu; Chang-Shan Yang; Qiang-Ren Liu; Yun-Zhi Tang; Yong-Rui Zhong; Bao-Hui Ye Spontaneous resolution of novel Zn complexes in the formation of 3D metal-organic frameworks based on 2,2'-biimidazole ligand Inorganica Chimica Acta, 2013, 399, 45-49
1516846	CIF	C37 H32 Fe4 I O4 P	P 1 21/c 1	13.4803; 24.6057; 12.4343 90; 95.362; 90	4106.3	Huei-Fang Dai; Wen-Yann Yeh Synthesis and characterization of phosphonium and phosphine oxide linked to a tetrairon cluster Inorganica Chimica Acta, 2013, 399, 50-54
1516847	CIF	C36 H30 Fe4 O5.5 P	P 1 21/c 1	41.6718; 9.4075; 15.6428 90; 93.607; 90	6120.3	Huei-Fang Dai; Wen-Yann Yeh Synthesis and characterization of phosphonium and phosphine oxide linked to a tetrairon cluster Inorganica Chimica Acta, 2013, 399, 50-54
1516848	CIF	C67 H60 N6 O3	P 1 21/c 1	10.058; 27.711; 18.798 90; 98.22; 90	5185.5	Tanya Tan; Carolina Gimbert-Surinach; Mohan Bhadbhade; Stephen B. Colbran Flexible dinucleating N,N,N-tridentate ligands based on a xanthene scaffold Inorganica Chimica Acta, 2013, 399, 55-61
1516849	CIF	C74 H60 Cl1.5 F6 N6.5 O3.5 P Pd	P 1 21/c 1	21.035; 13.514; 25.839 90; 105.904; 90	7064	Tanya Tan; Carolina Gimbert-Surinach; Mohan Bhadbhade; Stephen B. Colbran Flexible dinucleating N,N,N-tridentate ligands based on a xanthene scaffold Inorganica Chimica Acta, 2013, 399, 55-61
1516850	CIF	C31 H32 N4 Ni	P -1	9.5642; 12.4445; 12.6253 104.502; 99.804; 111.822	1291.28	Eunhee Kim; Hyosun Lee Template synthesis and X-ray crystal structures of 15-membered unsymmetric monobenzotetraazaannulene nickel(II) complexes Inorganica Chimica Acta, 2013, 399, 62-66
1516851	CIF	C29 H27 N5 Ni O2	P -1	10.2389; 11.0827; 12.345 74.284; 67.297; 79.33	1238.86	Eunhee Kim; Hyosun Lee Template synthesis and X-ray crystal structures of 15-membered unsymmetric monobenzotetraazaannulene nickel(II) complexes Inorganica Chimica Acta, 2013, 399, 62-66
1516852	CIF	C50 H48 B2 Co N6 O6	P 1 21/c 1	20.168; 16.754; 13.375 90; 94.148; 90	4507.5	Yan Z. Voloshin; Andrey Y. Lebedev; Valentin V. Novikov; Alexander V. Dolganov; Anna V. Vologzhanina; Ekaterina G. Lebed; Alexander A. Pavlov; Zoya A. Starikova; Michail I. Buzin; Yurii N. Bubnov Template synthesis, X-ray structure, spectral and redox properties of the paramagnetic alkylboron-capped cobalt(II) clathrochelates and their diamagnetic iron(II)-containing analogs Inorganica Chimica Acta, 2013, 399, 67-78
1516853	CIF	C57 H64 B2 Fe N6 O6	P -1	10.566; 14.168; 18.767 85.743; 81.421; 68.943	2591.8	Yan Z. Voloshin; Andrey Y. Lebedev; Valentin V. Novikov; Alexander V. Dolganov; Anna V. Vologzhanina; Ekaterina G. Lebed; Alexander A. Pavlov; Zoya A. Starikova; Michail I. Buzin; Yurii N. Bubnov Template synthesis, X-ray structure, spectral and redox properties of the paramagnetic alkylboron-capped cobalt(II) clathrochelates and their diamagnetic iron(II)-containing analogs Inorganica Chimica Acta, 2013, 399, 67-78
1516854	CIF	C14 H24 B2 Co N6 O6	P 1 21/n 1	8.246; 23.91; 19.501 90; 89.998; 90	3844.9	Yan Z. Voloshin; Andrey Y. Lebedev; Valentin V. Novikov; Alexander V. Dolganov; Anna V. Vologzhanina; Ekaterina G. Lebed; Alexander A. Pavlov; Zoya A. Starikova; Michail I. Buzin; Yurii N. Bubnov Template synthesis, X-ray structure, spectral and redox properties of the paramagnetic alkylboron-capped cobalt(II) clathrochelates and their diamagnetic iron(II)-containing analogs Inorganica Chimica Acta, 2013, 399, 67-78
1516855	CIF	C14 H24 B2 Fe N6 O6	P b c n	19.9212; 8.2523; 23.3202 90; 90; 90	3833.7	Yan Z. Voloshin; Andrey Y. Lebedev; Valentin V. Novikov; Alexander V. Dolganov; Anna V. Vologzhanina; Ekaterina G. Lebed; Alexander A. Pavlov; Zoya A. Starikova; Michail I. Buzin; Yurii N. Bubnov Template synthesis, X-ray structure, spectral and redox properties of the paramagnetic alkylboron-capped cobalt(II) clathrochelates and their diamagnetic iron(II)-containing analogs Inorganica Chimica Acta, 2013, 399, 67-78
1516856	CIF	C30 H28 N14 O8 Zn	P 1 21/n 1	10.628; 11.513; 13.554 90; 109.744; 90	1561	Feng Guo Hydrothermal syntheses, crystal structure and luminescent properties of four zinc(II) coordination polymers based on tipodal imidazole Inorganica Chimica Acta, 2013, 399, 79-84
1516857	CIF	C30 H24 Cl2 N12 Zn	P -3 1 c	11.472; 11.472; 15.217 90; 90; 120	1734.4	Feng Guo Hydrothermal syntheses, crystal structure and luminescent properties of four zinc(II) coordination polymers based on tipodal imidazole Inorganica Chimica Acta, 2013, 399, 79-84
1516858	CIF	C23 H16 N6 O5 Zn	P 1 21/c 1	9.699; 13.677; 16.584 90; 93.644; 90	2195.5	Feng Guo Hydrothermal syntheses, crystal structure and luminescent properties of four zinc(II) coordination polymers based on tipodal imidazole Inorganica Chimica Acta, 2013, 399, 79-84
1516859	CIF	C48 H40 N12 O10 Zn2	P -1	8.02; 17.175; 17.577 97.522; 97.742; 96.306	2358.3	Feng Guo Hydrothermal syntheses, crystal structure and luminescent properties of four zinc(II) coordination polymers based on tipodal imidazole Inorganica Chimica Acta, 2013, 399, 79-84
1516860	CIF	C12 H14 Ca N4 O8	C 1 2/c 1	13.282; 8.414; 16.325 90; 111.439; 90	1698.16	Barbara Barszcz; Joanna Masternak; Maciej Hodorowicz; Ewa Matczak-Jon; Agnieszka Jablonska-Wawrzycka; Katarzyna Stadnicka; Malgorzata Zienkiewicz; Karolina Krolewska; Julia Kazmierczak-Baranska Synthesis, crystal structure and NMR investigation of novel Ca(II) complexes with heterocyclic alcohol, aldehyde and carboxylate ligands. Evaluation of Ca(II) and Cd(II) analogues for anticancer activity Inorganica Chimica Acta, 2013, 399, 85-94
1516861	CIF	C10 H12 Ca N6 O8	P -1	7.0216; 7.6611; 14.6518 82.762; 83.74; 85.249	775.31	Barbara Barszcz; Joanna Masternak; Maciej Hodorowicz; Ewa Matczak-Jon; Agnieszka Jablonska-Wawrzycka; Katarzyna Stadnicka; Malgorzata Zienkiewicz; Karolina Krolewska; Julia Kazmierczak-Baranska Synthesis, crystal structure and NMR investigation of novel Ca(II) complexes with heterocyclic alcohol, aldehyde and carboxylate ligands. Evaluation of Ca(II) and Cd(II) analogues for anticancer activity Inorganica Chimica Acta, 2013, 399, 85-94
1516862	CIF	C9 H13 Ca N3 O7	P 21 21 21	8.682; 9.564; 16.611 90; 90; 90	1379.29	Barbara Barszcz; Joanna Masternak; Maciej Hodorowicz; Ewa Matczak-Jon; Agnieszka Jablonska-Wawrzycka; Katarzyna Stadnicka; Malgorzata Zienkiewicz; Karolina Krolewska; Julia Kazmierczak-Baranska Synthesis, crystal structure and NMR investigation of novel Ca(II) complexes with heterocyclic alcohol, aldehyde and carboxylate ligands. Evaluation of Ca(II) and Cd(II) analogues for anticancer activity Inorganica Chimica Acta, 2013, 399, 85-94
1516863	CIF	C22 H15 Cd N5 O5 S	P -1	9.412; 10.4276; 11.2794 69.936; 85.741; 85.582	1035.38	Xiu-Li Wang; Yun Qu; Guo-Cheng Liu; Jian Luan; Hong-Yan Lin Effect of organic polycarboxylates on the architectures of cadmium(II) coordination polymers based on dipyrazino[2,3-f:2'3'-h]quino-xaline: Syntheses, crystal structures, and photoluminescence properties Inorganica Chimica Acta, 2013, 399, 105-111
1516864	CIF	C20 H12 Cd N6 O4 S3	C 1 2/c 1	23.615; 12.1786; 14.595 90; 90.199; 90	4197.5	Xiu-Li Wang; Yun Qu; Guo-Cheng Liu; Jian Luan; Hong-Yan Lin Effect of organic polycarboxylates on the architectures of cadmium(II) coordination polymers based on dipyrazino[2,3-f:2'3'-h]quino-xaline: Syntheses, crystal structures, and photoluminescence properties Inorganica Chimica Acta, 2013, 399, 105-111
1516865	CIF	C36 H21 Cd2 N8 O9 S	P -1	10.1091; 11.3814; 16.0648 105.199; 107.543; 91.151	1690.8	Xiu-Li Wang; Yun Qu; Guo-Cheng Liu; Jian Luan; Hong-Yan Lin Effect of organic polycarboxylates on the architectures of cadmium(II) coordination polymers based on dipyrazino[2,3-f:2'3'-h]quino-xaline: Syntheses, crystal structures, and photoluminescence properties Inorganica Chimica Acta, 2013, 399, 105-111
1516866	CIF	C18 H12 I2 N2 O2 Pb2	P b c a	9.4814; 11.835; 17.835 90; 90; 90	2001.3	Ezzatollah Najafi; Mostafa M. Amini; Ezeddin Mohajerani; Mohammad Janghouri; Hossein Razavi; Hamidreza Khavasi Fabrication of an organic light-emitting diode (OLED) from a two-dimensional lead(II) coordination polymer Inorganica Chimica Acta, 2013, 399, 119-125
1516867	CIF	C23 H32 Co K N4 O5	P b c a	11.6732; 15.9989; 25.6674 90; 90; 90	4793.6	Ryoji Mitsuhashi; Takayoshi Suzuki; Yukinari Sunatsuki; Masaaki Kojima Hydrogen-bonding interactions, geometrical selectivity and spectroscopic properties of cobalt(III) complexes with unsymmetrical tridentate amine-amidato-phenolato type ligands Inorganica Chimica Acta, 2013, 399, 131-137
1516868	CIF	C49 H56.5 Co N5.5 O6 P	P -1	11.5973; 12.2755; 18.0998 100.372; 96.621; 112.716	2289	Ryoji Mitsuhashi; Takayoshi Suzuki; Yukinari Sunatsuki; Masaaki Kojima Hydrogen-bonding interactions, geometrical selectivity and spectroscopic properties of cobalt(III) complexes with unsymmetrical tridentate amine-amidato-phenolato type ligands Inorganica Chimica Acta, 2013, 399, 131-137
1516869	CIF	C20.5 H35 Co K N4 O9	P -1	8.8385; 11.9261; 14.2124 104.694; 110.228; 103.872	1268.2	Ryoji Mitsuhashi; Takayoshi Suzuki; Yukinari Sunatsuki; Masaaki Kojima Hydrogen-bonding interactions, geometrical selectivity and spectroscopic properties of cobalt(III) complexes with unsymmetrical tridentate amine-amidato-phenolato type ligands Inorganica Chimica Acta, 2013, 399, 131-137
1516870	CIF	C29 H44 Co K N4 O7	P -1	12.2392; 12.3153; 12.7357 112.839; 90.103; 116.275	1550.9	Ryoji Mitsuhashi; Takayoshi Suzuki; Yukinari Sunatsuki; Masaaki Kojima Hydrogen-bonding interactions, geometrical selectivity and spectroscopic properties of cobalt(III) complexes with unsymmetrical tridentate amine-amidato-phenolato type ligands Inorganica Chimica Acta, 2013, 399, 131-137
1516871	CIF	C51 H53.5 Co N4.5 O4 P	P 1 21/n 1	10.8336; 30.9997; 12.8566 90; 92.756; 90	4312.7	Ryoji Mitsuhashi; Takayoshi Suzuki; Yukinari Sunatsuki; Masaaki Kojima Hydrogen-bonding interactions, geometrical selectivity and spectroscopic properties of cobalt(III) complexes with unsymmetrical tridentate amine-amidato-phenolato type ligands Inorganica Chimica Acta, 2013, 399, 131-137
1516872	CIF	C20 H34 Co K N4 O9	P -1	7.4365; 12.8737; 13.1923 93.285; 96.038; 95.398	1247.5	Ryoji Mitsuhashi; Takayoshi Suzuki; Yukinari Sunatsuki; Masaaki Kojima Hydrogen-bonding interactions, geometrical selectivity and spectroscopic properties of cobalt(III) complexes with unsymmetrical tridentate amine-amidato-phenolato type ligands Inorganica Chimica Acta, 2013, 399, 131-137
1516873	CIF	C16 H12 Cl N2 O3 Re S	P -1	8.1877; 9.9841; 11.1123 84.575; 86.105; 70.027	849.32	Mahendra Sekhar Jana; Ajoy Kumar Pramanik; Subhankar Kundu; Deblina Sarkar; Tapan Kumar Mondal fac-Tricarbonyl rhenium(I) complexes of 2-(alkylthio)-N- ((pyridine-2-yl)methylene)benzenamine: Synthesis, spectroscopic characterization, X-ray structure and DFT calculation Inorganica Chimica Acta, 2013, 399, 138-145
1516874	CIF	C9 H21 K N2 Ni O10	P -1	7.2681; 7.9578; 15.377 86.982; 78.64; 63.532	779.93	Svetlana Belosevic; Marina Cendic; Maja Djukic; Miorad Vasojevic; Auke Meetsma; Zoran D. Matovic Crystal structure, configurational and density functional theory analysis of nickel(II) complexes with pentadentate 1,3-pd3a-type ligands Inorganica Chimica Acta, 2013, 399, 146-153
1516875	CIF	C19 H22 Cu N5 O15 Sm	P 1 21/c 1	9.1433; 28.5999; 10.3536 90; 105.629; 90	2607.34	Malay Dolai; Tarun Mistri; Anangamohan Panja; Mahammad Ali Diversity in supramolecular self-assembly through hydrogen-bonding interactions of non-coordinated aliphatic -OH group in a series of heterodinuclear CuIIM (M = NaI, ZnII, HgII, SmIII, BiIII, PbII and CdII) Inorganica Chimica Acta, 2013, 399, 95-104
1516876	CIF	C19 H22 Bi Cu N5 O15	P 1 21/c 1	8.9716; 28.4099; 10.4894 90; 105.737; 90	2573.35	Malay Dolai; Tarun Mistri; Anangamohan Panja; Mahammad Ali Diversity in supramolecular self-assembly through hydrogen-bonding interactions of non-coordinated aliphatic -OH group in a series of heterodinuclear CuIIM (M = NaI, ZnII, HgII, SmIII, BiIII, PbII and CdII) Inorganica Chimica Acta, 2013, 399, 95-104
1516877	CIF	C19 H20 Cd Cu N4 O11	P 1 21/c 1	9.194; 22.523; 14.282 90; 130.07; 90	2263.2	Malay Dolai; Tarun Mistri; Anangamohan Panja; Mahammad Ali Diversity in supramolecular self-assembly through hydrogen-bonding interactions of non-coordinated aliphatic -OH group in a series of heterodinuclear CuIIM (M = NaI, ZnII, HgII, SmIII, BiIII, PbII and CdII) Inorganica Chimica Acta, 2013, 399, 95-104
1516878	CIF	C19 H20 Cl2 Cu Hg N2 O5	P 1 21/n 1	12.1272; 13.0241; 13.6852 90; 101.187; 90	2120.5	Malay Dolai; Tarun Mistri; Anangamohan Panja; Mahammad Ali Diversity in supramolecular self-assembly through hydrogen-bonding interactions of non-coordinated aliphatic -OH group in a series of heterodinuclear CuIIM (M = NaI, ZnII, HgII, SmIII, BiIII, PbII and CdII) Inorganica Chimica Acta, 2013, 399, 95-104
1516879	CIF	C20 H24 Cu N3 Na O9	P 1 21/n 1	16.901; 7.4655; 18.388 90; 102.384; 90	2266.1	Malay Dolai; Tarun Mistri; Anangamohan Panja; Mahammad Ali Diversity in supramolecular self-assembly through hydrogen-bonding interactions of non-coordinated aliphatic -OH group in a series of heterodinuclear CuIIM (M = NaI, ZnII, HgII, SmIII, BiIII, PbII and CdII) Inorganica Chimica Acta, 2013, 399, 95-104
1516880	CIF	C19 H20 Cu N4 O11 Pb	P -1	8.6408; 11.2327; 11.8696 81.601; 84.574; 82.459	1126.5	Malay Dolai; Tarun Mistri; Anangamohan Panja; Mahammad Ali Diversity in supramolecular self-assembly through hydrogen-bonding interactions of non-coordinated aliphatic -OH group in a series of heterodinuclear CuIIM (M = NaI, ZnII, HgII, SmIII, BiIII, PbII and CdII) Inorganica Chimica Acta, 2013, 399, 95-104
1516881	CIF	C19 H22 Cu N4 O12 Zn	P -1	8.7696; 11.3057; 12.4018 111.288; 92.058; 97.833	1130.14	Malay Dolai; Tarun Mistri; Anangamohan Panja; Mahammad Ali Diversity in supramolecular self-assembly through hydrogen-bonding interactions of non-coordinated aliphatic -OH group in a series of heterodinuclear CuIIM (M = NaI, ZnII, HgII, SmIII, BiIII, PbII and CdII) Inorganica Chimica Acta, 2013, 399, 95-104
1516882	CIF	C14 H13 I O2	P b c a	7.8201; 15.7081; 21.1791 90; 90; 90	2601.6	Yang, Yanping; Cui, Mengchao; Zhang, Xiaoyang; Dai, Jiapei; Zhang, Zhiyong; Lin, Chunping; Guo, Yuzhi; Liu, Boli Radioiodinated Benzyloxybenzene Derivatives: A Class of Flexible Ligands Target to β-Amyloid Plaques in Alzheimer's Brains. Journal of medicinal chemistry, 2014, 57, 6030-6042
1516883	CIF	C14 H13 I O2	P n a 21	6.1079; 7.2239; 28.327 90; 90; 90	1249.9	Yang, Yanping; Cui, Mengchao; Zhang, Xiaoyang; Dai, Jiapei; Zhang, Zhiyong; Lin, Chunping; Guo, Yuzhi; Liu, Boli Radioiodinated Benzyloxybenzene Derivatives: A Class of Flexible Ligands Target to β-Amyloid Plaques in Alzheimer's Brains. Journal of medicinal chemistry, 2014, 57, 6030-6042
1516884	CIF	C27 H32 B Cl2 F4 N O5	P 1 21/c 1	18.1584; 8.4052; 24.416 90; 129.367; 90	2880.95	Gouin, Jérôme; Bürgi, Thomas; Guénée, Laure; Lacour, Jérôme Convergent Synthesis, Resolution, and Chiroptical Properties of Dimethoxychromenoacridinium Ions. Organic letters, 2014, 16, 3800
1516885	CIF	C29 H49 O Si2 U	P 1 21/n 1	10.84; 14.869; 19.149 90; 91.19; 90	3085.8	Tsoureas, Nikolaos; Castro, Ludovic; Kilpatrick, Alexander F. R.; Cloke, F. Geoffey N.; Maron, Laurent Controlling selectivity in the reductive activation of CO2by mixed sandwich uranium(iii) complexes Chemical Science, 2014, 5, 3777
1516886	CIF	C30 H51 O Si2 U	P 1 21/n 1	11.789; 18.961; 14.176 90; 96.89; 90	3145.9	Tsoureas, Nikolaos; Castro, Ludovic; Kilpatrick, Alexander F. R.; Cloke, F. Geoffey N.; Maron, Laurent Controlling selectivity in the reductive activation of CO2by mixed sandwich uranium(iii) complexes Chemical Science, 2014, 5, 3777
1516887	CIF	C31 H53 O Si2 U	P 1 21/n 1	12.092; 19.621; 13.755 90; 96.3; 90	3243.8	Tsoureas, Nikolaos; Castro, Ludovic; Kilpatrick, Alexander F. R.; Cloke, F. Geoffey N.; Maron, Laurent Controlling selectivity in the reductive activation of CO2by mixed sandwich uranium(iii) complexes Chemical Science, 2014, 5, 3777
1516888	CIF	C48 H76.5 O Si4 U2	P 1 21/n 1	22.913; 13.686; 38.185 90; 107.06; 90	11447	Tsoureas, Nikolaos; Castro, Ludovic; Kilpatrick, Alexander F. R.; Cloke, F. Geoffey N.; Maron, Laurent Controlling selectivity in the reductive activation of CO2by mixed sandwich uranium(iii) complexes Chemical Science, 2014, 5, 3777
1516889	CIF	C50 H78 O4 Si4 U2	P b c a	10.48; 21.616; 23.669 90; 90; 90	5361.9	Tsoureas, Nikolaos; Castro, Ludovic; Kilpatrick, Alexander F. R.; Cloke, F. Geoffey N.; Maron, Laurent Controlling selectivity in the reductive activation of CO2by mixed sandwich uranium(iii) complexes Chemical Science, 2014, 5, 3777
1516890	CIF	C54 H86 O4 Si4 U2	C m c a	21.741; 23.447; 10.829 90; 90; 90	5520.2	Tsoureas, Nikolaos; Castro, Ludovic; Kilpatrick, Alexander F. R.; Cloke, F. Geoffey N.; Maron, Laurent Controlling selectivity in the reductive activation of CO2by mixed sandwich uranium(iii) complexes Chemical Science, 2014, 5, 3777
1516891	CIF	C27 H43 O2 Si2 U	P 1 21/n 1	12.917; 13.555; 16.582 90; 100.86; 90	2851.3	Tsoureas, Nikolaos; Castro, Ludovic; Kilpatrick, Alexander F. R.; Cloke, F. Geoffey N.; Maron, Laurent Controlling selectivity in the reductive activation of CO2by mixed sandwich uranium(iii) complexes Chemical Science, 2014, 5, 3777
1516892	CIF	C53 H86 O3 Si4 U2	P n m a	23.33; 21.46; 10.71 90; 90; 90	5362.1	Tsoureas, Nikolaos; Castro, Ludovic; Kilpatrick, Alexander F. R.; Cloke, F. Geoffey N.; Maron, Laurent Controlling selectivity in the reductive activation of CO2by mixed sandwich uranium(iii) complexes Chemical Science, 2014, 5, 3777
1516893	CIF	C58 H86 O3 Si4 U2	P c a 21	43.8503; 10.3313; 24.2758 90; 90; 90	10997.7	Tsoureas, Nikolaos; Castro, Ludovic; Kilpatrick, Alexander F. R.; Cloke, F. Geoffey N.; Maron, Laurent Controlling selectivity in the reductive activation of CO2 by mixed sandwich uranium(iii) complexes Chemical Science, 2014, 5, 3777
1516894	CIF	C55 H90 O3 Si4 U2	P 1 21/c 1	11.737; 18.983; 25.761 90; 95.43; 90	5713.9	Tsoureas, Nikolaos; Castro, Ludovic; Kilpatrick, Alexander F. R.; Cloke, F. Geoffey N.; Maron, Laurent Controlling selectivity in the reductive activation of CO2by mixed sandwich uranium(iii) complexes Chemical Science, 2014, 5, 3777
1516895	CIF	C15 H10 N4 O7 Zn2	P -1	8.495; 9.3854; 11.552 81.95; 76.99; 69.9	840.8	Da Li; Jiayin Sun; Li Wang; Liying Zhang; Xiaohui Liu; Jianing Xu; Ping Zhang Two new three-dimensional metal-organic frameworks constructed from a semirigid V-shaped ligand with luminescent and topology studies Inorganica Chimica Acta, 2013, 399, 154-159
1516896	CIF	C30 H16 Cd2 N8 O10	P -1	11.888; 12.916; 13.009 93.94; 112.07; 110.34	1689.4	Da Li; Jiayin Sun; Li Wang; Liying Zhang; Xiaohui Liu; Jianing Xu; Ping Zhang Two new three-dimensional metal-organic frameworks constructed from a semirigid V-shaped ligand with luminescent and topology studies Inorganica Chimica Acta, 2013, 399, 154-159
1516897	CIF	C19 H22 Cl2 Cu N4 O5	P -1	12.406; 15.4849; 23.3147 72.584; 89.659; 85.182	4257.59	Salah S. Massoud; Richard S. Perkins; Kathleen D. Knierim; Sean P. Comiskey; Kara H. Otero; Corey L. Michel; Wesley M. Juneau; Jorg H. Albering; Franz A. Mautner; Wu Xu Effect of the chelate ring size on the cleavage activity of DNA by copper(II) complexes containing pyridyl groups Inorganica Chimica Acta, 2013, 399, 177-184
1516898	CIF	C19 H22 Cl3 Fe N O Pt S	P 1 21/a 1	9.3079; 26.2435; 9.7687 90; 116.795; 90	2130	Karlheinz Sunkel; Ramona Branzan; Stefan Weigand 2-Pyridylmetallocenes, part IV. Cycloplatination of 2-pyridyl-ferrocene, -ruthenocene and -cymantrene. Molecular structures of sigma-Pt{CpM[C5H3(2-C5H4N)]}Cl (DMSO) (M = Fe, Ru) and sigma-Pt{CpFe[C5H3(2-C5H4N)]}(acac) Inorganica Chimica Acta, 2013, 399, 193-199
1516899	CIF	C17 H18 Cl Fe N O Pt S	C 1 2/c 1	9.6637; 27.927; 12.8174 90; 96.645; 90	3435.9	Karlheinz Sunkel; Ramona Branzan; Stefan Weigand 2-Pyridylmetallocenes, part IV. Cycloplatination of 2-pyridyl-ferrocene, -ruthenocene and -cymantrene. Molecular structures of sigma-Pt{CpM[C5H3(2-C5H4N)]}Cl (DMSO) (M = Fe, Ru) and sigma-Pt{CpFe[C5H3(2-C5H4N)]}(acac) Inorganica Chimica Acta, 2013, 399, 193-199
1516900	CIF	C18 H19 Cl4 N O Pt Ru S	P -1	9.8621; 10.4803; 11.1942 100.706; 96.331; 97.819	1115.33	Karlheinz Sunkel; Ramona Branzan; Stefan Weigand 2-Pyridylmetallocenes, part IV. Cycloplatination of 2-pyridyl-ferrocene, -ruthenocene and -cymantrene. Molecular structures of sigma-Pt{CpM[C5H3(2-C5H4N)]}Cl (DMSO) (M = Fe, Ru) and sigma-Pt{CpFe[C5H3(2-C5H4N)]}(acac) Inorganica Chimica Acta, 2013, 399, 193-199
1516901	CIF	C20 H19 Fe N O2 Pt	C 1 2/c 1	16.208; 12.3572; 17.5616 90; 91.026; 90	3516.77	Karlheinz Sunkel; Ramona Branzan; Stefan Weigand 2-Pyridylmetallocenes, part IV. Cycloplatination of 2-pyridyl-ferrocene, -ruthenocene and -cymantrene. Molecular structures of sigma-Pt{CpM[C5H3(2-C5H4N)]}Cl (DMSO) (M = Fe, Ru) and sigma-Pt{CpFe[C5H3(2-C5H4N)]}(acac) Inorganica Chimica Acta, 2013, 399, 193-199
1516902	CIF	C22 H48 Cl2 N8 Ni2 O11	C 1 2/c 1	9.566; 11.359; 29.676 90; 91.219; 90	3223.9	Rajat Saha; Susobhan Biswas; Ian M. Steele; Kamalendu Dey; Atish Dipankar Jana; Sanjay Kumar Stabilization of 2D water sheets in a supramolecular metal-organic Schiff base complex: Reversible structural transformation upon dehydration-rehydration Inorganica Chimica Acta, 2013, 399, 200-207
1516903	CIF	C6 H8 N Na Ni O7	P 21 21 21	7.8518; 9.7379; 12.171 90; 90; 90	930.6	Jing Jin; Yu Ding; Yuan-Yuan Gong; Sheng-Mei Cong; Yu-Xian Chi; Guang-Ning Zhang; Shu-Yun Niu Synthesis, structure and surface photo-electric property of Ni(II) complexes Inorganica Chimica Acta, 2013, 399, 227-235
1516904	CIF	C22 H30 N6 Ni O9	C 1 2/c 1	22.317; 12.2177; 9.058 90; 108.766; 90	2338.5	Jing Jin; Yu Ding; Yuan-Yuan Gong; Sheng-Mei Cong; Yu-Xian Chi; Guang-Ning Zhang; Shu-Yun Niu Synthesis, structure and surface photo-electric property of Ni(II) complexes Inorganica Chimica Acta, 2013, 399, 227-235
1516905	CIF	C16 H26 N4 Ni O8	P b c a	8.884; 12.611; 15.885 90; 90; 90	1779.7	Jing Jin; Yu Ding; Yuan-Yuan Gong; Sheng-Mei Cong; Yu-Xian Chi; Guang-Ning Zhang; Shu-Yun Niu Synthesis, structure and surface photo-electric property of Ni(II) complexes Inorganica Chimica Acta, 2013, 399, 227-235
1516906	CIF	C12 H9 Br2 O4 P	P 1 c 1	11.7769; 4.7093; 13.1053 90; 109.462; 90	685.3	Payal Malik; Debashis Chakraborty Hydrogen phosphates: Self initiated organocatalysts for the controlled ring-opening polymerization of cyclic esters Inorganica Chimica Acta, 2013, 400, 32-41
1516907	CIF	C12 H9 Cl2 O4 P	P c c n	22.0545; 4.6788; 12.8346 90; 90; 90	1324.38	Payal Malik; Debashis Chakraborty Hydrogen phosphates: Self initiated organocatalysts for the controlled ring-opening polymerization of cyclic esters Inorganica Chimica Acta, 2013, 400, 32-41
1516908	CIF	C26 H24 N6 O11 Pd	P -1	13.877; 15.793; 17.406 83.599; 73.146; 71.742	3466.1	Himansu Sekhar Sahoo; Debakanta Tripathy; Sabyasachi Chakrabortty; Satish Bhat; Avinash Kumbhar; Dillip Kumar Chand Self-assembled mononuclear palladium(II) based molecular loopsOriginal Inorganica Chimica Acta, 2013, 400, 42-50
1516909	CIF	C18 H28 N6 O13 Pd	P -1	9.8586; 10.2379; 13.2723 93.338; 99.68; 102.739	1281.67	Himansu Sekhar Sahoo; Debakanta Tripathy; Sabyasachi Chakrabortty; Satish Bhat; Avinash Kumbhar; Dillip Kumar Chand Self-assembled mononuclear palladium(II) based molecular loopsOriginal Inorganica Chimica Acta, 2013, 400, 42-50
1516910	CIF	C36 H44 N6 O20 Pd	P -1	9.918; 9.982; 14.23 101.06; 107.24; 93.23	1310.8	Himansu Sekhar Sahoo; Debakanta Tripathy; Sabyasachi Chakrabortty; Satish Bhat; Avinash Kumbhar; Dillip Kumar Chand Self-assembled mononuclear palladium(II) based molecular loopsOriginal Inorganica Chimica Acta, 2013, 400, 42-50
1516911	CIF	C108 H146 Mo16 N12 O79	P 1 21/c 1	19.9057; 11.0481; 24.3389 90; 127.481; 90	4247.6	Jiao Guo; Jin Yang; Ying-Ying Liu; Jian-Fang Ma Two new polyoxometalate-templated supramolecular compounds constructed by a new tridentate ligand 2,4,6-tris[1-(4-oxidroxypyridinium)-ylmethyl]-mesitylene Inorganica Chimica Acta, 2013, 400, 51-58
1516912	CIF	C54 H70 N6 O52 Si W12	P 1 21/c 1	13.756; 23.821; 12.814 90; 111.482; 90	3907	Jiao Guo; Jin Yang; Ying-Ying Liu; Jian-Fang Ma Two new polyoxometalate-templated supramolecular compounds constructed by a new tridentate ligand 2,4,6-tris[1-(4-oxidroxypyridinium)-ylmethyl]-mesitylene Inorganica Chimica Acta, 2013, 400, 51-58
1516913	CIF	C30 H30 Mo24 N6 O82.96 P2	I a -3	25.8063; 25.8063; 25.8063 90; 90; 90	17186.1	Mingli Qi; Kai Yu; Zhanhua Su; Chunxiao Wang; Chunmei Wang; Baibin Zhou; Chuncheng Zhu Assembly of four new supramolecular compounds based on Keggin phosphomolybdate and different organocations Inorganica Chimica Acta, 2013, 400, 59-66
1516914	CIF	C18 H27 Mo12 N8 O40 P	P -1	12.8887; 13.2162; 14.316 83.515; 80.831; 88.674	2392	Mingli Qi; Kai Yu; Zhanhua Su; Chunxiao Wang; Chunmei Wang; Baibin Zhou; Chuncheng Zhu Assembly of four new supramolecular compounds based on Keggin phosphomolybdate and different organocations Inorganica Chimica Acta, 2013, 400, 59-66
1516915	CIF	C14 H21 Mo12 N6 O40 P	P -1	11.836; 12.033; 17.285 72.67; 74.861; 70.914	2183.9	Mingli Qi; Kai Yu; Zhanhua Su; Chunxiao Wang; Chunmei Wang; Baibin Zhou; Chuncheng Zhu Assembly of four new supramolecular compounds based on Keggin phosphomolybdate and different organocations Inorganica Chimica Acta, 2013, 400, 59-66
1516916	CIF	C15 H23 Mo12 N6 O40 P	P -1	11.8442; 12.1069; 17.7816 74.081; 70.931; 71.804	2246.9	Mingli Qi; Kai Yu; Zhanhua Su; Chunxiao Wang; Chunmei Wang; Baibin Zhou; Chuncheng Zhu Assembly of four new supramolecular compounds based on Keggin phosphomolybdate and different organocations Inorganica Chimica Acta, 2013, 400, 59-66
1516917	CIF	C12 H19 N3 Nd2 O14	I 41/a :2	26.2339; 26.2339; 12.0733 90; 90; 90	8309.1	Limin Zhang; Naiqian Yu; Kaihong Zhang; Ruishuo Qiu; Yixuan Zhao; Wencong Rong; Hong Deng Syntheses, structure, and properties of a series of three-dimensional lanthanide-based hybrid frameworks Inorganica Chimica Acta, 2013, 400, 67-73
1516918	CIF	C12 H19 Eu2 N3 O14	I 41/a :2	26.019; 26.019; 12.0188 90; 90; 90	8136.6	Limin Zhang; Naiqian Yu; Kaihong Zhang; Ruishuo Qiu; Yixuan Zhao; Wencong Rong; Hong Deng Syntheses, structure, and properties of a series of three-dimensional lanthanide-based hybrid frameworks Inorganica Chimica Acta, 2013, 400, 67-73
1516919	CIF	C12 H19 N3 O14 Tb2	I 41/a :2	25.824; 25.824; 11.966 90; 90; 90	7980	Limin Zhang; Naiqian Yu; Kaihong Zhang; Ruishuo Qiu; Yixuan Zhao; Wencong Rong; Hong Deng Syntheses, structure, and properties of a series of three-dimensional lanthanide-based hybrid frameworks Inorganica Chimica Acta, 2013, 400, 67-73
1516920	CIF	C12 H19 Dy2 N3 O14	I 41/a :2	25.803; 25.803; 11.9679 90; 90; 90	7968.2	Limin Zhang; Naiqian Yu; Kaihong Zhang; Ruishuo Qiu; Yixuan Zhao; Wencong Rong; Hong Deng Syntheses, structure, and properties of a series of three-dimensional lanthanide-based hybrid frameworks Inorganica Chimica Acta, 2013, 400, 67-73
1516921	CIF	C28 H25 Cd N2 O9	C 1 2/c 1	26.164; 9.233; 23.666 90; 108.41; 90	5424.5	Jun Chen; Guo-Ping Yang; Wen-Huan Huang; Ling-Yan Pang; Cui-Ping Zhang; Yao-Yu Wang; Qi-Zhen Shi The nature of the metal ions influenced formation of coordination polymers based on asymmetric semi-rigid 3-(4-carboxyphenoxy)phthalic acid with N-heterocyclic ligands Inorganica Chimica Acta, 2013, 400, 7-12
1516922	CIF	C28 H26 Co N2 O9	P -1	10.9809; 11.7784; 12.1259 63.892; 83.12; 77.689	1375.3	Jun Chen; Guo-Ping Yang; Wen-Huan Huang; Ling-Yan Pang; Cui-Ping Zhang; Yao-Yu Wang; Qi-Zhen Shi The nature of the metal ions influenced formation of coordination polymers based on asymmetric semi-rigid 3-(4-carboxyphenoxy)phthalic acid with N-heterocyclic ligands Inorganica Chimica Acta, 2013, 400, 7-12
1516923	CIF	C41 H35 Ag2 N4 O7	P 1 21/n 1	16.9556; 9.0102; 24.685 90; 106.846; 90	3609.4	Jun Chen; Guo-Ping Yang; Wen-Huan Huang; Ling-Yan Pang; Cui-Ping Zhang; Yao-Yu Wang; Qi-Zhen Shi The nature of the metal ions influenced formation of coordination polymers based on asymmetric semi-rigid 3-(4-carboxyphenoxy)phthalic acid with N-heterocyclic ligands Inorganica Chimica Acta, 2013, 400, 7-12
1516924	CIF	C28 H34 Cl2 N2 Ru	P -1	7.3631; 13.5745; 13.7274 87.4473; 74.6508; 86.9204	1320.55	Deniz Mercan; Engin Cetinkaya; Ertan Sahin Ru(II)-arene complexes with N-substituted 3,4-dihydroquinazoline ligands and catalytic activity for transfer hydrogenation reaction Inorganica Chimica Acta, 2013, 400, 74-81
1516925	CIF	C19 H22 N	P -1	8.136; 8.54; 11.79 86.97; 80.99; 79.16	794	Jianchao Yuan; Fengying Song; Jing Li; Zong Jia; Fuzhou Wang; Bingnian Yuan Chiral {bis[N,N'-(2-ethyl-6-methylphenyl)imino]-1,2-dimethylethane} dibromonickel bearing sec-phenethyl groups: Synthesis, characterization and application in synthesis of nanosized dendritic polyethylene Inorganica Chimica Acta, 2013, 400, 99-106
1516926	CIF	C38 H44 Br2 N2 Ni	P 1 21/n 1	12.214; 25.21; 12.436 90; 106.149; 90	3678	Jianchao Yuan; Fengying Song; Jing Li; Zong Jia; Fuzhou Wang; Bingnian Yuan Chiral {bis[N,N'-(2-ethyl-6-methylphenyl)imino]-1,2-dimethylethane} dibromonickel bearing sec-phenethyl groups: Synthesis, characterization and application in synthesis of nanosized dendritic polyethylene Inorganica Chimica Acta, 2013, 400, 99-106
1516927	CIF	C28 H32 F6 Fe N3 O4 P V	P -1	10.437; 13.099; 13.77 71.356; 69.014; 67.803	1590	Babu Balaji; Kumar Somyajit; Bhabatosh Banik; Ganesh Nagaraju; Akhil R. Chakravarty Photoactivated DNA cleavage and anticancer activity of oxovanadium(IV) complexes of curcumin Inorganica Chimica Acta, 2013, 400, 142-150
1516928	CIF	C41 H59 B N4 Ni2 O7	P 1 21/c 1	15.7424; 12.1464; 23.968 90; 107.058; 90	4381.4	Katsura Mochizuki; Junpei Takahashi; Yukiko Ishima; Tomomi Shindo Synthesis and structures of urea-coordinated dinickel(II) complexes with binucleating ligand 1,3-bis(N-(2-(dimethylamino)ethyl)-N-methylamino)propan-2-ol (HL1) and its a nalogs Inorganica Chimica Acta, 2013, 400, 151-158
1516929	CIF	C46 H73 B N6 Ni2 O8	P 1 21/n 1	17.591; 17.449; 17.256 90; 104.69; 90	5124	Katsura Mochizuki; Junpei Takahashi; Yukiko Ishima; Tomomi Shindo Synthesis and structures of urea-coordinated dinickel(II) complexes with binucleating ligand 1,3-bis(N-(2-(dimethylamino)ethyl)-N-methylamino)propan-2-ol (HL1) and its a nalogs Inorganica Chimica Acta, 2013, 400, 151-158
1516930	CIF	C40 H60 B Cl2 N7 Ni2 O3	P 1 21/c 1	18.23; 15.284; 16.364 90; 101.445; 90	4468.8	Katsura Mochizuki; Junpei Takahashi; Yukiko Ishima; Tomomi Shindo Synthesis and structures of urea-coordinated dinickel(II) complexes with binucleating ligand 1,3-bis(N-(2-(dimethylamino)ethyl)-N-methylamino)propan-2-ol (HL1) and its a nalogs Inorganica Chimica Acta, 2013, 400, 151-158
1516931	CIF	C45 H62 B N3 Ni2 O9	P -1	11.618; 14; 14.87 76.444; 84.969; 86.123	2339	Katsura Mochizuki; Junpei Takahashi; Yukiko Ishima; Tomomi Shindo Synthesis and structures of urea-coordinated dinickel(II) complexes with binucleating ligand 1,3-bis(N-(2-(dimethylamino)ethyl)-N-methylamino)propan-2-ol (HL1) and its a nalogs Inorganica Chimica Acta, 2013, 400, 151-158
1516932	CIF	C64 H83 B2 Cl N4 Ni2 O9	P -1	11.765; 14.412; 18.546 95.475; 91.001; 93.904	3122.1	Katsura Mochizuki; Junpei Takahashi; Yukiko Ishima; Tomomi Shindo Synthesis and structures of urea-coordinated dinickel(II) complexes with binucleating ligand 1,3-bis(N-(2-(dimethylamino)ethyl)-N-methylamino)propan-2-ol (HL1) and its a nalogs Inorganica Chimica Acta, 2013, 400, 151-158
1516933	CIF	C44 H64 B N3 Ni2 O8	P 1 21/c 1	14.169; 18.064; 18.342 90; 98.824; 90	4639	Katsura Mochizuki; Junpei Takahashi; Yukiko Ishima; Tomomi Shindo Synthesis and structures of urea-coordinated dinickel(II) complexes with binucleating ligand 1,3-bis(N-(2-(dimethylamino)ethyl)-N-methylamino)propan-2-ol (HL1) and its a nalogs Inorganica Chimica Acta, 2013, 400, 151-158
1516934	CIF	C43 H62 B N5 Ni2 O8	P 1 21/c 1	11.254; 15.027; 27.273 90; 91.374; 90	4611	Katsura Mochizuki; Junpei Takahashi; Yukiko Ishima; Tomomi Shindo Synthesis and structures of urea-coordinated dinickel(II) complexes with binucleating ligand 1,3-bis(N-(2-(dimethylamino)ethyl)-N-methylamino)propan-2-ol (HL1) and its a nalogs Inorganica Chimica Acta, 2013, 400, 151-158
1516935	CIF	C22 H35 Cl2 N O3 Sn	C 1 2/c 1	47.1867; 10.1593; 25.3842 90; 120.001; 90	10538.4	Farooq Ali Shah; Muhammad Sirajuddin; Saqib Ali; Syed Mustansar Abbas; Muhammad Nawaz Tahir; Corrado Rizzoli Synthesis, spectroscopic characterization, X-ray structure and biological screenings of organotin(IV) 3-[(3,5-dichlorophenylamido)]propanoates Inorganica Chimica Acta, 2013, 400, 159-162
1516936	CIF	C28 H23 Cl2 N O3 Sn	P 1 21/c 1	10.361; 27.083; 9.692 90; 97.902; 90	2693.8	Farooq Ali Shah; Muhammad Sirajuddin; Saqib Ali; Syed Mustansar Abbas; Muhammad Nawaz Tahir; Corrado Rizzoli Synthesis, spectroscopic characterization, X-ray structure and biological screenings of organotin(IV) 3-[(3,5-dichlorophenylamido)]propanoates Inorganica Chimica Acta, 2013, 400, 159-162
1516937	CIF	C15 H14 N3 O5 Zn	C 1 2/c 1	28.218; 10.8849; 10.7915 90; 106.817; 90	3172.9	Wang, Yan; Liu, Zhiqing; Zhou, Juhong; Wang, Tao; Wang, Suna; Liu, Guangxiang; Wang, Xiaoxiao; Gao, Ya; Xu, Jing A series of transition coordination polymers assembled by asymmetric dicarboxylic acid and flexible bridging ligand: Structural diversities, topologies and properties Inorganica Chimica Acta, 2013, 400, 169-178
1516938	CIF	C24 H20 Cd2 N3 O9	P -1	7.5872; 12.2872; 15.3589 68.173; 86.445; 72.809	1268	Wang, Yan; Liu, Zhiqing; Zhou, Juhong; Wang, Tao; Wang, Suna; Liu, Guangxiang; Wang, Xiaoxiao; Gao, Ya; Xu, Jing A series of transition coordination polymers assembled by asymmetric dicarboxylic acid and flexible bridging ligand: Structural diversities, topologies and properties Inorganica Chimica Acta, 2013, 400, 169-178
1516939	CIF	C15 H18 Co N3 O7	P -1	8.354; 9.9055; 11.9259 91.392; 104.428; 114.077	863.7	Wang, Yan; Liu, Zhiqing; Zhou, Juhong; Wang, Tao; Wang, Suna; Liu, Guangxiang; Wang, Xiaoxiao; Gao, Ya; Xu, Jing A series of transition coordination polymers assembled by asymmetric dicarboxylic acid and flexible bridging ligand: Structural diversities, topologies and properties Inorganica Chimica Acta, 2013, 400, 169-178
1516940	CIF	C21 H24 N6 Ni O7	P 1 21/c 1	11.47; 13.33; 19.23 90; 122.3; 90	2485	Wang, Yan; Liu, Zhiqing; Zhou, Juhong; Wang, Tao; Wang, Suna; Liu, Guangxiang; Wang, Xiaoxiao; Gao, Ya; Xu, Jing A series of transition coordination polymers assembled by asymmetric dicarboxylic acid and flexible bridging ligand: Structural diversities, topologies and properties Inorganica Chimica Acta, 2013, 400, 169-178
1516941	CIF	C113 H116 Cu9 N28 O21	P c a 21	33.552; 11.631; 30.295 90; 90; 90	11822	Dongcheng Liu; Zilu Chen; Wanyun Huang; Suni Qin; Liping Jiang; Suping Zhou; Fupei Liang Metal clusters constructed by dihydrazide ligand: Synthesis, structure and magnetic properties Inorganica Chimica Acta, 2013, 400, 179-183
1516942	CIF	C92 H76 Co5 N20 O12	P 1 21/c 1	18.2086; 16.0597; 19.708 90; 94.204; 90	5747.6	Dongcheng Liu; Zilu Chen; Wanyun Huang; Suni Qin; Liping Jiang; Suping Zhou; Fupei Liang Metal clusters constructed by dihydrazide ligand: Synthesis, structure and magnetic properties Inorganica Chimica Acta, 2013, 400, 179-183
1516943	CIF	C42 H47 Cu4 N5 O12	P -1	11.9186; 12.2974; 15.2404 102.571; 92.372; 99.842	2140.9	Zhengliang Lu; Tao Fan; Weiwei Guo; Jing Lu; Chunhua Fan Synthesis, structure and magnetism of three cubane Cu(II) and Ni(II) complexes based on flexible Schiff-base ligands Inorganica Chimica Acta, 2013, 400, 191-196
1516944	CIF	C44 H68 N4 Ni4 O20	P -1	14.106; 15.0618; 16.6812 69.543; 73.547; 72.281	3100.4	Zhengliang Lu; Tao Fan; Weiwei Guo; Jing Lu; Chunhua Fan Synthesis, structure and magnetism of three cubane Cu(II) and Ni(II) complexes based on flexible Schiff-base ligands Inorganica Chimica Acta, 2013, 400, 191-196
1516945	CIF	C48 H80 N4 Ni4 O22	P -1	14.9988; 15.1184; 17.0828 68.287; 66.409; 70.254	3215.1	Zhengliang Lu; Tao Fan; Weiwei Guo; Jing Lu; Chunhua Fan Synthesis, structure and magnetism of three cubane Cu(II) and Ni(II) complexes based on flexible Schiff-base ligands Inorganica Chimica Acta, 2013, 400, 191-196
1516946	CIF	C19 H17.5 Cl2 N2.5 Pd	P -1	8.0349; 13.5623; 17.5006 86.712; 77.043; 80.322	1831.68	William M. Motswainyana; Martin O. Onani; Abram M. Madiehe; Morounke Saibu; Jeroen Jacobs; Luc van Meervelt Imino-quinolyl palladium(II) and platinum(II) complexes: Synthesis, characterization, molecular structures and cytotoxic effect Inorganica Chimica Acta, 2013, 400, 197-202
1516947	CIF	C22 H24 Cl2 N2 Pd	P 1 21/c 1	11.4731; 13.0007; 14.8263 90; 106.356; 90	2122	William M. Motswainyana; Martin O. Onani; Abram M. Madiehe; Morounke Saibu; Jeroen Jacobs; Luc van Meervelt Imino-quinolyl palladium(II) and platinum(II) complexes: Synthesis, characterization, molecular structures and cytotoxic effect Inorganica Chimica Acta, 2013, 400, 197-202
1516948	CIF	C78 H100 Mo8 N12 O32	P 1 21/c 1	18.9946; 14.1611; 19.0729 90; 112.113; 90	4752.9	Jia Gu; Xuee Jiang; Zhanhua Su; Zhifeng Zhao; Baibin Zhou Self-assembly of gamma-octamolybdate-based frameworks decorated by 1,3-bis(4-pyridyl)propane through covalent bond Inorganica Chimica Acta, 2013, 400, 210-214
1516949	CIF	C39 H46 Mo8 N6 O26	P 1 21/n 1	10.6712; 21.4989; 22.9381 90; 96.812; 90	5225.3	Jia Gu; Xuee Jiang; Zhanhua Su; Zhifeng Zhao; Baibin Zhou Self-assembly of gamma-octamolybdate-based frameworks decorated by 1,3-bis(4-pyridyl)propane through covalent bond Inorganica Chimica Acta, 2013, 400, 210-214
1516950	CIF	C68 H56 N2 O8 P2 S4 Sn2	P -1	9.1471; 13.362; 14.7072 75.808; 78.661; 87.864	1708.6	Radu F. Semeniuc; Robert R. Baum; Jedidiah J. Veach; Kraig A. Wheeler; Perry J. Pellechia Metal complexes of ditopic dithiophosphonate ligands built on a naphthalenediimide core Inorganica Chimica Acta, 2013, 400, 228-238
1516951	CIF	C106 H90 Cl4 Cu2 N2 O8 P6 S4	P -1	9.2045; 11.541; 23.4034 85.15; 89.605; 75.421	2397.19	Radu F. Semeniuc; Robert R. Baum; Jedidiah J. Veach; Kraig A. Wheeler; Perry J. Pellechia Metal complexes of ditopic dithiophosphonate ligands built on a naphthalenediimide core Inorganica Chimica Acta, 2013, 400, 228-238
1516952	CIF	C72 H64 N2 O10 P2 S4 Sn2	P 1 c 1	13.7321; 10.5102; 23.2601 90; 97.74; 90	3326.48	Radu F. Semeniuc; Robert R. Baum; Jedidiah J. Veach; Kraig A. Wheeler; Perry J. Pellechia Metal complexes of ditopic dithiophosphonate ligands built on a naphthalenediimide core Inorganica Chimica Acta, 2013, 400, 228-238
1516953	CIF	C90 H76 Cl4 N4 O16 P4 S8 Sn2	P -1	10.9684; 12.3642; 17.6112 87.54; 88.133; 71.074	2256.71	Radu F. Semeniuc; Robert R. Baum; Jedidiah J. Veach; Kraig A. Wheeler; Perry J. Pellechia Metal complexes of ditopic dithiophosphonate ligands built on a naphthalenediimide core Inorganica Chimica Acta, 2013, 400, 228-238
1516954	CIF	C50 H48 Cl4 N2 O10 P2 S4 Sn	P -1	12.3562; 13.0479; 18.2453 91.405; 105.836; 105.259	2715.4	Radu F. Semeniuc; Robert R. Baum; Jedidiah J. Veach; Kraig A. Wheeler; Perry J. Pellechia Metal complexes of ditopic dithiophosphonate ligands built on a naphthalenediimide core Inorganica Chimica Acta, 2013, 400, 228-238
1516955	CIF	C9 H10 N3 O9 Sm	P -1	8.148; 9.37; 10.179 66.618; 73.234; 83.832	683	Zhao-Hao Li; Dong-Feng Hong; Li-Ping Xue; Wei-Jun Fu; Bang-Tun Zhao Two lanthanide-bound 1H-benzotriazole polymers: New potential metal-organic scaffold for solid-phase organic chemistry Inorganica Chimica Acta, 2013, 400, 239-242
1516956	CIF	C9 H10 Ho N3 O9	P -1	8.018; 9.348; 10.09 66.76; 72.957; 83.524	664.4	Zhao-Hao Li; Dong-Feng Hong; Li-Ping Xue; Wei-Jun Fu; Bang-Tun Zhao Two lanthanide-bound 1H-benzotriazole polymers: New potential metal-organic scaffold for solid-phase organic chemistry Inorganica Chimica Acta, 2013, 400, 239-242
1516957	CIF	C41 H51 B Fe N10	P 1 21/c 1	12.5378; 11.7168; 25.9454 90; 95.1122; 90	3796.3	Keishiro Murakami; Aki Kitabayashi; Suguru Yamauchi; Koshiro Nishi; Takeshi Fujinami; Naohide Matsumoto; Seiichiro Iijima; Masaaki Kojima Iron(II) complexes with a linear pentadentate ligand H2L1 = bis(N,N'-2-methylimidazol-4-yl-methylideneaminopropyl)methylamine and a monodentate ligand X (X = N3-, NCS-, NCSe-) Inorganica Chimica Acta, 2013, 400, 244-249
1516958	CIF	C42 H47 B Fe N8 S	P 1 21/c 1	15.543; 12.577; 22.012 90; 108.803; 90	4073	Keishiro Murakami; Aki Kitabayashi; Suguru Yamauchi; Koshiro Nishi; Takeshi Fujinami; Naohide Matsumoto; Seiichiro Iijima; Masaaki Kojima Iron(II) complexes with a linear pentadentate ligand H2L1 = bis(N,N'-2-methylimidazol-4-yl-methylideneaminopropyl)methylamine and a monodentate ligand X (X = N3-, NCS-, NCSe-) Inorganica Chimica Acta, 2013, 400, 244-249
1516959	CIF	C42 H47 B Fe N8 Se	P 1 21/c 1	15.558; 12.6513; 22.0709 90; 108.432; 90	4121.3	Keishiro Murakami; Aki Kitabayashi; Suguru Yamauchi; Koshiro Nishi; Takeshi Fujinami; Naohide Matsumoto; Seiichiro Iijima; Masaaki Kojima Iron(II) complexes with a linear pentadentate ligand H2L1 = bis(N,N'-2-methylimidazol-4-yl-methylideneaminopropyl)methylamine and a monodentate ligand X (X = N3-, NCS-, NCSe-) Inorganica Chimica Acta, 2013, 400, 244-249
1516960	CIF	C39 H34 Cl2 N2 O2 Pd	P 21 21 2	14.654; 11.152; 10.05 90; 90; 90	1642.4	Takashi Tsuno; Haruka Iwabe; Henri Brunner Synthesis and structural characterization of isomeric palladium(II) complexes with chiral N,O-bidentate ligands Inorganica Chimica Acta, 2013, 400, 262-266
1516961	CIF	C38 H32 N2 O2 Pd	P 1	6.683; 15.639; 15.685 88.127; 84.123; 79.058	1600.9	Takashi Tsuno; Haruka Iwabe; Henri Brunner Synthesis and structural characterization of isomeric palladium(II) complexes with chiral N,O-bidentate ligands Inorganica Chimica Acta, 2013, 400, 262-266
1516962	CIF	C11 H19 N Ni O8	P c a 21	11.3509; 16.7012; 7.4757 90; 90; 90	1417.2	Smrečki, Neven; Kukovec, Boris-Marko; Đaković, Marijana; Popović, Zora Nickel(II) complexes with N‒aralkyliminodiacetic acids: preparation, spectroscopic, structural and thermal characterization Inorganica Chimica Acta, 2013, 400, 122-129
1516963	CIF	C13 H21 N Ni O7	P 1 21/c 1	18.1964; 7.754; 11.2469 90; 102.004; 90	1552.18	Smrečki, Neven; Kukovec, Boris-Marko; Đaković, Marijana; Popović, Zora Nickel(II) complexes with N‒aralkyliminodiacetic acids: preparation, spectroscopic, structural and thermal characterization Inorganica Chimica Acta, 2013, 400, 122-129
1516964	CIF	Eu2 Mo3 O12	C 1 2/c 1	7.55755; 11.47093; 11.51584 90; 109.278; 90	942.36	Atuchin, V. V.; Aleksandrovsky, A. S.; Chimitova, O. D.; Gavrilova, T. A.; Krylov, A. S.; Molokeev, M. S.; Oreshonkov, A. S.; Bazarov, B. G.; Bazarova, J. G. Synthesis and Spectroscopic Properties of Monoclinic α-Eu2(MoO4)3 The Journal of Physical Chemistry C, 2014, 118, 15404
1516965	CIF	C27 H21 N2	P 1 21/n 1	9.5166; 15.4363; 15.1805 90; 96.671; 90	2214.9	Mo, Dong-Liang; Pecak, Wiktoria H.; Zhao, Meng; Wink, Donald J.; Anderson, Laura L. Synthesis of N-Styrenyl Amidines from α,β-Unsaturated Nitrones and Isocyanates through CO2 Elimination and Styrenyl Migration. Organic letters, 2014, 16, 3696
1516966	CIF	C23 H22 N2 O	P b c a	9.3932; 18.3398; 23.3368 90; 90; 90	4020.2	Das, Arindam; Alam, Rauful; Eriksson, Lars; Szabó, Kálmán J Stereocontrol in synthesis of homoallylic amines. Syn selective direct allylation of hydrazones with allylboronic acids. Organic letters, 2014, 16, 3808-3811
1516967	CIF	C20 H24 N2 O	P -1	9.148; 10.4716; 10.7014 102.932; 112.881; 94.888	903.42	Das, Arindam; Alam, Rauful; Eriksson, Lars; Szabó, Kálmán J Stereocontrol in synthesis of homoallylic amines. Syn selective direct allylation of hydrazones with allylboronic acids. Organic letters, 2014, 16, 3808-3811
1516968	CIF	C23 H19 Br O4	P 1	8.0129; 8.8764; 14.284 75.661; 88.56; 73.636	943.3	Li, Lijun; Su, Cunxiang; Liu, Xiaoqin; Tian, Hua; Shi, Yian Catalytic Asymmetric Intermolecular Bromoesterification of Unfunctionalized Olefins. Organic letters, 2014, 16, 3728
1516969	CIF	C10 H11 Br O	P 1 21 1	10.488; 8.97; 10.599 90; 107.296; 90	952	Li, Lijun; Su, Cunxiang; Liu, Xiaoqin; Tian, Hua; Shi, Yian Catalytic Asymmetric Intermolecular Bromoesterification of Unfunctionalized Olefins. Organic letters, 2014, 16, 3728
1516970	CIF	C22 H19 Br O2	P 1 21 1	11.041; 6.6793; 12.193 90; 102.07; 90	879.3	Li, Lijun; Su, Cunxiang; Liu, Xiaoqin; Tian, Hua; Shi, Yian Catalytic Asymmetric Intermolecular Bromoesterification of Unfunctionalized Olefins. Organic letters, 2014, 16, 3728
1516971	CIF	C21 H17 Br O2	C 1 2 1	20.888; 7.515; 14.089 90; 129.736; 90	1700.7	Li, Lijun; Su, Cunxiang; Liu, Xiaoqin; Tian, Hua; Shi, Yian Catalytic Asymmetric Intermolecular Bromoesterification of Unfunctionalized Olefins. Organic letters, 2014, 16, 3728
1516972	CIF	C17 H18 Br N O2 S	P -1	10.027; 10.035; 10.325 113.27; 114.37; 96.32	821.8	Li, Lijun; Su, Cunxiang; Liu, Xiaoqin; Tian, Hua; Shi, Yian Catalytic Asymmetric Intermolecular Bromoesterification of Unfunctionalized Olefins. Organic letters, 2014, 16, 3728
1516973	CIF	C20 H15 N3 O	P 21 21 21	5.3994; 14.277; 20.499 90; 90; 90	1580.2	Mukherjee, Manjira; Pal, Siddhartha; Lohar, Somenath; Sen, Buddhadeb; Sen, Supriti; Banerjee, Samya; Banerjee, Snehasis; Chattopadhyay, Pabitra A napthelene-pyrazol conjugate: Al(iii) ion-selective blue shifting chemosensor applicable as biomarker in aqueous solution. The Analyst, 2014, 139, 4828-4835
1516974	CIF	C98 H68 N2 O26 Zn8	P n m a	24.8949; 42.564; 32.7857 90; 90; 90	34741	Dutta, Ananya; Wong-Foy, Antek G.; Matzger, Adam J. Coordination copolymerization of three carboxylate linkers into a pillared layer framework Chemical Science, 2014, 5, 3729
1516975	CIF	C43 H30 N O13 Zn4	P 1 21/c 1	17.1259; 32.5986; 25.1806 90; 99.471; 90	13866.2	Dutta, Ananya; Wong-Foy, Antek G.; Matzger, Adam J. Coordination copolymerization of three carboxylate linkers into a pillared layer framework Chemical Science, 2014, 5, 3729
1516976	CIF	C21 H13 F3 N3 O6 Re S	P 1 21/n 1	13.1254; 13.0009; 13.7872 90; 109.269; 90	2220.88	Fernández-Moreira, Vanesa; Marzo, Isabel; Gimeno, M. Concepción Luminescent Re(i) and Re(i)/Au(i) complexes as cooperative partners in cell imaging and cancer therapy Chem. Sci., 2014, 5, 4434
1516977	CIF	C41 H33 Au F6 N3 O4 P2 Re	P -1	9.4683; 16.4296; 26.0868 92.497; 92.66; 91.206	4048.77	Fernández-Moreira, Vanesa; Marzo, Isabel; Gimeno, M. Concepción Luminescent Re(i) and Re(i)/Au(i) complexes as cooperative partners in cell imaging and cancer therapy Chem. Sci., 2014, 5, 4434
1516978	CIF	C38 H28 Au F3 N4 O6 P Re S	P -1	8.9054; 9.077; 22.963 84.156; 88.572; 88.527	1845.48	Fernández-Moreira, Vanesa; Marzo, Isabel; Gimeno, M. Concepción Luminescent Re(i) and Re(i)/Au(i) complexes as cooperative partners in cell imaging and cancer therapy Chem. Sci., 2014, 5, 4434
1516979	CIF	C37 H31 Au F3 N4 O6.5 P Re S	P -1	13.0494; 13.4519; 22.5256 95.947; 99.847; 102.157	3768.28	Fernández-Moreira, Vanesa; Marzo, Isabel; Gimeno, M. Concepción Luminescent Re(i) and Re(i)/Au(i) complexes as cooperative partners in cell imaging and cancer therapy Chem. Sci., 2014, 5, 4434
1516980	CIF	C14 H14 N4 O4	P -1	7.16538; 8.2062; 11.6136 85.818; 88.406; 82.354	674.9	Appel, Wilco P. J.; Nieuwenhuizen, Marko M. L.; Lutz, Martin; de Waal, Bas F. M.; Palmans, Anja R. A.; Meijer, E. W. Supramolecular chemistry with ureido-benzoic acids Chemical Science, 2014, 5, 3735
1516981	CIF	C22 H23 Cd N3 S4	P m n 21	16.9468; 8.9864; 8.1711 90; 90; 90	1244.38	Damian C. Onwudiwe; Christien A. Strydom; Eric C. Hosten Effect of methyl substituent in pyridine on the spectral and thermal properties of pyridyl adducts of Zn(II) and Cd(II) dithiocarbamate Inorganica Chimica Acta, 2013, 401, 1-10
1516982	CIF	C26 H26 Cd N4 S4	P 1 21/c 1	16.6557; 17.6455; 9.2332 90; 91.473; 90	2712.72	Damian C. Onwudiwe; Christien A. Strydom; Eric C. Hosten Effect of methyl substituent in pyridine on the spectral and thermal properties of pyridyl adducts of Zn(II) and Cd(II) dithiocarbamate Inorganica Chimica Acta, 2013, 401, 1-10
1516983	CIF	C17 H22 Mo N2 O3 S3	P 1 21/c 1	19.1121; 8.2591; 12.8459 90; 104.63; 90	1961.96	Takahiko Ogawa; Koji Koike; Jun Matsumoto; Yuji Kajita; Hideki Masuda Synthesis and characterization of tricarbonyl-molybdenum complexes bearing monoaza-trithia-macrocyclic ligands Inorganica Chimica Acta, 2013, 401, 101-106
1516984	CIF	C13 H21 Mo N O3 S3	P n a 21	29.541; 8.9741; 12.7826 90; 90; 90	3388.7	Takahiko Ogawa; Koji Koike; Jun Matsumoto; Yuji Kajita; Hideki Masuda Synthesis and characterization of tricarbonyl-molybdenum complexes bearing monoaza-trithia-macrocyclic ligands Inorganica Chimica Acta, 2013, 401, 101-106
1516985	CIF	C10 H8 O6 Pb	C 1 2/c 1	10.2009; 9.7997; 10.1272 90; 101.047; 90	993.6	Marlon T. Conato; Xiqu Wang; Allan J. Jacobson Synthesis and crystal structures of complexes based on the ligand meso-1,4-phenylenebis(hydroxyacetic acid) Inorganica Chimica Acta, 2013, 401, 24-29
1516986	CIF	C10 H16 Co O10	C 1 2/c 1	20.7272; 12.9346; 10.2507 90; 102.431; 90	2683.8	Marlon T. Conato; Xiqu Wang; Allan J. Jacobson Synthesis and crystal structures of complexes based on the ligand meso-1,4-phenylenebis(hydroxyacetic acid) Inorganica Chimica Acta, 2013, 401, 24-29
1516987	CIF	C10 H16 O10 Zn	C 1 2/c 1	20.7801; 12.8656; 10.2531 90; 102.678; 90	2674.3	Marlon T. Conato; Xiqu Wang; Allan J. Jacobson Synthesis and crystal structures of complexes based on the ligand meso-1,4-phenylenebis(hydroxyacetic acid) Inorganica Chimica Acta, 2013, 401, 24-29
1516988	CIF	C17 H16 O6	P 21 21 2	6.787; 23.691; 4.5084 90; 90; 90	724.9	Victor Barba; Paola Ramos; Danae Jimenez; Abraham Rivera; Ariel Meneses Calixarene and hemicarcerand-like compounds obtained by self-assembly of 3-aminophenylboronic acid and salicylaldehyde derivatives Inorganica Chimica Acta, 2013, 401, 30-37
1516989	CIF	C12 H13 N O2	P 1 21/n 1	4.5421; 12.455; 18.85 90; 90.625; 90	1066.32	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1516990	CIF	C20 H26 N2	C 1 2/c 1	24.1856; 11.2518; 26.716 90; 93.795; 90	7254.3	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1516991	CIF	C21 H20 N2	P 1 21/c 1	11.2144; 21.3255; 7.0455 90; 93.732; 90	1681.38	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1516992	CIF	C24 H28 N2	P 1 21/n 1	9.002; 10.9823; 21.1272 90; 97.961; 90	2068.6	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1516993	CIF	C29.5 H31 Cl N2	P 1 21/n 1	11.3408; 18.7613; 12.489 90; 105.247; 90	2563.73	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1516994	CIF	C54 H44 Cl4 Li4 N4 O4	P -1	11.012; 15.932; 17.0779 107.968; 99.26; 109.543	2566.7	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1516995	CIF	C70 H82 Li2 N4 O3	P -1	8.789; 10.2331; 17.4981 75.609; 88.98; 87.036	1522.32	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1516996	CIF	C53 H42 Cl4 N4 O5 Zr2	P 1 21/n 1	9.6242; 18.0723; 15.0107 90; 101.713; 90	2556.47	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1516997	CIF	C58 H58 Cl2 N4 O2 Zr	P 1 21/n 1	12.7194; 22.1936; 18.2873 90; 97.899; 90	5113.3	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1516998	CIF	C81 H66 Cl6 Co3 Li2 N6 O7	R -3 c :H	20.251; 20.251; 32.903 90; 90; 120	11685.8	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1516999	CIF	C26 H20 Cu N2 O2	P 1 21/n 1	9.4444; 22.2615; 9.9361 90; 97.297; 90	2072.11	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1517000	CIF	C26 H20 N2 O2 Zn	P 1 21/n 1	11.2726; 16.1504; 11.7431 90; 90.669; 90	2137.77	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1517001	CIF	C34 H24 N2 O2 Zn	C 1 2/c 1	24.746; 8.6601; 12.2225 90; 104.566; 90	2535.13	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1517002	CIF	C42 H38 Fe N4	P 1 21/c 1	10.2774; 16.3353; 20.2966 90; 92.231; 90	3404.9	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1517003	CIF	C42 H38 Co N4	P 1 21/n 1	20.9121; 8.2655; 21.649 90; 113.229; 90	3438.66	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1517004	CIF	C42 H38 N4 Ni	P 1 21/c 1	10.2332; 16.385; 20.2217 90; 91.977; 90	3388.57	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1517005	CIF	C48 H54 N4 Ni	P -1	10.7602; 11.3696; 18.8522 83.913; 86.422; 65.77	2090.87	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1517006	CIF	C42 H38 Cu N4	P 1 21/n 1	21.0026; 8.0519; 21.7477 90; 113.082; 90	3383.35	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1517007	CIF	C51 H44 Cl2 N4 Zn	P b c a	10.2526; 22.0749; 38.2732 90; 90; 90	8662.2	Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49
1517008	CIF	C38 H46 Br4 Cu2 N7 O22 Sm	C 1 2/c 1	16.923; 14.041; 21.722 90; 94.06; 90	5148.5	Beata Cristovao; Barbara Miroslaw Propeller-like heterotrinuclear CuII-LnIII-CuII compounds - Physicochemical properties Inorganica Chimica Acta, 2013, 401, 50-57
1517009	CIF	C38 H46 Br4 Cu2 Eu N7 O22	C 1 2/c 1	16.858; 14.033; 21.711 90; 93.64; 90	5125.8	Beata Cristovao; Barbara Miroslaw Propeller-like heterotrinuclear CuII-LnIII-CuII compounds - Physicochemical properties Inorganica Chimica Acta, 2013, 401, 50-57
1517010	CIF	C14 H55 Er2 N6 O69 W12	P 1 21/n 1	12.9075; 25.135; 21.631 90; 98.584; 90	6939.1	Dan-Dan Liu; Ya-Guang Chen Coordination polymers of lanthanide elements and metatungstate: Syntheses, structure and magnetic property Inorganica Chimica Acta, 2013, 401, 70-75
1517011	CIF	C21 H51 N6 O84 Tm3 W12	R 3 c :H	16.6502; 16.6502; 51.313 90; 90; 120	12319.6	Dan-Dan Liu; Ya-Guang Chen Coordination polymers of lanthanide elements and metatungstate: Syntheses, structure and magnetic property Inorganica Chimica Acta, 2013, 401, 70-75
1517012	CIF	C21 H51 N6 O87 W12 Yb3	R 3 c :H	16.6606; 16.6606; 51.316 90; 90; 120	12335.7	Dan-Dan Liu; Ya-Guang Chen Coordination polymers of lanthanide elements and metatungstate: Syntheses, structure and magnetic property Inorganica Chimica Acta, 2013, 401, 70-75
1517013	CIF	C21 H21 Lu3 N6 O80 W12	R 3 c :H	16.6308; 16.6308; 51.164 90; 90; 120	12255.2	Dan-Dan Liu; Ya-Guang Chen Coordination polymers of lanthanide elements and metatungstate: Syntheses, structure and magnetic property Inorganica Chimica Acta, 2013, 401, 70-75
1517014	CIF	C32 H50 F2 Ti	P 21 21 21	10.394; 15.2446; 18.0777 90; 90; 90	2864.45	Vladimir V. Burlakov; Konstantin A. Lyssenko; Anke Spannenberg; Wolfgang Baumann; Perdita Arndt; Vladimir B. Shur; Uwe Rosenthal Reactivity of functionalised decamethyltitanocenes: Synthesis and structure of chiral monocyclopentadienyl titanium halogenides Inorganica Chimica Acta, 2013, 401, 76-80
1517015	CIF	C22 H35 Cl3 Ti	P -1	9.3969; 11.5366; 11.951 103.627; 97.146; 112.576	1128.8	Vladimir V. Burlakov; Konstantin A. Lyssenko; Anke Spannenberg; Wolfgang Baumann; Perdita Arndt; Vladimir B. Shur; Uwe Rosenthal Reactivity of functionalised decamethyltitanocenes: Synthesis and structure of chiral monocyclopentadienyl titanium halogenides Inorganica Chimica Acta, 2013, 401, 76-80
1517016	CIF	C47 H36 Mn3 N4 O13 S6	P b c a	19.1258; 23.0759; 23.544 90; 90; 90	10391	Reda F.M. Elshaarawy; Yanhua Lan; Christoph Janiak Oligonuclear homo- and mixed-valence manganese complexes based on thiophene- or aryl-carboxylate ligation: Synthesis, characterization and magnetic studies Inorganica Chimica Acta, 2013, 401, 85-94
1517017	CIF	C45 H33 Mn3 N3 O14 S6	P b c a	18.974; 22.931; 23.64 90; 90; 90	10286	Reda F.M. Elshaarawy; Yanhua Lan; Christoph Janiak Oligonuclear homo- and mixed-valence manganese complexes based on thiophene- or aryl-carboxylate ligation: Synthesis, characterization and magnetic studies Inorganica Chimica Acta, 2013, 401, 85-94
1517018	CIF	C69 H75 Cl2 Mn4 N O23 S10	P 1 21/c 1	14.723; 20.353; 28.02 90; 92.77; 90	8387	Reda F.M. Elshaarawy; Yanhua Lan; Christoph Janiak Oligonuclear homo- and mixed-valence manganese complexes based on thiophene- or aryl-carboxylate ligation: Synthesis, characterization and magnetic studies Inorganica Chimica Acta, 2013, 401, 85-94
1517019	CIF	C98 H119 Cl2 Mn4 N O20	P 1 21/c 1	16.593; 27.958; 22.7744 90; 108.246; 90	10034	Reda F.M. Elshaarawy; Yanhua Lan; Christoph Janiak Oligonuclear homo- and mixed-valence manganese complexes based on thiophene- or aryl-carboxylate ligation: Synthesis, characterization and magnetic studies Inorganica Chimica Acta, 2013, 401, 85-94
1517020	CIF	C22 H26 N2 O4	P b c a	11.5485; 16.5802; 20.5991 90; 90; 90	3944.24	Schurgers, Ben; Brigou, Ben; Urbanczyk-Lipkowska, Zofia; Tourwé, Dirk; Ballet, Steven; De Proft, Frank; Van Lommen, Guy; Verniest, Guido Synthesis of Fused 3-Aminoazepinones via Trapping of a New Class of Cyclic Seven-Membered Allenamides with Furan. Organic letters, 2014, 16, 3712-3715
1517021	CIF	C22 H26 N2 O4	P 1 21/c 1	9.918; 26.3168; 7.8796 90; 97.924; 90	2037.02	Schurgers, Ben; Brigou, Ben; Urbanczyk-Lipkowska, Zofia; Tourwé, Dirk; Ballet, Steven; De Proft, Frank; Van Lommen, Guy; Verniest, Guido Synthesis of Fused 3-Aminoazepinones via Trapping of a New Class of Cyclic Seven-Membered Allenamides with Furan. Organic letters, 2014, 16, 3712-3715
1517022	CIF	C38 H42 Au P Si	C 1 2/c 1	25.9774; 25.2649; 11.2161 90; 113.278; 90	6762.1	Mazzanti, Virginia; Jiang, Huixin; Gotfredsen, Henrik; Morsing, Thorbjørn J; Parker, Christian R.; Nielsen, Mogens Brøndsted The Gilded Edge in Acetylenic Scaffolding: Pd-Catalyzed Cross-Coupling Reactions of Phosphine-Gold(I) Oligoynyl Complexes. Organic letters, 2014, 16, 3736
1517023	CIF	C59.7 H40.71 Au2 Cl3.4 N2 O4 P2	P -1	13.3652; 13.4905; 17.0362 83.516; 86.041; 64.505	2754.1	Mazzanti, Virginia; Jiang, Huixin; Gotfredsen, Henrik; Morsing, Thorbjørn J; Parker, Christian R.; Nielsen, Mogens Brøndsted The Gilded Edge in Acetylenic Scaffolding: Pd-Catalyzed Cross-Coupling Reactions of Phosphine-Gold(I) Oligoynyl Complexes. Organic letters, 2014, 16, 3736
1517024	CIF	C37 H48 N Ni O P2	P 1 21/c 1	12.292; 9.621; 28.336 90; 92.9; 90	3346.8	Yoo, Changho; Oh, Seohee; Kim, Jin; Lee, Yunho Transmethylation of a four-coordinate nickel(i) monocarbonyl species with methyl iodide Chemical Science, 2014, 5, 3853
1517025	CIF	C4 H9 Cd N6 O9	P 1 21/c 1	10.6999; 9.4421; 11.2283 90; 108.935; 90	1073	Yoo, Changho; Oh, Seohee; Kim, Jin; Lee, Yunho Transmethylation of a four-coordinate nickel(i) monocarbonyl species with methyl iodide Chemical Science, 2014, 5, 3853
1517026	CIF	C34 H49 N Ni O P2	P 1 21/c 1	12.4045; 9.652; 27.5625 90; 92.722; 90	3296.29	Yoo, Changho; Oh, Seohee; Kim, Jin; Lee, Yunho Transmethylation of a four-coordinate nickel(i) monocarbonyl species with methyl iodide Chemical Science, 2014, 5, 3853
1517027	CIF	C31 H51 N Ni O P2	P 1 21/c 1	19.2355; 11.6533; 14.8149 90; 110.899; 90	3102.4	Yoo, Changho; Oh, Seohee; Kim, Jin; Lee, Yunho Transmethylation of a four-coordinate nickel(i) monocarbonyl species with methyl iodide Chemical Science, 2014, 5, 3853
1517028	CIF	C28 H45 N Ni P2	P -1	10.5204; 11.0371; 12.559 79.346; 84.731; 71.343	1357	Yoo, Changho; Oh, Seohee; Kim, Jin; Lee, Yunho Transmethylation of a four-coordinate nickel(i) monocarbonyl species with methyl iodide Chemical Science, 2014, 5, 3853
1517029	CIF	C30 H47 N Ni O P2	C 1 c 1	16.6022; 12.4707; 16.0966 90; 113.6; 90	3053.92	Yoo, Changho; Oh, Seohee; Kim, Jin; Lee, Yunho Transmethylation of a four-coordinate nickel(i) monocarbonyl species with methyl iodide Chemical Science, 2014, 5, 3853
1517030	CIF	C29 H47 N Ni P2	P 1 21/c 1	15.7352; 9.8832; 18.2622 90; 94.249; 90	2832.22	Yoo, Changho; Oh, Seohee; Kim, Jin; Lee, Yunho Transmethylation of a four-coordinate nickel(i) monocarbonyl species with methyl iodide Chemical Science, 2014, 5, 3853
1517031	CIF	C30 H47 N Ni O P2	P 1 21/c 1	15.5099; 9.9868; 18.6693 90; 95.552; 90	2878.2	Yoo, Changho; Oh, Seohee; Kim, Jin; Lee, Yunho Transmethylation of a four-coordinate nickel(i) monocarbonyl species with methyl iodide Chemical Science, 2014, 5, 3853
1517032	CIF	C31 H49 N Ni O P2	P 1 21/c 1	12.11; 13.584; 19.335 90; 106.49; 90	3049.8	Yoo, Changho; Oh, Seohee; Kim, Jin; Lee, Yunho Transmethylation of a four-coordinate nickel(i) monocarbonyl species with methyl iodide Chemical Science, 2014, 5, 3853
1517033	CIF	C19.5 H12 Co1.5 N4.5	C 2 2 21	8.4667; 16.5199; 24.2164 90; 90; 90	3387.1	Bin Yuan; Min Min Yue; Ying Wang; Ju Yan Liu; Bin Ding; Xiao Jun Zhao Cyano-bridged assemblies induced by positive ions: Hydrothermal syntheses, crystal and powder X-ray structures, and magnetic properties Inorganica Chimica Acta, 2013, 402, 1-5
1517034	CIF	C12 H8 N4 Ni	P b c n	14.173; 10.1535; 15.833 90; 90; 90	2278.5	Bin Yuan; Min Min Yue; Ying Wang; Ju Yan Liu; Bin Ding; Xiao Jun Zhao Cyano-bridged assemblies induced by positive ions: Hydrothermal syntheses, crystal and powder X-ray structures, and magnetic properties Inorganica Chimica Acta, 2013, 402, 1-5
1517035	CIF	C20 H26 Cd N6 O11	P 1 21/c 1	12.3418; 12.8106; 15.3894 90; 93.886; 90	2427.56	Shantanu Hazra; Biswarup Sarkar; Subrata Naiya; Michael G.B. Drew; Ashutosh Ghosh Structural variations in the complexes of cadmium(II), hexamethylenetetramine, and 2-, 3- and 4-nitrobenzoates Inorganica Chimica Acta, 2013, 402, 12-19
1517036	CIF	C40 H46 Cd N12 O18	P -1	7.8716; 11.583; 12.6457 84.717; 75.307; 85.07	1108.2	Shantanu Hazra; Biswarup Sarkar; Subrata Naiya; Michael G.B. Drew; Ashutosh Ghosh Structural variations in the complexes of cadmium(II), hexamethylenetetramine, and 2-, 3- and 4-nitrobenzoates Inorganica Chimica Acta, 2013, 402, 12-19
1517037	CIF	C20 H20 Cd N6 O8	C m m 2	23.195; 6.51; 6.894 90; 90; 90	1041	Shantanu Hazra; Biswarup Sarkar; Subrata Naiya; Michael G.B. Drew; Ashutosh Ghosh Structural variations in the complexes of cadmium(II), hexamethylenetetramine, and 2-, 3- and 4-nitrobenzoates Inorganica Chimica Acta, 2013, 402, 12-19
1517038	CIF	C20 H25 Cd N6 O10.5	P -1	7.2297; 12.8247; 13.4064 73.407; 82.355; 81.246	1172.11	Shantanu Hazra; Biswarup Sarkar; Subrata Naiya; Michael G.B. Drew; Ashutosh Ghosh Structural variations in the complexes of cadmium(II), hexamethylenetetramine, and 2-, 3- and 4-nitrobenzoates Inorganica Chimica Acta, 2013, 402, 12-19
1517039	CIF	C50 H74 Co2 N8 O20	P 1 21/c 1	21.0889; 13.6528; 19.9806 90; 101.633; 90	5634.7	Jian Wu; Jian-Qiang Liu Coexistence of planar tetramer and cyclic octamer water clusters in a polymer: Synthesis, DFT study and magnetism Inorganica Chimica Acta, 2013, 402, 20-24
1517040	CIF	C16 H20 N4 O5 Zn	P 1 21 1	8.9744; 13.352; 15.3503 90; 92.545; 90	1837.6	Rui-Li Zhao; Ke-Fen Yue; Chun-sheng Zhou; Qiao-De-Mei Cheng; Jing-Tao Shi; Yong-Liang Liu; Yao-Yu Wang A study of zinc(II) coordination polymers with identical meso-helix based on 1,4-bis(2-methyl-imidazol-1-yl)butane Inorganica Chimica Acta, 2013, 402, 25-32
1517041	CIF	C16 H22 N4 O5 Zn	P c a 21	15.91; 8.949; 13.459 90; 90; 90	1916.3	Rui-Li Zhao; Ke-Fen Yue; Chun-sheng Zhou; Qiao-De-Mei Cheng; Jing-Tao Shi; Yong-Liang Liu; Yao-Yu Wang A study of zinc(II) coordination polymers with identical meso-helix based on 1,4-bis(2-methyl-imidazol-1-yl)butane Inorganica Chimica Acta, 2013, 402, 25-32
1517042	CIF	C17 H24 N4 O5 Zn	P 1 n 1	9.47; 8.8874; 11.3366 90; 94.809; 90	950.8	Rui-Li Zhao; Ke-Fen Yue; Chun-sheng Zhou; Qiao-De-Mei Cheng; Jing-Tao Shi; Yong-Liang Liu; Yao-Yu Wang A study of zinc(II) coordination polymers with identical meso-helix based on 1,4-bis(2-methyl-imidazol-1-yl)butane Inorganica Chimica Acta, 2013, 402, 25-32
1517043	CIF	C24 H24 N6 O6 Zn	P 21 21 21	8.7076; 15.686; 19.368 90; 90; 90	2645.4	Rui-Li Zhao; Ke-Fen Yue; Chun-sheng Zhou; Qiao-De-Mei Cheng; Jing-Tao Shi; Yong-Liang Liu; Yao-Yu Wang A study of zinc(II) coordination polymers with identical meso-helix based on 1,4-bis(2-methyl-imidazol-1-yl)butane Inorganica Chimica Acta, 2013, 402, 25-32
1517044	CIF	C44 H41 Eu N8 O10	I -4 c 2	16.3271; 16.3271; 16.1084 90; 90; 90	4294.1	Victor F. Shul-gin; Oleg V. Konnik; Susana V. Abkhairova; Alexey N. Gusev; Svetlana B. Meshkova; Anna V. Kiriyak; Eduard B. Rusanov; Miki Hasegawa; Wolfgang Linert Anionic lanthanide complexes with 3-methyl-1-phenyl-4-formylpyrazole-5-one and hydroxonium as counter ion Inorganica Chimica Acta, 2013, 402, 33-38
1517045	CIF	C44 H41 N8 O10 Sm	I -4 c 2	16.2701; 16.2701; 16.1315 90; 90; 90	4270.3	Victor F. Shul-gin; Oleg V. Konnik; Susana V. Abkhairova; Alexey N. Gusev; Svetlana B. Meshkova; Anna V. Kiriyak; Eduard B. Rusanov; Miki Hasegawa; Wolfgang Linert Anionic lanthanide complexes with 3-methyl-1-phenyl-4-formylpyrazole-5-one and hydroxonium as counter ion Inorganica Chimica Acta, 2013, 402, 33-38
1517046	CIF	C44 H38 Cu2 N2 O9	P 1 21/c 1	10.4155; 20.113; 19.323 90; 104.032; 90	3927.1	In Hong Hwang; Young Dan Jo; Hyun Kim; Kyeong Beom Kim; Kwang-Deog Jung; Cheal Kim; Youngmee Kim; Sung-Jin Kim Catalytic transesterification reactions of one-dimensional coordination polymers containing paddle-wheel-type units connected by various bridging ligands Inorganica Chimica Acta, 2013, 402, 39-45
1517047	CIF	C68 H58 Cu3 N4 O12	P -1	9.8178; 10.774; 14.9306 79.685; 81.615; 78.697	1513.6	In Hong Hwang; Young Dan Jo; Hyun Kim; Kyeong Beom Kim; Kwang-Deog Jung; Cheal Kim; Youngmee Kim; Sung-Jin Kim Catalytic transesterification reactions of one-dimensional coordination polymers containing paddle-wheel-type units connected by various bridging ligands Inorganica Chimica Acta, 2013, 402, 39-45
1517048	CIF	C40 H33 Cu2 N3 O8	P -1	10.299; 10.846; 16.531 75.827; 86.068; 88.446	1786	In Hong Hwang; Young Dan Jo; Hyun Kim; Kyeong Beom Kim; Kwang-Deog Jung; Cheal Kim; Youngmee Kim; Sung-Jin Kim Catalytic transesterification reactions of one-dimensional coordination polymers containing paddle-wheel-type units connected by various bridging ligands Inorganica Chimica Acta, 2013, 402, 39-45
1517049	CIF	C34 H28 Cu2 N2 O12	P 1 21/c 1	11.104; 9.78; 18.453 90; 97.12; 90	1988.5	In Hong Hwang; Young Dan Jo; Hyun Kim; Kyeong Beom Kim; Kwang-Deog Jung; Cheal Kim; Youngmee Kim; Sung-Jin Kim Catalytic transesterification reactions of one-dimensional coordination polymers containing paddle-wheel-type units connected by various bridging ligands Inorganica Chimica Acta, 2013, 402, 39-45
1517050	CIF	C34 H28 Cl4 Cu2 N2 O8	P -1	9.744; 10.039; 10.74 89.94; 83.54; 62.3	922.7	In Hong Hwang; Young Dan Jo; Hyun Kim; Kyeong Beom Kim; Kwang-Deog Jung; Cheal Kim; Youngmee Kim; Sung-Jin Kim Catalytic transesterification reactions of one-dimensional coordination polymers containing paddle-wheel-type units connected by various bridging ligands Inorganica Chimica Acta, 2013, 402, 39-45
1517051	CIF	C18 H18 Mn N2 O6 P2	P 1 21/n 1	10.4041; 14.67; 12.4281 90; 103.314; 90	1845.9	Tiffany M. Smith; Diona Symester; Kathryn Perrin; Jose Vargas; Michael Tichenor; Charles J. O-Connor; Jon Zubieta Hydrothermal syntheses and structural chemistry of Mn(II), Co(II) and Ni(II) coordination polymers with xylyl-diphosphonate ligands Inorganica Chimica Acta, 2013, 402, 46-59
1517052	CIF	C40 H38 Co N4 O12 P4	C 1 2/c 1	18.2825; 25.5632; 8.5534 90; 96.522; 90	3971.6	Tiffany M. Smith; Diona Symester; Kathryn Perrin; Jose Vargas; Michael Tichenor; Charles J. O-Connor; Jon Zubieta Hydrothermal syntheses and structural chemistry of Mn(II), Co(II) and Ni(II) coordination polymers with xylyl-diphosphonate ligands Inorganica Chimica Acta, 2013, 402, 46-59
1517053	CIF	C32 H26 Co N6 O6 P2	P -1	10.1252; 10.7137; 15.4619 72.627; 72.563; 76.693	1508.9	Tiffany M. Smith; Diona Symester; Kathryn Perrin; Jose Vargas; Michael Tichenor; Charles J. O-Connor; Jon Zubieta Hydrothermal syntheses and structural chemistry of Mn(II), Co(II) and Ni(II) coordination polymers with xylyl-diphosphonate ligands Inorganica Chimica Acta, 2013, 402, 46-59
1517054	CIF	C18 H18 N2 Ni O6 P2	P -1	7.6024; 10.8033; 10.8232 95.76; 94.041; 92.794	880.84	Tiffany M. Smith; Diona Symester; Kathryn Perrin; Jose Vargas; Michael Tichenor; Charles J. O-Connor; Jon Zubieta Hydrothermal syntheses and structural chemistry of Mn(II), Co(II) and Ni(II) coordination polymers with xylyl-diphosphonate ligands Inorganica Chimica Acta, 2013, 402, 46-59
1517055	CIF	C20 H18 N2 Ni O6 P2	P -1	7.538; 10.783; 11.934 82.441; 88.115; 85.638	958.6	Tiffany M. Smith; Diona Symester; Kathryn Perrin; Jose Vargas; Michael Tichenor; Charles J. O-Connor; Jon Zubieta Hydrothermal syntheses and structural chemistry of Mn(II), Co(II) and Ni(II) coordination polymers with xylyl-diphosphonate ligands Inorganica Chimica Acta, 2013, 402, 46-59
1517056	CIF	C40 H38 N4 Ni O12 P4	C 1 2/c 1	18.2692; 25.477; 8.5637 90; 96.733; 90	3958.4	Tiffany M. Smith; Diona Symester; Kathryn Perrin; Jose Vargas; Michael Tichenor; Charles J. O-Connor; Jon Zubieta Hydrothermal syntheses and structural chemistry of Mn(II), Co(II) and Ni(II) coordination polymers with xylyl-diphosphonate ligands Inorganica Chimica Acta, 2013, 402, 46-59
1517057	CIF	C32 H26 N6 Ni O6 P2	P -1	10.0453; 10.7094; 15.4596 72.132; 72.796; 76.961	1495.4	Tiffany M. Smith; Diona Symester; Kathryn Perrin; Jose Vargas; Michael Tichenor; Charles J. O-Connor; Jon Zubieta Hydrothermal syntheses and structural chemistry of Mn(II), Co(II) and Ni(II) coordination polymers with xylyl-diphosphonate ligands Inorganica Chimica Acta, 2013, 402, 46-59
1517058	CIF	C20 H22 N3 Ni O8 P2	P -1	10.8732; 11.0085; 11.2619 63.681; 66.155; 72.92	1094.32	Tiffany M. Smith; Diona Symester; Kathryn Perrin; Jose Vargas; Michael Tichenor; Charles J. O-Connor; Jon Zubieta Hydrothermal syntheses and structural chemistry of Mn(II), Co(II) and Ni(II) coordination polymers with xylyl-diphosphonate ligands Inorganica Chimica Acta, 2013, 402, 46-59
1517059	CIF	C18 H18 Mn N2 O6 P2	P -1	7.6596; 10.843; 11.025 96.309; 91.689; 94.815	906.2	Tiffany M. Smith; Diona Symester; Kathryn Perrin; Jose Vargas; Michael Tichenor; Charles J. O-Connor; Jon Zubieta Hydrothermal syntheses and structural chemistry of Mn(II), Co(II) and Ni(II) coordination polymers with xylyl-diphosphonate ligands Inorganica Chimica Acta, 2013, 402, 46-59
1517060	CIF	C36 H38 Mn N4 O12 P4	C 1 2/c 1	18.035; 24.643; 8.766 90; 102.609; 90	3802	Tiffany M. Smith; Diona Symester; Kathryn Perrin; Jose Vargas; Michael Tichenor; Charles J. O-Connor; Jon Zubieta Hydrothermal syntheses and structural chemistry of Mn(II), Co(II) and Ni(II) coordination polymers with xylyl-diphosphonate ligands Inorganica Chimica Acta, 2013, 402, 46-59
1517061	CIF	C20 H18 Mn N2 O6 P2	P 1 21/n 1	10.5123; 14.6743; 12.6219 90; 104.601; 90	1884.2	Tiffany M. Smith; Diona Symester; Kathryn Perrin; Jose Vargas; Michael Tichenor; Charles J. O-Connor; Jon Zubieta Hydrothermal syntheses and structural chemistry of Mn(II), Co(II) and Ni(II) coordination polymers with xylyl-diphosphonate ligands Inorganica Chimica Acta, 2013, 402, 46-59
1517062	CIF	C20 H18 Mn N2 O6 P2	P 1 21/c 1	10.8871; 23.673; 7.6062 90; 95.014; 90	1952.8	Tiffany M. Smith; Diona Symester; Kathryn Perrin; Jose Vargas; Michael Tichenor; Charles J. O-Connor; Jon Zubieta Hydrothermal syntheses and structural chemistry of Mn(II), Co(II) and Ni(II) coordination polymers with xylyl-diphosphonate ligands Inorganica Chimica Acta, 2013, 402, 46-59
1517063	CIF	C18 H18 Co N2 O6 P2	P -1	7.6118; 10.8203; 10.861 95.957; 92.407; 94.21	886.19	Tiffany M. Smith; Diona Symester; Kathryn Perrin; Jose Vargas; Michael Tichenor; Charles J. O-Connor; Jon Zubieta Hydrothermal syntheses and structural chemistry of Mn(II), Co(II) and Ni(II) coordination polymers with xylyl-diphosphonate ligands Inorganica Chimica Acta, 2013, 402, 46-59
1517064	CIF	C20 H18 Co N2 O6 P2	P 1 21/n 1	10.3139; 14.5501; 12.67 90; 104.161; 90	1843.6	Tiffany M. Smith; Diona Symester; Kathryn Perrin; Jose Vargas; Michael Tichenor; Charles J. O-Connor; Jon Zubieta Hydrothermal syntheses and structural chemistry of Mn(II), Co(II) and Ni(II) coordination polymers with xylyl-diphosphonate ligands Inorganica Chimica Acta, 2013, 402, 46-59
1517065	CIF	C20 H18 Co N2 O6 P2	P 1 21/c 1	10.8283; 23.3785; 7.5532 90; 94.518; 90	1906.1	Tiffany M. Smith; Diona Symester; Kathryn Perrin; Jose Vargas; Michael Tichenor; Charles J. O-Connor; Jon Zubieta Hydrothermal syntheses and structural chemistry of Mn(II), Co(II) and Ni(II) coordination polymers with xylyl-diphosphonate ligands Inorganica Chimica Acta, 2013, 402, 46-59
1517066	CIF	C20 H18 Co N2 O6 P2	C 1 2/c 1	21.099; 12.0022; 7.5739 90; 98.077; 90	1898.9	Tiffany M. Smith; Diona Symester; Kathryn Perrin; Jose Vargas; Michael Tichenor; Charles J. O-Connor; Jon Zubieta Hydrothermal syntheses and structural chemistry of Mn(II), Co(II) and Ni(II) coordination polymers with xylyl-diphosphonate ligands Inorganica Chimica Acta, 2013, 402, 46-59
1517067	CIF	C14 H28 Cd3 Mo6 N12 O36 P4	P -1	12.686; 14.444; 14.594 109.839; 106.925; 96.214	2341.9	Xiu-Li Wang; Jing-Jing Cao; Guo-Cheng Liu; Hong-Yan Lin; Ai-Xiang Tian Ligands directed versatile cadmium-bis(triazole) metal-organic fragments to generate three new two dimensional complexes based on polymolybdenum phosphate Inorganica Chimica Acta, 2013, 402, 6-11
1517068	CIF	C32 H60 Cd5 Mo12 N24 O72 P8	P -1	12.836; 14.502; 14.953 104.155; 102.83; 108.371	2422.3	Xiu-Li Wang; Jing-Jing Cao; Guo-Cheng Liu; Hong-Yan Lin; Ai-Xiang Tian Ligands directed versatile cadmium-bis(triazole) metal-organic fragments to generate three new two dimensional complexes based on polymolybdenum phosphate Inorganica Chimica Acta, 2013, 402, 6-11
1517069	CIF	C40 H76 Cd5 Mo12 N24 O72 P8	P -1	14.3639; 14.9311; 14.949 114.38; 111.444; 92.437	2646.4	Xiu-Li Wang; Jing-Jing Cao; Guo-Cheng Liu; Hong-Yan Lin; Ai-Xiang Tian Ligands directed versatile cadmium-bis(triazole) metal-organic fragments to generate three new two dimensional complexes based on polymolybdenum phosphate Inorganica Chimica Acta, 2013, 402, 6-11
1517070	CIF	Bi16 O56 Ta12	C 1 2/c 1	13.016; 7.5832; 12.226 90; 101.477; 90	1182.6	Muktha, B.; Priya, M. H.; Madras, Giridhar; Guru Row, T. N. Synthesis, structure, and photocatalysis in a new structural variant of the Aurivillius phase: LiBi4M3O14 (M = Nb, Ta). The journal of physical chemistry. B, 2005, 109, 11442-11449
1517071	CIF	Bi4 Li Nb3 O14	C 1 2/c 1	13.035; 7.648; 12.217 90; 101.512; 90	1193.4	Muktha, B.; Priya, M. H.; Madras, Giridhar; Guru Row, T. N. Synthesis, structure, and photocatalysis in a new structural variant of the Aurivillius phase: LiBi4M3O14 (M = Nb, Ta). The journal of physical chemistry. B, 2005, 109, 11442-11449
1517072	CIF	C20 H22	P 1 21/n 1	5.9388; 12.164; 21.118 90; 97.72; 90	1511.7	Peng, Jing; Chen, Chao; Chen, Junjie; Su, Xiang; Xi, Chanjuan; Chen, Hui Cu-Catalyzed Arylcarbocyclization of Alkynes with Diaryliodonium Salts through C-C Bond Formation on Inert C(sp3)-H Bond. Organic letters, 2014, 16, 3776
1517073	CIF	C23 H26	P 1 21 1	7.7819; 6.151; 18.029 90; 97.73; 90	855.1	Peng, Jing; Chen, Chao; Chen, Junjie; Su, Xiang; Xi, Chanjuan; Chen, Hui Cu-Catalyzed Arylcarbocyclization of Alkynes with Diaryliodonium Salts through C-C Bond Formation on Inert C(sp3)-H Bond. Organic letters, 2014, 16, 3776
1517074	CIF	C23 H20	P -1	5.606; 8.951; 17.058 81.48; 82.58; 77.41	822	Peng, Jing; Chen, Chao; Chen, Junjie; Su, Xiang; Xi, Chanjuan; Chen, Hui Cu-Catalyzed Arylcarbocyclization of Alkynes with Diaryliodonium Salts through C-C Bond Formation on Inert C(sp3)-H Bond. Organic letters, 2014, 16, 3776
1517075	CIF	C32 H31 N O8	P 1 21/c 1	15.2; 9.19; 21.788 90; 108.912; 90	2879.2	Talukdar, Ranadeep; Tiwari, Deo Prakash; Saha, Amrita; Ghorai, Manas K. Diastereoselective Synthesis of Functionalized Tetrahydrocarbazoles via a Domino-Ring Opening-Cyclization of Donor-Acceptor Cyclopropanes with Substituted 2-Vinylindoles. Organic letters, 2014, 16, 3954-3957
1517076	CIF	C25 H26 N2 O7	P 1 21/n 1	8.398; 23.088; 12.083 90; 107.75; 90	2231.3	Talukdar, Ranadeep; Tiwari, Deo Prakash; Saha, Amrita; Ghorai, Manas K. Diastereoselective Synthesis of Functionalized Tetrahydrocarbazoles via a Domino-Ring Opening-Cyclization of Donor-Acceptor Cyclopropanes with Substituted 2-Vinylindoles. Organic letters, 2014, 16, 3954-3957
1517077	CIF	C270.75 H371 Cd18 Cl8 N18 O105.92 Tb6	P -3	51.114; 51.114; 24.362 90; 90; 120	55122	Jones, Richard A.; Gnanam, Annie J.; Arambula, Jonathan; Jones, Jessica N.; Swaminathan, Jagannath; yang, xiao ping; Schipper, Desmond; Hall, Justin Walker; DePue, Lauren J.; Marcotte, Edward; Sessler, Jonathan; Ehrlich, Lauren I.; Brown, Katherine A.; Dieye, Yahkya; Vadivelu, Jamuna; Chandler, Don J. FD175: Lanthanide Nano-drums: A New Class of Molecular Nanoparticles for Potential Biomedical Applications Faraday Discussions, 2014
1517078	CIF	C360 H464 Cd24 Ho8 N24 O144	F d d d :2	54.777; 62.244; 79.935 90; 90; 90	272542	Jones, Richard A.; Gnanam, Annie J.; Arambula, Jonathan; Jones, Jessica N.; Swaminathan, Jagannath; yang, xiao ping; Schipper, Desmond; Hall, Justin Walker; DePue, Lauren J.; Marcotte, Edward; Sessler, Jonathan; Ehrlich, Lauren I.; Brown, Katherine A.; Dieye, Yahkya; Vadivelu, Jamuna; Chandler, Don J. FD175: Lanthanide Nano-drums: A New Class of Molecular Nanoparticles for Potential Biomedical Applications Faraday Discussions, 2014
1517079	CIF	C268.5 H369.5 Cd18 Cl10 Lu6 N18 O101.5	C 1 2/c 1	41.871; 22.803; 47.322 90; 112.91; 90	41618	Jones, Richard A.; Gnanam, Annie J.; Arambula, Jonathan; Jones, Jessica N.; Swaminathan, Jagannath; yang, xiao ping; Schipper, Desmond; Hall, Justin Walker; DePue, Lauren J.; Marcotte, Edward; Sessler, Jonathan; Ehrlich, Lauren I.; Brown, Katherine A.; Dieye, Yahkya; Vadivelu, Jamuna; Chandler, Don J. FD175: Lanthanide Nano-drums: A New Class of Molecular Nanoparticles for Potential Biomedical Applications Faraday Discussions, 2014
1517080	CIF	C273.75 H384.5 Cd18 Cl8 Eu6 N18 O109.67	P -3	51.304; 51.304; 24.418 90; 90; 120	55660	Jones, Richard A.; Gnanam, Annie J.; Arambula, Jonathan; Jones, Jessica N.; Swaminathan, Jagannath; yang, xiao ping; Schipper, Desmond; Hall, Justin Walker; DePue, Lauren J.; Marcotte, Edward; Sessler, Jonathan; Ehrlich, Lauren I.; Brown, Katherine A.; Dieye, Yahkya; Vadivelu, Jamuna; Chandler, Don J. FD175: Lanthanide Nano-drums: A New Class of Molecular Nanoparticles for Potential Biomedical Applications Faraday Discussions, 2014
1517081	CIF	C21 H16 Br N O2	P -1	11.8347; 12.6758; 12.9917 83.604; 84.093; 65.322	1756.48	Goldberg, Frederick W.; Magnus, Philip; Turnbull, Rachel A mild thermal and acid-catalyzed rearrangement of O-aryl ethers into ortho-hydroxy arenes. Organic letters, 2005, 7, 4531-4534
1517082	CIF	C21 H16 Br N O2	P -1	8.4348; 14.1792; 14.812 94.72; 91.124; 105.433	1700.2	Goldberg, Frederick W.; Magnus, Philip; Turnbull, Rachel A mild thermal and acid-catalyzed rearrangement of O-aryl ethers into ortho-hydroxy arenes. Organic letters, 2005, 7, 4531-4534
1517083	CIF	C21 H28 O2 S	P c 21 b	7.841; 13.755; 17.44 90; 90; 90	1880.96	Imagawa, Hiroshi; Iyenaga, Tomoaki; Nishizawa, Mugio Mercuric triflate-catalyzed tandem cyclization leading to polycarbocycles. Organic letters, 2005, 7, 451-453
1517084	CIF	C17 H22 O3	P -1	7.286; 10.506; 10.585 107.314; 99.739; 102.947	729.25	Imagawa, Hiroshi; Iyenaga, Tomoaki; Nishizawa, Mugio Mercuric triflate-catalyzed tandem cyclization leading to polycarbocycles. Organic letters, 2005, 7, 451-453
1517085	CIF	C20 H20 N2 O5	P 21 21 21	9.1575; 13.84; 14.879 90; 90; 90	1885.8	Nair, Vijay; Biju, A. T.; Abhilash, K. G.; Menon, Rajeev S.; Suresh, Eringathodi Reaction of diaryl-1,2-diones with triphenylphosphine and diethyl azodicarboxylate leading to N,N-dicarboethoxy monohydrazones via a novel rearrangement. Organic letters, 2005, 7, 2121-2123
1517086	CIF	C26 H50 O2	P 41 2 2	19.4695; 19.4695; 26.58 90; 90; 90	10075.5	Jones, Ian W.; Monguchi, Yasunari; Dawson, Alice; Carducci, Michael D.; Mash, Eugene A. Synthesis of 1,10-dimethylbicyclo[8.8.8]hexacosane and 1,10-dihydroxybicyclo[8.8.8]hexacosane. Organic letters, 2005, 7, 2841-2843
1517087	CIF	C28 H54	P 1 21/c 1	10.639; 27.103; 10.096 90; 116.417; 90	2607.2	Jones, Ian W.; Monguchi, Yasunari; Dawson, Alice; Carducci, Michael D.; Mash, Eugene A. Synthesis of 1,10-dimethylbicyclo[8.8.8]hexacosane and 1,10-dihydroxybicyclo[8.8.8]hexacosane. Organic letters, 2005, 7, 2841-2843
1517088	CIF	C20 Cl10 N6	P 1 2/c 1	8.7677; 4.8934; 25.862 90; 93.889; 90	1107	Zheng, Shijun; Thompson, Joe D.; Tontcheva, Ana; Khan, Saeed I.; Rubin, Yves Perchloro-2,5,8-triazaphenalenyl radical. Organic letters, 2005, 7, 1861-1863
1517089	CIF	C10.5 H2 Cl5 N3 O2	P -1	6.9473; 6.2385; 15.819 100.097; 97.56; 104.412	642.6	Zheng, Shijun; Thompson, Joe D.; Tontcheva, Ana; Khan, Saeed I.; Rubin, Yves Perchloro-2,5,8-triazaphenalenyl radical. Organic letters, 2005, 7, 1861-1863
1517090	CIF	C64 H8 F2 N4 S8 Si	P -1	9.2539; 14.9631; 22.219 81.005; 85.178; 88.053	3027.3	Coughlin, Jessica E.; Zhugayevych, Andriy; Bakus, Ronald C.; van der Poll, Thomas S.; Welch, Gregory C.; Teat, Simon J.; Bazan, Guillermo C.; Tretiak, Sergei A Combined Experimental and Theoretical Study of Conformational Preferences of Molecular Semiconductors The Journal of Physical Chemistry C, 2014, 118, 15610
1517091	CIF	C44 H46 N4 S6 Si	P 1 21/c 1	18.34; 7.326; 31.8 90; 103.18; 90	4160	Coughlin, Jessica E.; Zhugayevych, Andriy; Bakus, Ronald C.; van der Poll, Thomas S.; Welch, Gregory C.; Teat, Simon J.; Bazan, Guillermo C.; Tretiak, Sergei A Combined Experimental and Theoretical Study of Conformational Preferences of Molecular Semiconductors The Journal of Physical Chemistry C, 2014, 118, 15610
1517092	CIF	C42 H44 N6 S6 Si	P 1 21/n 1	18.817; 7.9805; 28.301 90; 107.018; 90	4063.8	Coughlin, Jessica E.; Zhugayevych, Andriy; Bakus, Ronald C.; van der Poll, Thomas S.; Welch, Gregory C.; Teat, Simon J.; Bazan, Guillermo C.; Tretiak, Sergei A Combined Experimental and Theoretical Study of Conformational Preferences of Molecular Semiconductors The Journal of Physical Chemistry C, 2014, 118, 15610
1517093	CIF	C64 H72 F2 N4 S8 Si	P -1	8.808; 16.279; 22.976 108.413; 100.019; 95.249	3040.1	Coughlin, Jessica E.; Zhugayevych, Andriy; Bakus, Ronald C.; van der Poll, Thomas S.; Welch, Gregory C.; Teat, Simon J.; Bazan, Guillermo C.; Tretiak, Sergei A Combined Experimental and Theoretical Study of Conformational Preferences of Molecular Semiconductors The Journal of Physical Chemistry C, 2014, 118, 15610
1517094	CIF	C42 H42 N6 S6 Si	P -1	10.4822; 13.6007; 16.4254 67.272; 88.286; 71.732	2039.9	Coughlin, Jessica E.; Zhugayevych, Andriy; Bakus, Ronald C.; van der Poll, Thomas S.; Welch, Gregory C.; Teat, Simon J.; Bazan, Guillermo C.; Tretiak, Sergei A Combined Experimental and Theoretical Study of Conformational Preferences of Molecular Semiconductors The Journal of Physical Chemistry C, 2014, 118, 15610
1517095	CIF	C64 H68 F2 N4 S8 Si	P -1	9.2916; 14.916; 22.551 80.585; 78.642; 87.741	3022.9	Coughlin, Jessica E.; Zhugayevych, Andriy; Bakus, Ronald C.; van der Poll, Thomas S.; Welch, Gregory C.; Teat, Simon J.; Bazan, Guillermo C.; Tretiak, Sergei A Combined Experimental and Theoretical Study of Conformational Preferences of Molecular Semiconductors The Journal of Physical Chemistry C, 2014, 118, 15610
1517096	CIF	C12 H12 Mo O5	P 21 21 21	8.5556; 10.4982; 14.8086 90; 90; 90	1330.08	Grover, Nidhi; Pöthig, Alexander; Kühn, Fritz E. Cyclopentadienyl molybdenum alkyl ester complexes as catalyst precursors for olefin epoxidation Catal. Sci. Technol., 2014, 4, 4219
1517097	CIF	C13 H14 Mo O5	P b c a	10.3022; 11.1065; 23.6758 90; 90; 90	2709	Grover, Nidhi; Pöthig, Alexander; Kühn, Fritz E. Cyclopentadienyl molybdenum alkyl ester complexes as catalyst precursors for olefin epoxidation Catal. Sci. Technol., 2014, 4, 4219
1517098	CIF	C20 H24 Mo O5	P 21 21 21	7.417; 7.6621; 34.3794 90; 90; 90	1953.77	Grover, Nidhi; Pöthig, Alexander; Kühn, Fritz E. Cyclopentadienyl molybdenum alkyl ester complexes as catalyst precursors for olefin epoxidation Catal. Sci. Technol., 2014, 4, 4219
1517099	CIF	C40 H50 S Si2	C 1 2/c 1	18.8584; 12.3701; 15.9959 90; 104.724; 90	3609	Shi, Xueliang; Burrezo, Paula Mayorga; Lee, Sangsu; Zhang, Wenhua; Zheng, Bin; Dai, Gaole; Chang, Jingjing; López Navarrete, Juan T.; Huang, Kuo-Wei; Kim, Dongho; Casado, Juan; Chi, Chunyan Antiaromatic bisindeno-[n]thienoacenes with small singlet biradical characters: syntheses, structures and chain length dependent physical properties Chem. Sci., 2014, 5, 4490
1517100	CIF	C42 H50 S2 Si2	P -1	7.402; 14.535; 18.955 73.693; 83.913; 77.68	1910	Shi, Xueliang; Burrezo, Paula Mayorga; Lee, Sangsu; Zhang, Wenhua; Zheng, Bin; Dai, Gaole; Chang, Jingjing; López Navarrete, Juan T.; Huang, Kuo-Wei; Kim, Dongho; Casado, Juan; Chi, Chunyan Antiaromatic bisindeno-[n]thienoacenes with small singlet biradical characters: syntheses, structures and chain length dependent physical properties Chem. Sci., 2014, 5, 4490
1517101	CIF	C38 H30 S2	P -1	7.0732; 7.9974; 12.843 83.771; 88.008; 79.973	711.1	Shi, Xueliang; Burrezo, Paula Mayorga; Lee, Sangsu; Zhang, Wenhua; Zheng, Bin; Dai, Gaole; Chang, Jingjing; López Navarrete, Juan T.; Huang, Kuo-Wei; Kim, Dongho; Casado, Juan; Chi, Chunyan Antiaromatic bisindeno-[n]thienoacenes with small singlet biradical characters: syntheses, structures and chain length dependent physical properties Chem. Sci., 2014, 5, 4490
1517102	CIF	C40 H34 S2	C 1 2/c 1	24.056; 16.0276; 18.3518 90; 122.105; 90	5993.7	Shi, Xueliang; Burrezo, Paula Mayorga; Lee, Sangsu; Zhang, Wenhua; Zheng, Bin; Dai, Gaole; Chang, Jingjing; López Navarrete, Juan T.; Huang, Kuo-Wei; Kim, Dongho; Casado, Juan; Chi, Chunyan Antiaromatic bisindeno-[n]thienoacenes with small singlet biradical characters: syntheses, structures and chain length dependent physical properties Chem. Sci., 2014, 5, 4490
1517103	CIF	C44 H50 S3 Si2	P -1	7.51; 14.0747; 20.3192 73.205; 81.761; 82.646	2026.41	Shi, Xueliang; Burrezo, Paula Mayorga; Lee, Sangsu; Zhang, Wenhua; Zheng, Bin; Dai, Gaole; Chang, Jingjing; López Navarrete, Juan T.; Huang, Kuo-Wei; Kim, Dongho; Casado, Juan; Chi, Chunyan Antiaromatic bisindeno-[n]thienoacenes with small singlet biradical characters: syntheses, structures and chain length dependent physical properties Chem. Sci., 2014, 5, 4490
1517104	CIF	C56 H106 Fe4 N10 O23 Y2	P 1 21/c 1	19.1485; 16.4725; 24.797 90; 101.162; 90	7673.6	Mereacre, Valeriu; Klöwer, Frederik; Lan, Yanhua; Clérac, Rodolphe; Wolny, Juliusz A.; Schünemann, Volker; Anson, Christopher E.; Powell, Annie K. Spin relaxation in antiferromagnetic Fe-Fe dimers slowed down by anisotropic Dy(III) ions. Beilstein journal of nanotechnology, 2013, 4, 807-814
1517105	CIF	C68 H133 Dy2 Fe4 N13 O22	P -1	13.9237; 14.5196; 25.1289 82.856; 79.71; 65.545	4542.9	Mereacre, Valeriu; Klöwer, Frederik; Lan, Yanhua; Clérac, Rodolphe; Wolny, Juliusz A.; Schünemann, Volker; Anson, Christopher E.; Powell, Annie K. Spin relaxation in antiferromagnetic Fe-Fe dimers slowed down by anisotropic Dy(III) ions. Beilstein journal of nanotechnology, 2013, 4, 807-814
1517106	CIF	C H4 B3 O6	C 1 2/m 1	28.1808; 17.4764; 3.6978 90; 96.658; 90	1808.88	Lukose, Binit; Kuc, Agnieszka; Frenzel, Johannes; Heine, Thomas On the reticular construction concept of covalent organic frameworks. Beilstein journal of nanotechnology, 2010, 1, 60-70
1517107	CIF	C8 H4 B3 O3	C 1 2/m 1	35.7342; 22.3206; 3.6909 90; 90.014; 90	2943.89	Lukose, Binit; Kuc, Agnieszka; Frenzel, Johannes; Heine, Thomas On the reticular construction concept of covalent organic frameworks. Beilstein journal of nanotechnology, 2010, 1, 60-70
1517108	CIF	C6 H4 B3 O3	C 1 2/m 1	35.9717; 22.4102; 3.6868 90; 90.259; 90	2972.02	Lukose, Binit; Kuc, Agnieszka; Frenzel, Johannes; Heine, Thomas On the reticular construction concept of covalent organic frameworks. Beilstein journal of nanotechnology, 2010, 1, 60-70
1517109	CIF	C60 H24 B6 O12	C 1 2/m 1	46.6585; 29.0485; 3.7052 90; 93.864; 90	5010.46	Lukose, Binit; Kuc, Agnieszka; Frenzel, Johannes; Heine, Thomas On the reticular construction concept of covalent organic frameworks. Beilstein journal of nanotechnology, 2010, 1, 60-70
1517110	CIF	C24 H12 B3 O3	C m c m	22.3206; 38.6604; 6.8195 90; 90; 90	5884.71	Lukose, Binit; Kuc, Agnieszka; Frenzel, Johannes; Heine, Thomas On the reticular construction concept of covalent organic frameworks. Beilstein journal of nanotechnology, 2010, 1, 60-70
1517111	CIF	C6 H4 B O	P 6/m m m	22.4102; 22.4102; 3.4905 90; 90; 120	1518.13	Lukose, Binit; Kuc, Agnieszka; Frenzel, Johannes; Heine, Thomas On the reticular construction concept of covalent organic frameworks. Beilstein journal of nanotechnology, 2010, 1, 60-70
1517112	CIF	C21 H6 B3 O6	C 1 2/m 1	16.2172; 30.27; 3.6865 90; 92.86; 90	1807.43	Lukose, Binit; Kuc, Agnieszka; Frenzel, Johannes; Heine, Thomas On the reticular construction concept of covalent organic frameworks. Beilstein journal of nanotechnology, 2010, 1, 60-70
1517113	CIF	C72 H36 B6 O12	C 1 2/m 1	60.3114; 37.583; 3.6711 90; 92.477; 90	8313.45	Lukose, Binit; Kuc, Agnieszka; Frenzel, Johannes; Heine, Thomas On the reticular construction concept of covalent organic frameworks. Beilstein journal of nanotechnology, 2010, 1, 60-70
1517114	CIF	C18 H12 B3 O3	C m c m	22.4102; 38.8156; 6.8263 90; 90; 90	5937.96	Lukose, Binit; Kuc, Agnieszka; Frenzel, Johannes; Heine, Thomas On the reticular construction concept of covalent organic frameworks. Beilstein journal of nanotechnology, 2010, 1, 60-70
1517115	CIF	C6 H4 B O	P 63/m m c	22.4102; 22.4102; 6.0735 90; 90; 120	2641.56	Lukose, Binit; Kuc, Agnieszka; Frenzel, Johannes; Heine, Thomas On the reticular construction concept of covalent organic frameworks. Beilstein journal of nanotechnology, 2010, 1, 60-70
1517116	CIF	C8 H4 B O	P 63/m m c	22.3206; 22.3206; 5.9366 90; 90; 120	2561.42	Lukose, Binit; Kuc, Agnieszka; Frenzel, Johannes; Heine, Thomas On the reticular construction concept of covalent organic frameworks. Beilstein journal of nanotechnology, 2010, 1, 60-70
1517117	CIF	C21 H6 B3 O6	C m c m	17.4764; 30.27; 6.8195 90; 90; 90	3607.59	Lukose, Binit; Kuc, Agnieszka; Frenzel, Johannes; Heine, Thomas On the reticular construction concept of covalent organic frameworks. Beilstein journal of nanotechnology, 2010, 1, 60-70
1517120	CIF	C13 H12 Br N O	P 21 21 21	6.6803; 10.1921; 16.8279 90; 90; 90	1145.75	Du, Xiang-Wei; Ghosh, Avipsa; Stanley, Levi M. Enantioselective synthesis of polycyclic nitrogen heterocycles by rh-catalyzed alkene hydroacylation: constructing six-membered rings in the absence of chelation assistance. Organic letters, 2014, 16, 4036-4039
1517121	CIF	C48 H38 Co5 N18 O18 P6	P 1 21/n 1	9.4189; 26.248; 11.4511 90; 95.618; 90	2817.4	Fupeng Zhai; Mingli Deng; Yun Ling; Zhenxia Chen; Linhong Weng; Yaming Zhou Syntheses, structures and magnetic properties of two isostructural metal-phosphonate frameworks Inorganica Chimica Acta, 2013, 402, 104-108
1517122	CIF	C48 H38 Mn5 N18 O18 P6	P 1 21/n 1	9.565; 26.466; 11.532 90; 93.474; 90	2913.9	Fupeng Zhai; Mingli Deng; Yun Ling; Zhenxia Chen; Linhong Weng; Yaming Zhou Syntheses, structures and magnetic properties of two isostructural metal-phosphonate frameworks Inorganica Chimica Acta, 2013, 402, 104-108
1517123	CIF	C24 H18 Cl2 O4 V	C 1 2/c 1	27.467; 6.4942; 13.3931 90; 117.383; 90	2121.3	Iva Klepalova; Jan Honzicek; Jaromir Vinklarek; Zdenka Padelkova; Lucie Sebestova; Martina Rezacova Vanadocene and niobocene dihalides containing electron-withdrawing substituents in the cyclopentadienyl rings: Synthesis, characterization and cytotoxicity Inorganica Chimica Acta, 2013, 402, 109-115
1517124	CIF	C15 H16 Br2 Cl2 O4 V	P 1 2/c 1	10.841; 6.875; 12.0651 90; 98.538; 90	889.27	Iva Klepalova; Jan Honzicek; Jaromir Vinklarek; Zdenka Padelkova; Lucie Sebestova; Martina Rezacova Vanadocene and niobocene dihalides containing electron-withdrawing substituents in the cyclopentadienyl rings: Synthesis, characterization and cytotoxicity Inorganica Chimica Acta, 2013, 402, 109-115
1517125	CIF	C24 H18 Cl2 Nb O4	P 1 21/c 1	6.557; 30.1549; 11.261 90; 105.304; 90	2147.6	Iva Klepalova; Jan Honzicek; Jaromir Vinklarek; Zdenka Padelkova; Lucie Sebestova; Martina Rezacova Vanadocene and niobocene dihalides containing electron-withdrawing substituents in the cyclopentadienyl rings: Synthesis, characterization and cytotoxicity Inorganica Chimica Acta, 2013, 402, 109-115
1517126	CIF	C14 H14 Br2 Nb O4	C 1 2/c 1	20.0123; 7.254; 14.4631 90; 133.24; 90	1529.54	Iva Klepalova; Jan Honzicek; Jaromir Vinklarek; Zdenka Padelkova; Lucie Sebestova; Martina Rezacova Vanadocene and niobocene dihalides containing electron-withdrawing substituents in the cyclopentadienyl rings: Synthesis, characterization and cytotoxicity Inorganica Chimica Acta, 2013, 402, 109-115
1517127	CIF	C16 H18 Br2 Nb O4	P b c n	11.8; 6.913; 20.7381 90; 90; 90	1691.7	Iva Klepalova; Jan Honzicek; Jaromir Vinklarek; Zdenka Padelkova; Lucie Sebestova; Martina Rezacova Vanadocene and niobocene dihalides containing electron-withdrawing substituents in the cyclopentadienyl rings: Synthesis, characterization and cytotoxicity Inorganica Chimica Acta, 2013, 402, 109-115
1517128	CIF	C10 H10 Br2 V	P 21 21 21	6.888; 12.1511; 12.551 90; 90; 90	1050.48	Iva Klepalova; Jan Honzicek; Jaromir Vinklarek; Zdenka Padelkova; Lucie Sebestova; Martina Rezacova Vanadocene and niobocene dihalides containing electron-withdrawing substituents in the cyclopentadienyl rings: Synthesis, characterization and cytotoxicity Inorganica Chimica Acta, 2013, 402, 109-115
1517129	CIF	C40 H44 Cu4 N8 O46 Si W12	C 1 2/m 1	15.795; 23.522; 21.226 90; 100.155; 90	7763	Shu-Yun Shi; Zhan-Lin Xu; Hong-Hui Teng; Ling-Zi Zhao; Xiao-Bing Cui; Ji-Qing Xu Two new compounds constructed from polyoxoanions, metal ions and organic ligands Inorganica Chimica Acta, 2013, 402, 123-127
1517130	CIF	C30 H26 Cu2 Mo12 N6 O40 Si	P -1	10.8645; 11.8169; 13.3176 105.386; 102.406; 115.66	1374.8	Shu-Yun Shi; Zhan-Lin Xu; Hong-Hui Teng; Ling-Zi Zhao; Xiao-Bing Cui; Ji-Qing Xu Two new compounds constructed from polyoxoanions, metal ions and organic ligands Inorganica Chimica Acta, 2013, 402, 123-127
1517131	CIF	C60 H58 Co N14 O8	P 1 2/c 1	15.6; 9.6539; 20.651 90; 112.25; 90	2878.5	Guang-Feng Hou; Bo Wen; Ying-Hui Yu; Jin-Sheng Gao; Xiao-Dan Wang; Peng-Fei Yan Two novel 2-fold interpenetration frameworks constructed by 4,4'-bis(1H-imidazol-1-yl-methyl)biphenyl cobalt(II) coordination polymer and the effect of dicarboxylic acid Inorganica Chimica Acta, 2013, 402, 128-132
1517132	CIF	C28 H24 Co N4 O5	I 41/a :2	19.904; 19.904; 26.18 90; 90; 90	10372	Guang-Feng Hou; Bo Wen; Ying-Hui Yu; Jin-Sheng Gao; Xiao-Dan Wang; Peng-Fei Yan Two novel 2-fold interpenetration frameworks constructed by 4,4'-bis(1H-imidazol-1-yl-methyl)biphenyl cobalt(II) coordination polymer and the effect of dicarboxylic acid Inorganica Chimica Acta, 2013, 402, 128-132