Crystallography Open Database

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Searching journal of publication like 'ACS omega' volume of publication is 3

COD ID: 4515854
CIF file Formula: - C25 H26 N2 O2 S2 -
Comments: Gupta, Abhishek Kumar; Kumar, Ashwani; Singh, Ranjit; Devi, Manisha; Dhir, Abhimanew; Pradeep, Chullikkattil P. Facile Synthesis of an Organic Solid State Near-Infrared-Emitter with Large Stokes Shift via Excited-State Intramolecular Proton Transfer. ACS omega 3(10) (2018) 14341-14348
Space group: P -1
Cell volume: 1168.1
Cell parameters: 10.8541; 11.169; 12.0753; 112.082; 94.659; 115.759;  

COD ID: 4515855
CIF file Formula: - C23 H22 N2 O2 S2 -
Comments: Gupta, Abhishek Kumar; Kumar, Ashwani; Singh, Ranjit; Devi, Manisha; Dhir, Abhimanew; Pradeep, Chullikkattil P. Facile Synthesis of an Organic Solid State Near-Infrared-Emitter with Large Stokes Shift via Excited-State Intramolecular Proton Transfer. ACS omega 3(10) (2018) 14341-14348
Space group: P -1
Cell volume: 2116.64
Cell parameters: 10.0414; 15.0433; 15.5315; 93.055; 107.51; 106.789;  

COD ID: 4515856
CIF file Formula: - C15 H15 N O2 S -
Comments: Gupta, Abhishek Kumar; Kumar, Ashwani; Singh, Ranjit; Devi, Manisha; Dhir, Abhimanew; Pradeep, Chullikkattil P. Facile Synthesis of an Organic Solid State Near-Infrared-Emitter with Large Stokes Shift via Excited-State Intramolecular Proton Transfer. ACS omega 3(10) (2018) 14341-14348
Space group: P 21 21 21
Cell volume: 1370.34
Cell parameters: 5.2088; 9.272; 28.3737; 90; 90; 90;  

COD ID: 4515857
CIF file Formula: - C28 H32 B N S2 -
Comments: Li, Sheng-Yong; Sun, Zuo-Bang; Zhao, Cui-Hua Impact of the 2,2'-Bithienyl Framework on the Charge-Transfer Emission of Triarylborane-Based o,o'-Substituted Biaryls. ACS omega 3(10) (2018) 12730-12736
Space group: P 1 21/n 1
Cell volume: 2630.8
Cell parameters: 16.9687; 9.905; 17.5869; 90; 117.124; 90;  

COD ID: 4515858
CIF file Formula: - C40 H40 B N S2 -
Comments: Li, Sheng-Yong; Sun, Zuo-Bang; Zhao, Cui-Hua Impact of the 2,2'-Bithienyl Framework on the Charge-Transfer Emission of Triarylborane-Based o,o'-Substituted Biaryls. ACS omega 3(10) (2018) 12730-12736
Space group: P 21 c n
Cell volume: 3428
Cell parameters: 8.0507; 16.79; 25.3603; 90; 90; 90;  

COD ID: 4515859
CIF file Formula: - C59 H44 Cl3 N2 O2 P2 Ru -
Comments: Mondal, Sandip; Bera, Sachinath; Maity, Suvendu; Ghosh, Prasanta Orthometalated <i>N</i>-(Benzophenoxazine)-<i>o</i>-aminophenol: Phenolato versus Phenoxyl States. ACS omega 3(10) (2018) 13323-13334
Space group: C 1 2/c 1
Cell volume: 10351
Cell parameters: 27.173; 18.901; 23.601; 90; 121.36; 90;  

COD ID: 4515860
CIF file Formula: - C41 H29 Br2 Cl2 N2 O2 Os P -
Comments: Mondal, Sandip; Bera, Sachinath; Maity, Suvendu; Ghosh, Prasanta Orthometalated <i>N</i>-(Benzophenoxazine)-<i>o</i>-aminophenol: Phenolato versus Phenoxyl States. ACS omega 3(10) (2018) 13323-13334
Space group: P -1
Cell volume: 1859.94
Cell parameters: 11.7693; 12.6976; 14.8599; 97.091; 107.794; 113.557;  

COD ID: 4515861
CIF file Formula: - C41 H29 Br2 Cl2 N2 O2 Os P -
Comments: Mondal, Sandip; Bera, Sachinath; Maity, Suvendu; Ghosh, Prasanta Orthometalated <i>N</i>-(Benzophenoxazine)-<i>o</i>-aminophenol: Phenolato versus Phenoxyl States. ACS omega 3(10) (2018) 13323-13334
Space group: P -1
Cell volume: 1792.33
Cell parameters: 11.9432; 12.5744; 14.4985; 99.789; 105.371; 115.439;  

COD ID: 4515862
CIF file Formula: - C67 H54 Cl2 N6 O8 Ru -
Comments: Pal, Poulami; Mukherjee, Shruti; Maity, Dinesh; Baitalik, Sujoy Synthesis, Photophysics, and Switchable Luminescence Properties of a New Class of Ruthenium(II)-Terpyridine Complexes Containing Photoisomerizable Styrylbenzene Units. ACS omega 3(10) (2018) 14526-14537
Space group: P 1 21/c 1
Cell volume: 5866
Cell parameters: 19.593; 17.367; 18.153; 90; 108.269; 90;  

COD ID: 4515863
CIF file Formula: - C14 H9 Br2 N3 -
Comments: Chen, Zhengwang; Liang, Pei; Zheng, Jing; Zhou, Zhonggao; Wen, Xiaowei; Liu, Tanggao; Ye, Min Cyanide-Free Ce(III)-Catalyzed Highly Efficient Synthesis of α-Iminonitriles from 2-Aminopyridines and Nitroalkenes via Intermolecular Dehydration Reaction. ACS omega 3(10) (2018) 12520-12529
Space group: P 1 21/c 1
Cell volume: 1356.3
Cell parameters: 7.3587; 10.0065; 18.5152; 90; 95.836; 90;  

COD ID: 4515864
CIF file Formula: - C20 H18 F N O4 -
Comments: Ramu, Gopathi; Hari Krishna, Namballa; Pawar, Gaurav; Visweswara Sastry, K. N.; Nanubolu, Jagadeesh Babu; Nagendra Babu, Bathini Solvent-Controlled, Tunable Domino Reaction of 3-Ylideneoxindoles with in Situ-Generated α-Aryldiazomethanes: A Facile Access to 3-Spirocyclopropyl-2-oxindole and Pyrazoloquinazolinone Scaffolds. ACS omega 3(10) (2018) 12349-12360
Space group: P 1 21/c 1
Cell volume: 1717
Cell parameters: 6.081; 12.345; 22.898; 90; 93.02; 90;  

COD ID: 4515865
CIF file Formula: - C38 H28 N8 O10 -
Comments: Ramu, Gopathi; Hari Krishna, Namballa; Pawar, Gaurav; Visweswara Sastry, K. N.; Nanubolu, Jagadeesh Babu; Nagendra Babu, Bathini Solvent-Controlled, Tunable Domino Reaction of 3-Ylideneoxindoles with in Situ-Generated α-Aryldiazomethanes: A Facile Access to 3-Spirocyclopropyl-2-oxindole and Pyrazoloquinazolinone Scaffolds. ACS omega 3(10) (2018) 12349-12360
Space group: P 1 21/c 1
Cell volume: 3422.8
Cell parameters: 10.5066; 35.89; 9.3401; 90; 103.633; 90;  

COD ID: 4515866
CIF file Formula: - C49 H60 Br2 Cl2 N8 O4 Pt2 -
Comments: McCready, Matthew S.; Puddephatt, Richard J. Supramolecular Organoplatinum(IV) Chemistry: Dimers and Polymers Formed by Intermolecular Hydrogen Bonding. ACS omega 3(10) (2018) 13621-13629
Space group: P b c n
Cell volume: 5157.1
Cell parameters: 11.8035; 15.125; 28.887; 90; 90; 90;  

COD ID: 4515867
CIF file Formula: - C30 H33 Br N4 O2 Pt -
Comments: McCready, Matthew S.; Puddephatt, Richard J. Supramolecular Organoplatinum(IV) Chemistry: Dimers and Polymers Formed by Intermolecular Hydrogen Bonding. ACS omega 3(10) (2018) 13621-13629
Space group: P 1 21/c 1
Cell volume: 2711.4
Cell parameters: 9.0266; 20.43; 14.744; 90; 94.271; 90;  

COD ID: 4515868
CIF file Formula: - C32 H37 Br Cl2 N4 O2 Pt -
Comments: McCready, Matthew S.; Puddephatt, Richard J. Supramolecular Organoplatinum(IV) Chemistry: Dimers and Polymers Formed by Intermolecular Hydrogen Bonding. ACS omega 3(10) (2018) 13621-13629
Space group: P -1
Cell volume: 1618.2
Cell parameters: 10.258; 10.484; 16.122; 80.57; 80.05; 72.63;  

COD ID: 4515869
CIF file Formula: - C21 H23 Br N4 Pt -
Comments: McCready, Matthew S.; Puddephatt, Richard J. Supramolecular Organoplatinum(IV) Chemistry: Dimers and Polymers Formed by Intermolecular Hydrogen Bonding. ACS omega 3(10) (2018) 13621-13629
Space group: P 1 21/c 1
Cell volume: 1964.1
Cell parameters: 18.083; 12.964; 8.3848; 90; 92.263; 90;  

COD ID: 4515870
CIF file Formula: - C32 H37 Br Cl5 N4 O2 Pt -
Comments: McCready, Matthew S.; Puddephatt, Richard J. Supramolecular Organoplatinum(IV) Chemistry: Dimers and Polymers Formed by Intermolecular Hydrogen Bonding. ACS omega 3(10) (2018) 13621-13629
Space group: P 1 21/n 1
Cell volume: 3614
Cell parameters: 9.7737; 10.0964; 36.9181; 90; 97.239; 90;  

COD ID: 4515871
CIF file Formula: - C32 H40 B Br N4 O3 Pt -
Comments: McCready, Matthew S.; Puddephatt, Richard J. Supramolecular Organoplatinum(IV) Chemistry: Dimers and Polymers Formed by Intermolecular Hydrogen Bonding. ACS omega 3(10) (2018) 13621-13629
Space group: P -1
Cell volume: 1574.96
Cell parameters: 8.8735; 10.971; 17.8017; 94.577; 93.652; 113.547;  

COD ID: 4515872
CIF file Formula: - C37 H50 B Br N4 O4 Pt -
Comments: McCready, Matthew S.; Puddephatt, Richard J. Supramolecular Organoplatinum(IV) Chemistry: Dimers and Polymers Formed by Intermolecular Hydrogen Bonding. ACS omega 3(10) (2018) 13621-13629
Space group: P -1
Cell volume: 1796.64
Cell parameters: 9.8253; 9.9194; 19.4252; 103.365; 95.89; 99.558;  

COD ID: 4515873
CIF file Formula: - C23 H17 N3 O4 S3 -
Comments: Singsardar, Mukta; Mondal, Susmita; Sarkar, Rajib; Hajra, Alakananda (Diacetoxy)iodobenzene-Mediated Regioselective Imidation of Imidazoheterocycles with <i>N</i>-Fluorobenzenesulfonimide. ACS omega 3(10) (2018) 12505-12512
Space group: P 1 21/n 1
Cell volume: 4672
Cell parameters: 12.59; 19.81; 18.88; 90; 97.17; 90;  

COD ID: 4515874
CIF file Formula: - C27 H45 Cl Mo3 O10 S4 -
Comments: Fu, Dong; Fabre, Bruno; Loget, Gabriel; Mériadec, Cristelle; Ababou-Girard, Soraya; Cadot, Emmanuel; Leclerc-Laronze, Nathalie; Marrot, Jérôme; de Ponfilly, Quentin Polyoxothiometalate-Derivatized Silicon Photocathodes for Sunlight-Driven Hydrogen Evolution Reaction. ACS omega 3(10) (2018) 13837-13849
Space group: P 63/m
Cell volume: 5997.1
Cell parameters: 20.702; 20.702; 16.158; 90; 90; 120;  

COD ID: 4515875
CIF file Formula: - C7 H7 N O -
Comments: Pagliari, Anderson B.; Orlando, Tainára; Salbego, Paulo R. S.; Zimmer, Geórgia C; Hörner, Manfredo; Zanatta, Nilo; Bonacorso, Helio G.; Martins, Marcos A. P. Supramolecular Packing of a Series of <i>N</i>-Phenylamides and the Role of NH···O=C Interactions. ACS omega 3(10) (2018) 13850-13861
Space group: C 1 2/c 1
Cell volume: 2504
Cell parameters: 31.177; 6.1229; 14.3335; 90; 113.771; 90;  

COD ID: 4515876
CIF file Formula: - C8 H6 F3 N O -
Comments: Pagliari, Anderson B.; Orlando, Tainára; Salbego, Paulo R. S.; Zimmer, Geórgia C; Hörner, Manfredo; Zanatta, Nilo; Bonacorso, Helio G.; Martins, Marcos A. P. Supramolecular Packing of a Series of <i>N</i>-Phenylamides and the Role of NH···O=C Interactions. ACS omega 3(10) (2018) 13850-13861
Space group: P 1 21 1
Cell volume: 817.4
Cell parameters: 5.1753; 19.084; 8.2765; 90; 90.302; 90;  

COD ID: 4515877
CIF file Formula: - C11 H15 N O -
Comments: Pagliari, Anderson B.; Orlando, Tainára; Salbego, Paulo R. S.; Zimmer, Geórgia C; Hörner, Manfredo; Zanatta, Nilo; Bonacorso, Helio G.; Martins, Marcos A. P. Supramolecular Packing of a Series of <i>N</i>-Phenylamides and the Role of NH···O=C Interactions. ACS omega 3(10) (2018) 13850-13861
Space group: P c a 21
Cell volume: 1079.1
Cell parameters: 9.969; 10.642; 10.172; 90; 90; 90;  

COD ID: 4515878
CIF file Formula: - C8 H9 N O -
Comments: Pagliari, Anderson B.; Orlando, Tainára; Salbego, Paulo R. S.; Zimmer, Geórgia C; Hörner, Manfredo; Zanatta, Nilo; Bonacorso, Helio G.; Martins, Marcos A. P. Supramolecular Packing of a Series of <i>N</i>-Phenylamides and the Role of NH···O=C Interactions. ACS omega 3(10) (2018) 13850-13861
Space group: P b c a
Cell volume: 1425.1
Cell parameters: 9.371; 7.7868; 19.5301; 90; 90; 90;  

COD ID: 4515879
CIF file Formula: - C13 H11 N O -
Comments: Pagliari, Anderson B.; Orlando, Tainára; Salbego, Paulo R. S.; Zimmer, Geórgia C; Hörner, Manfredo; Zanatta, Nilo; Bonacorso, Helio G.; Martins, Marcos A. P. Supramolecular Packing of a Series of <i>N</i>-Phenylamides and the Role of NH···O=C Interactions. ACS omega 3(10) (2018) 13850-13861
Space group: P -1
Cell volume: 499.6
Cell parameters: 5.352; 7.971; 12.471; 73.23; 79.202; 89.85;  

COD ID: 4515880
CIF file Formula: - C8 H6 Br3 N O -
Comments: Pagliari, Anderson B.; Orlando, Tainára; Salbego, Paulo R. S.; Zimmer, Geórgia C; Hörner, Manfredo; Zanatta, Nilo; Bonacorso, Helio G.; Martins, Marcos A. P. Supramolecular Packing of a Series of <i>N</i>-Phenylamides and the Role of NH···O=C Interactions. ACS omega 3(10) (2018) 13850-13861
Space group: P c a 21
Cell volume: 1107.59
Cell parameters: 10.1863; 9.1483; 11.8856; 90; 90; 90;  

COD ID: 4515881
CIF file Formula: - C21 H22 N4 Ni O5 Pb S2 -
Comments: Roy, Sourav; Halder, Soumi; Drew, Michael G. B.; Ray, Partha Pratim; Chattopadhyay, Shouvik Fabrication of an Active Electronic Device Using a Hetero-bimetallic Coordination Polymer. ACS omega 3(10) (2018) 12788-12796
Space group: P 1 21/n 1
Cell volume: 2394.8
Cell parameters: 12.3716; 9.6865; 20.7826; 90; 105.941; 90;  

COD ID: 4515882
CIF file Formula: - C24 H28 O8 -
Comments: Nomura, Eisaku; Noda, Takumi; Gomi, Daiki; Mori, Hajime Substituent Effect on the Formation of Arylindanes by Dimerization of Ferulic Acid and its Related Compounds. ACS omega 3(10) (2018) 12746-12753
Space group: P -1
Cell volume: 1096.03
Cell parameters: 10.60195; 10.75301; 11.3032; 59.987; 80.147; 88.894;  

COD ID: 4515883
CIF file Formula: - C26 H32 O10 -
Comments: Nomura, Eisaku; Noda, Takumi; Gomi, Daiki; Mori, Hajime Substituent Effect on the Formation of Arylindanes by Dimerization of Ferulic Acid and its Related Compounds. ACS omega 3(10) (2018) 12746-12753
Space group: P -1
Cell volume: 1225.25
Cell parameters: 8.7988; 10.50228; 13.8851; 89.745; 76.69; 79.141;  

COD ID: 4515884
CIF file Formula: - C62 H34 Cl2 Co15 N2 O38 Pd9 -
Comments: Berti, Beatrice; Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano Cluster Core Isomerism Induced by Crystal Packing Effects in the [HCo<sub>15</sub>Pd<sub>9</sub>C<sub>3</sub>(CO)<sub>38</sub>]<sup>2-</sup> Molecular Nanocluster. ACS omega 3(10) (2018) 13239-13250
Space group: P 1 21/n 1
Cell volume: 16230
Cell parameters: 13.5461; 25.518; 47.112; 90; 94.719; 90;  

COD ID: 4515885
CIF file Formula: - C63 H36 Cl4 Co15 N2 O38 Pd9 -
Comments: Berti, Beatrice; Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano Cluster Core Isomerism Induced by Crystal Packing Effects in the [HCo<sub>15</sub>Pd<sub>9</sub>C<sub>3</sub>(CO)<sub>38</sub>]<sup>2-</sup> Molecular Nanocluster. ACS omega 3(10) (2018) 13239-13250
Space group: P c a 21
Cell volume: 8573.4
Cell parameters: 25.9095; 12.7628; 25.9267; 90; 90; 90;  

COD ID: 4515886
CIF file Formula: - C68 H46 Cl2 Co15 N2 O38 Pd9 -
Comments: Berti, Beatrice; Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano Cluster Core Isomerism Induced by Crystal Packing Effects in the [HCo<sub>15</sub>Pd<sub>9</sub>C<sub>3</sub>(CO)<sub>38</sub>]<sup>2-</sup> Molecular Nanocluster. ACS omega 3(10) (2018) 13239-13250
Space group: P 1 21/c 1
Cell volume: 8777.7
Cell parameters: 12.9658; 36.928; 18.5192; 90; 98.141; 90;  

COD ID: 4515887
CIF file Formula: - C68 H46 Cl2 Co15 N2 O38 Pd9 -
Comments: Berti, Beatrice; Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano Cluster Core Isomerism Induced by Crystal Packing Effects in the [HCo<sub>15</sub>Pd<sub>9</sub>C<sub>3</sub>(CO)<sub>38</sub>]<sup>2-</sup> Molecular Nanocluster. ACS omega 3(10) (2018) 13239-13250
Space group: P 1 21/c 1
Cell volume: 9029.1
Cell parameters: 13.0934; 37.1883; 18.6966; 90; 97.344; 90;  

COD ID: 4515888
CIF file Formula: - C81.5 H41 Cl5 Co15 O38 P2 Pd9 -
Comments: Berti, Beatrice; Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano Cluster Core Isomerism Induced by Crystal Packing Effects in the [HCo<sub>15</sub>Pd<sub>9</sub>C<sub>3</sub>(CO)<sub>38</sub>]<sup>2-</sup> Molecular Nanocluster. ACS omega 3(10) (2018) 13239-13250
Space group: P -1
Cell volume: 4933.5
Cell parameters: 12.6823; 12.8975; 30.7793; 95.725; 98.686; 94.004;  

COD ID: 4515889
CIF file Formula: - C81.5 H41 Cl5 Co15 O38 P2 Pd9 -
Comments: Berti, Beatrice; Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano Cluster Core Isomerism Induced by Crystal Packing Effects in the [HCo<sub>15</sub>Pd<sub>9</sub>C<sub>3</sub>(CO)<sub>38</sub>]<sup>2-</sup> Molecular Nanocluster. ACS omega 3(10) (2018) 13239-13250
Space group: P -1
Cell volume: 5154.2
Cell parameters: 13.0138; 13.0903; 31.023; 96.767; 99.948; 93.099;  

COD ID: 4515890
CIF file Formula: - C79 H36 Co15 O38 P2 Pd9 -
Comments: Berti, Beatrice; Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano Cluster Core Isomerism Induced by Crystal Packing Effects in the [HCo<sub>15</sub>Pd<sub>9</sub>C<sub>3</sub>(CO)<sub>38</sub>]<sup>2-</sup> Molecular Nanocluster. ACS omega 3(10) (2018) 13239-13250
Space group: R 3 :H
Cell volume: 6913.1
Cell parameters: 18.8375; 18.8375; 22.4956; 90; 90; 120;  

COD ID: 4515891
CIF file Formula: - C79 H36 Co15 O38 P2 Pd9 -
Comments: Berti, Beatrice; Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano Cluster Core Isomerism Induced by Crystal Packing Effects in the [HCo<sub>15</sub>Pd<sub>9</sub>C<sub>3</sub>(CO)<sub>38</sub>]<sup>2-</sup> Molecular Nanocluster. ACS omega 3(10) (2018) 13239-13250
Space group: R 3 :H
Cell volume: 7104.7
Cell parameters: 18.9827; 18.9827; 22.7666; 90; 90; 120;  

COD ID: 4515892
CIF file Formula: - C72 H50 Cl2 Co15 N3 O38 Pd9 -
Comments: Berti, Beatrice; Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano Cluster Core Isomerism Induced by Crystal Packing Effects in the [HCo<sub>15</sub>Pd<sub>9</sub>C<sub>3</sub>(CO)<sub>38</sub>]<sup>2-</sup> Molecular Nanocluster. ACS omega 3(10) (2018) 13239-13250
Space group: P -1
Cell volume: 4589.7
Cell parameters: 12.7371; 13.5459; 28.843; 93.292; 93.675; 111.909;  

COD ID: 4515893
CIF file Formula: - C72 H50 Cl2 Co15 N3 O38 Pd9 -
Comments: Berti, Beatrice; Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano Cluster Core Isomerism Induced by Crystal Packing Effects in the [HCo<sub>15</sub>Pd<sub>9</sub>C<sub>3</sub>(CO)<sub>38</sub>]<sup>2-</sup> Molecular Nanocluster. ACS omega 3(10) (2018) 13239-13250
Space group: P c a 21
Cell volume: 8979.2
Cell parameters: 39.915; 12.8254; 17.5401; 90; 90; 90;  

COD ID: 4515894
CIF file Formula: - C99 H56 Cl2 Co15 O38 P3 Pd9 -
Comments: Berti, Beatrice; Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano Cluster Core Isomerism Induced by Crystal Packing Effects in the [HCo<sub>15</sub>Pd<sub>9</sub>C<sub>3</sub>(CO)<sub>38</sub>]<sup>2-</sup> Molecular Nanocluster. ACS omega 3(10) (2018) 13239-13250
Space group: P -1
Cell volume: 5539.8
Cell parameters: 12.7433; 16.7009; 28.227; 90.39; 94.828; 112.141;  

COD ID: 4515895
CIF file Formula: - C43 H18 Cl2 Co13 N O29 Pd3 -
Comments: Berti, Beatrice; Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano Cluster Core Isomerism Induced by Crystal Packing Effects in the [HCo<sub>15</sub>Pd<sub>9</sub>C<sub>3</sub>(CO)<sub>38</sub>]<sup>2-</sup> Molecular Nanocluster. ACS omega 3(10) (2018) 13239-13250
Space group: P -1
Cell volume: 5800
Cell parameters: 11.9099; 21.2639; 25.6686; 114.096; 90.729; 100.805;  

COD ID: 4515896
CIF file Formula: - C58 H72 Co8 N2 O24 Pd4 -
Comments: Berti, Beatrice; Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano Cluster Core Isomerism Induced by Crystal Packing Effects in the [HCo<sub>15</sub>Pd<sub>9</sub>C<sub>3</sub>(CO)<sub>38</sub>]<sup>2-</sup> Molecular Nanocluster. ACS omega 3(10) (2018) 13239-13250
Space group: P -1
Cell volume: 1809.07
Cell parameters: 11.3488; 13.6232; 14.1177; 62.07; 79.979; 69.75;  

COD ID: 4515897
CIF file Formula: - C58 H72 Co8 N2 O24 Pt4 -
Comments: Berti, Beatrice; Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano Cluster Core Isomerism Induced by Crystal Packing Effects in the [HCo<sub>15</sub>Pd<sub>9</sub>C<sub>3</sub>(CO)<sub>38</sub>]<sup>2-</sup> Molecular Nanocluster. ACS omega 3(10) (2018) 13239-13250
Space group: P -1
Cell volume: 1872.1
Cell parameters: 11.4009; 13.94; 14.213; 62.21; 78.778; 69.642;  

COD ID: 4515898
CIF file Formula: - C0 H0 Cl3 Cu K -
Comments: Zhou, Huawei; Liu, Xuejing; He, Guohang; Fan, Lin; Shi, Shaozhen; Wei, Jiazhen; Xu, Wenli; Yuan, Cang; Chai, Ning; Chen, Baoli; Zhang, Yingtian; Zhang, Xianxi; Zhao, Jinsheng; Wei, Xinting; Yin, Jie; Tian, Dongxu Synthesis, Crystal Structure, UV-Vis Adsorption Properties, Photoelectric Behavior, and DFT Computational Study of All-Inorganic and Lead-Free Copper Halide Salt K<sub>2</sub>Cu<sub>2</sub>Cl<sub>6</sub>. ACS omega 3(10) (2018) 14021-14026
Space group: P 1 21/c 1
Cell volume: 483
Cell parameters: 4.034; 13.7987; 8.7445; 90; 97.123; 90;  

COD ID: 4515899
CIF file Formula: - C38 H36 Cl4 Cu2 N8 O12 Zn2 -
Comments: Majumder, Ishani; Chakraborty, Prateeti; Álvarez, Raquel; Gonzalez-Diaz, Myriam; Peláez, Rafael; Ellahioui, Younes; Bauza, Antonio; Frontera, Antonio; Zangrando, Ennio; Gómez-Ruiz, Santiago; Das, Debasis Bioactive Heterometallic Cu<sup>II</sup>-Zn<sup>II</sup> Complexes with Potential Biomedical Applications. ACS omega 3(10) (2018) 13343-13353
Space group: P 1 21/c 1
Cell volume: 2247.81
Cell parameters: 10.08; 17.9664; 12.4991; 90; 96.773; 90;  

COD ID: 4515900
CIF file Formula: - C42 H36 Cl4 Cu2 N10 O4 Zn -
Comments: Majumder, Ishani; Chakraborty, Prateeti; Álvarez, Raquel; Gonzalez-Diaz, Myriam; Peláez, Rafael; Ellahioui, Younes; Bauza, Antonio; Frontera, Antonio; Zangrando, Ennio; Gómez-Ruiz, Santiago; Das, Debasis Bioactive Heterometallic Cu<sup>II</sup>-Zn<sup>II</sup> Complexes with Potential Biomedical Applications. ACS omega 3(10) (2018) 13343-13353
Space group: P 1 21/c 1
Cell volume: 2121.7
Cell parameters: 10.3783; 20.893; 10.1906; 90; 106.224; 90;  

COD ID: 4515901
CIF file Formula: - C38 H36 Cl4 Cu2 N6 O11 Zn -
Comments: Majumder, Ishani; Chakraborty, Prateeti; Álvarez, Raquel; Gonzalez-Diaz, Myriam; Peláez, Rafael; Ellahioui, Younes; Bauza, Antonio; Frontera, Antonio; Zangrando, Ennio; Gómez-Ruiz, Santiago; Das, Debasis Bioactive Heterometallic Cu<sup>II</sup>-Zn<sup>II</sup> Complexes with Potential Biomedical Applications. ACS omega 3(10) (2018) 13343-13353
Space group: P 1 21/c 1
Cell volume: 2125.4
Cell parameters: 10.0431; 19.9558; 11.4121; 90; 111.678; 90;  

COD ID: 4515902
CIF file Formula: - C38 H36 Cl8 Cu2 N4 O4 Zn2 -
Comments: Majumder, Ishani; Chakraborty, Prateeti; Álvarez, Raquel; Gonzalez-Diaz, Myriam; Peláez, Rafael; Ellahioui, Younes; Bauza, Antonio; Frontera, Antonio; Zangrando, Ennio; Gómez-Ruiz, Santiago; Das, Debasis Bioactive Heterometallic Cu<sup>II</sup>-Zn<sup>II</sup> Complexes with Potential Biomedical Applications. ACS omega 3(10) (2018) 13343-13353
Space group: P 1 21/c 1
Cell volume: 2211.3
Cell parameters: 9.7807; 16.605; 13.616; 90; 90.203; 90;  

COD ID: 4515903
CIF file Formula: - C19 H18 Cl2 Cu N2 O2 -
Comments: Majumder, Ishani; Chakraborty, Prateeti; Álvarez, Raquel; Gonzalez-Diaz, Myriam; Peláez, Rafael; Ellahioui, Younes; Bauza, Antonio; Frontera, Antonio; Zangrando, Ennio; Gómez-Ruiz, Santiago; Das, Debasis Bioactive Heterometallic Cu<sup>II</sup>-Zn<sup>II</sup> Complexes with Potential Biomedical Applications. ACS omega 3(10) (2018) 13343-13353
Space group: P 1 21/n 1
Cell volume: 1850.34
Cell parameters: 6.9256; 23.3181; 11.7998; 90; 103.829; 90;  

COD ID: 4515904
CIF file Formula: - C41 H45 F6 N4 O4 P -
Comments: Greenlee, Andrew J.; Ofosu, Charles K.; Xiao, Qifan; Modan, Mohammed M.; Janzen, Daron E.; Cao, Dennis D. Pyridinium-Functionalized Pyromellitic Diimides with Stabilized Radical Anion States. ACS omega 3(1) (2018) 240-245
Space group: I 1 a 1
Cell volume: 3958.7
Cell parameters: 13.0575; 17.6855; 17.644; 90; 103.694; 90;  

COD ID: 4515905
CIF file Formula: - C19 H25 N3 O5 -
Comments: Hu, Xing-Mei; Luo, Da-Yun; Zi, Quan-Xing; Lin, Jun; Yan, Sheng-Jiao Diastereoselective Synthesis of Morphan Derivatives by Michael and Hetero-Michael Addition of 1,1-Enediamines to Quinone Monoketals. ACS omega 3(1) (2018) 8-21
Space group: C 1 2/c 1
Cell volume: 7794
Cell parameters: 21.969; 17.259; 20.669; 90; 96.021; 90;  

COD ID: 4515906
CIF file Formula: - C18 H22 Cl N3 O5 -
Comments: Hu, Xing-Mei; Luo, Da-Yun; Zi, Quan-Xing; Lin, Jun; Yan, Sheng-Jiao Diastereoselective Synthesis of Morphan Derivatives by Michael and Hetero-Michael Addition of 1,1-Enediamines to Quinone Monoketals. ACS omega 3(1) (2018) 8-21
Space group: P 1 21/n 1
Cell volume: 1891.1
Cell parameters: 7.372; 19.312; 13.785; 90; 105.509; 90;  

COD ID: 4515907
CIF file Formula: - C17 H21 N3 O5 -
Comments: Hu, Xing-Mei; Luo, Da-Yun; Zi, Quan-Xing; Lin, Jun; Yan, Sheng-Jiao Diastereoselective Synthesis of Morphan Derivatives by Michael and Hetero-Michael Addition of 1,1-Enediamines to Quinone Monoketals. ACS omega 3(1) (2018) 8-21
Space group: P 1 21/c 1
Cell volume: 1798
Cell parameters: 17.67; 8.064; 12.926; 90; 102.53; 90;  

COD ID: 4515908
CIF file Formula: - C24 H25 F2 N3 O5 -
Comments: Hu, Xing-Mei; Luo, Da-Yun; Zi, Quan-Xing; Lin, Jun; Yan, Sheng-Jiao Diastereoselective Synthesis of Morphan Derivatives by Michael and Hetero-Michael Addition of 1,1-Enediamines to Quinone Monoketals. ACS omega 3(1) (2018) 8-21
Space group: P -1
Cell volume: 1135.5
Cell parameters: 8.3233; 8.3363; 17.223; 102.674; 97.734; 98.563;  

COD ID: 4515909
CIF file Formula: - C21 H15 Br N2 O2 -
Comments: Leas, Derek A.; Wu, Jianbo; Ezell, Edward L.; Garrison, Jered C.; Vennerstrom, Jonathan L.; Dong, Yuxiang Formation of 2-Imino Benzo[<i>e</i>]-1,3-oxazin-4-ones from Reactions of Salicylic Acids and Anilines with HATU: Mechanistic and Synthetic Studies. ACS omega 3(1) (2018) 781-787
Space group: P 1 21/c 1
Cell volume: 1734.45
Cell parameters: 10.92936; 12.8033; 13.37608; 90; 112.081; 90;  

COD ID: 4515910
CIF file Formula: - C14 H20 O4 -
Comments: Li, Yuelan; Zhu, Rongxiu; Zhang, Jiaozhen; Xie, Fei; Wang, Xiaoning; Xu, Ke; Qiao, Yanan; Zhao, Zuntian; Lou, Hongxiang Ophiosphaerellins A-I, Polyketide-Derived Compounds from the Endolichenic Fungus <i>Ophiosphaerella korrae</i>. ACS omega 3(1) (2018) 176-180
Space group: P 21 21 21
Cell volume: 1412.37
Cell parameters: 9.0317; 10.0478; 15.5635; 90; 90; 90;  

COD ID: 4515911
CIF file Formula: - C14 H20 O3 -
Comments: Li, Yuelan; Zhu, Rongxiu; Zhang, Jiaozhen; Xie, Fei; Wang, Xiaoning; Xu, Ke; Qiao, Yanan; Zhao, Zuntian; Lou, Hongxiang Ophiosphaerellins A-I, Polyketide-Derived Compounds from the Endolichenic Fungus <i>Ophiosphaerella korrae</i>. ACS omega 3(1) (2018) 176-180
Space group: P 41
Cell volume: 1313.04
Cell parameters: 13.4241; 13.4241; 7.2863; 90; 90; 90;  

COD ID: 4515912
CIF file Formula: - C26 H22 O -
Comments: Sahoo, Prakash Kumar; Gawali, Suhas Shahaji; Gunanathan, Chidambaram Iron-Catalyzed Selective Etherification and Transetherification Reactions Using Alcohols. ACS omega 3(1) (2018) 124-136
Space group: P 1 21/n 1
Cell volume: 1996.15
Cell parameters: 9.2774; 22.6668; 9.8223; 90; 104.891; 90;  

COD ID: 4515913
CIF file Formula: - C54 H88 N2 O9 -
Comments: Rodríguez-Fortea, Antonio; Kaleta, Jiří; Mézière, Cécile; Allain, Magali; Canadell, Enric; Wzietek, Pawel; Michl, Josef; Batail, Patrick Asymmetric Choreography in Pairs of Orthogonal Rotors. ACS omega 3(1) (2018) 1293-1297
Space group: C 1 2/c 1
Cell volume: 5399.7
Cell parameters: 22.2703; 15.8902; 15.2838; 90; 93.297; 90;  

COD ID: 4515914
CIF file Formula: - C54 H88 N2 O9 -
Comments: Rodríguez-Fortea, Antonio; Kaleta, Jiří; Mézière, Cécile; Allain, Magali; Canadell, Enric; Wzietek, Pawel; Michl, Josef; Batail, Patrick Asymmetric Choreography in Pairs of Orthogonal Rotors. ACS omega 3(1) (2018) 1293-1297
Space group: C 1 2/c 1
Cell volume: 5475.4
Cell parameters: 22.3412; 15.9121; 15.4268; 90; 93.24; 90;  

COD ID: 4515915
CIF file Formula: - C13 H18 O3 -
Comments: Yadav, Jhillu Singh; Singh, Shweta; Das, Saibal Stereoselective Total Syntheses of Acutifolone A, Bisacutifolone A and B, Pinguisenol, and Isonaviculol. ACS omega 3(1) (2018) 636-647
Space group: P 21 21 21
Cell volume: 1184.7
Cell parameters: 7.1234; 7.7506; 21.457; 90; 90; 90;  

COD ID: 4515916
CIF file Formula: - C16 H9 F5 O -
Comments: Yamada, Shigeyuki; Mitsuda, Akira; Miyano, Kazuya; Tanaka, Tsuyoshi; Morita, Masato; Agou, Tomohiro; Kubota, Toshio; Konno, Tsutomu Development of Novel Solid-State Light-Emitting Materials Based on Pentafluorinated Tolane Fluorophores. ACS omega 3(8) (2018) 9105-9113
Space group: P -1
Cell volume: 703.3
Cell parameters: 6.45; 7.2271; 15.5635; 100.475; 94.555; 97.516;  

COD ID: 4515917
CIF file Formula: - C20 H17 F5 O -
Comments: Yamada, Shigeyuki; Mitsuda, Akira; Miyano, Kazuya; Tanaka, Tsuyoshi; Morita, Masato; Agou, Tomohiro; Kubota, Toshio; Konno, Tsutomu Development of Novel Solid-State Light-Emitting Materials Based on Pentafluorinated Tolane Fluorophores. ACS omega 3(8) (2018) 9105-9113
Space group: P -1
Cell volume: 925.07
Cell parameters: 6.1612; 7.4665; 20.2688; 89.766; 87.758; 83.16;  

COD ID: 4515918
CIF file Formula: - C23 H21 Cl S -
Comments: Vu, Minh Duy; Foo, Ce Qing; Sadeer, Abdul; Shand, Sam S.; Li, Yongxin; Pullarkat, Sumod A. Triflic-Acid-Catalyzed Tandem Allylic Substitution-Cyclization Reaction of Alcohols with Thiophenols-Facile Access to Polysubstituted Thiochromans. ACS omega 3(8) (2018) 8945-8951
Space group: P 1 21/n 1
Cell volume: 1885
Cell parameters: 12.4697; 8.9131; 17.456; 90; 103.685; 90;  

COD ID: 4515919
CIF file Formula: - C18 H6 F8 N4 Ni -
Comments: Pilia, Luca; Shuku, Yoshiaki; Dalgleish, Simon; Awaga, Kunio; Robertson, Neil Structural and Electronic Effects Due to Fluorine Atoms on Dibenzotetraaza-Annulenes Complexes. ACS omega 3(8) (2018) 10074-10083
Space group: P 1 21/n 1
Cell volume: 765.3
Cell parameters: 9.3936; 4.6798; 17.703; 90; 100.44; 90;  

COD ID: 4515920
CIF file Formula: - C18 H6 Cu F8 N4 -
Comments: Pilia, Luca; Shuku, Yoshiaki; Dalgleish, Simon; Awaga, Kunio; Robertson, Neil Structural and Electronic Effects Due to Fluorine Atoms on Dibenzotetraaza-Annulenes Complexes. ACS omega 3(8) (2018) 10074-10083
Space group: P 1 21/n 1
Cell volume: 769.8
Cell parameters: 9.457; 4.715; 17.574; 90; 100.787; 90;  

COD ID: 4515921
CIF file Formula: - C37 H42 Hg4 N15 O13 -
Comments: Lemes, Maykon A.; Stein, Hilarie N.; Gabidullin, Bulat; Steinmann, Stephan N.; Murugesu, Muralee Tetrazine-Based Ligand Transformation Driving Metal-Metal Bond and Mixed-Valence Hg<sup>I</sup>/Hg<sup>II</sup>. ACS omega 3(8) (2018) 10273-10277
Space group: P -1
Cell volume: 2346.9
Cell parameters: 13.3372; 13.4107; 15.8542; 66.936; 65.477; 73.256;  

COD ID: 4515922
CIF file Formula: - C42 H97 Cl N24 O36 -
Comments: Wang, Xin-Xin; Tian, Fei-Yang; Chen, Kai; Zhang, Yun-Qian; Tao, Zhu; Zhu, Qian-Jiang Hexamethylcucurbit[3,3]uril-Based Porous Supramolecular Assemblies and Their Adsorption Properties. ACS omega 3(8) (2018) 9827-9833
Space group: P -1
Cell volume: 6612
Cell parameters: 16.4068; 21.1877; 21.5464; 94.827; 105.616; 110.717;  

COD ID: 4515923
CIF file Formula: - C40 H34 Cu2 N6 O18 -
Comments: Hossain, Anowar; Dey, Arka; Seth, Saikat Kumar; Ray, Partha Pratim; Ballester, Pablo; Pritchard, Robin G.; Ortega-Castro, Joaquín; Frontera, Antonio; Mukhopadhyay, Subrata Enhanced Photosensitive Schottky Diode Behavior of Pyrazine over 2-Aminopyrimidine Ligand in Copper(II)-Phthalate MOFs: Experimental and Theoretical Rationalization. ACS omega 3(8) (2018) 9160-9171
Space group: P 1 21/n 1
Cell volume: 2069.73
Cell parameters: 10.8505; 10.467; 18.8893; 90; 105.253; 90;  

COD ID: 4515924
CIF file Formula: - C20 H18 Cu N2 O10 -
Comments: Hossain, Anowar; Dey, Arka; Seth, Saikat Kumar; Ray, Partha Pratim; Ballester, Pablo; Pritchard, Robin G.; Ortega-Castro, Joaquín; Frontera, Antonio; Mukhopadhyay, Subrata Enhanced Photosensitive Schottky Diode Behavior of Pyrazine over 2-Aminopyrimidine Ligand in Copper(II)-Phthalate MOFs: Experimental and Theoretical Rationalization. ACS omega 3(8) (2018) 9160-9171
Space group: C 1 2/c 1
Cell volume: 2015.9
Cell parameters: 16.9098; 11.4225; 10.4825; 90; 95.3601; 90;  

COD ID: 4515925
CIF file Formula: - C7 H10 N4 -
Comments: Tinson, Ryan A. J.; Hughes, David L.; Ward, Leanne; Stephenson, G. Richard Unusual Nucleophilic Addition of Grignard Reagents in the Synthesis of 4-Amino-pyrimidines. ACS omega 3(8) (2018) 8937-8944
Space group: P 1 21/n 1
Cell volume: 832.89
Cell parameters: 9.3247; 8.2469; 10.8377; 90; 92.037; 90;  

COD ID: 4515926
CIF file Formula: - C16 H9 N O2 S -
Comments: Lohar, Somenath; Dhara, Koushik; Roy, Priya; Sinha Babu, Santi P.; Chattopadhyay, Pabitra Highly Sensitive Ratiometric Chemosensor and Biomarker for Cyanide Ions in the Aqueous Medium. ACS omega 3(8) (2018) 10145-10153
Space group: P 1 21/n 1
Cell volume: 1232.19
Cell parameters: 6.6437; 9.4377; 19.9115; 90; 99.266; 90;  

COD ID: 4515927
CIF file Formula: - C34 H24 N2 O7 S2 -
Comments: Lohar, Somenath; Dhara, Koushik; Roy, Priya; Sinha Babu, Santi P.; Chattopadhyay, Pabitra Highly Sensitive Ratiometric Chemosensor and Biomarker for Cyanide Ions in the Aqueous Medium. ACS omega 3(8) (2018) 10145-10153
Space group: P -1
Cell volume: 1581.07
Cell parameters: 7.3648; 12.6013; 17.9669; 71.88; 86.822; 86.863;  

COD ID: 4515928
CIF file Formula: - C46 H46 N2 O11 -
Comments: Fang, Jing; Zhang, Qi; Li, Meiqi; Wang, Jian-Rong; Mei, Xuefeng Isostructural Solvates of Naturally Occurring Allocryptopine Exhibit Both Mechanochromic and Hydrochromic Luminescent Properties. ACS omega 3(8) (2018) 9220-9226
Space group: P 1 21/n 1
Cell volume: 2007.99
Cell parameters: 10.8577; 14.2462; 13.918; 90; 111.138; 90;  

COD ID: 4515929
CIF file Formula: - C45 H46 N3 O11 -
Comments: Fang, Jing; Zhang, Qi; Li, Meiqi; Wang, Jian-Rong; Mei, Xuefeng Isostructural Solvates of Naturally Occurring Allocryptopine Exhibit Both Mechanochromic and Hydrochromic Luminescent Properties. ACS omega 3(8) (2018) 9220-9226
Space group: P 1 21/n 1
Cell volume: 2004.7
Cell parameters: 10.6658; 14.335; 13.962; 90; 110.1; 90;  

COD ID: 4515930
CIF file Formula: - C45 H46 N2 O11 -
Comments: Fang, Jing; Zhang, Qi; Li, Meiqi; Wang, Jian-Rong; Mei, Xuefeng Isostructural Solvates of Naturally Occurring Allocryptopine Exhibit Both Mechanochromic and Hydrochromic Luminescent Properties. ACS omega 3(8) (2018) 9220-9226
Space group: P 1 21/n 1
Cell volume: 1984.3
Cell parameters: 10.5721; 14.2791; 13.9602; 90; 109.686; 90;  

COD ID: 4515931
CIF file Formula: - C52 H29 F9 N6 Pt -
Comments: Alemayehu, Abraham B.; McCormick, Laura J.; Gagnon, Kevin J.; Borisov, Sergey M.; Ghosh, Abhik Stable Platinum(IV) Corroles: Synthesis, Molecular Structure, and Room-Temperature Near-IR Phosphorescence. ACS omega 3(8) (2018) 9360-9368
Space group: C 1 2/c 1
Cell volume: 4164.3
Cell parameters: 18.9584; 16.8577; 14.0096; 90; 111.553; 90;  

COD ID: 4515932
CIF file Formula: - C49 H32 N6 Pt -
Comments: Alemayehu, Abraham B.; McCormick, Laura J.; Gagnon, Kevin J.; Borisov, Sergey M.; Ghosh, Abhik Stable Platinum(IV) Corroles: Synthesis, Molecular Structure, and Room-Temperature Near-IR Phosphorescence. ACS omega 3(8) (2018) 9360-9368
Space group: P -1
Cell volume: 1795.9
Cell parameters: 9.4792; 12.0922; 16.675; 109.102; 95.415; 90.85;  

COD ID: 4515933
CIF file Formula: - C24 H30 N2 O4 -
Comments: Reddy, Chatrala Ravikumar; Sridhar, Balasubramanian; V Subba Reddy, Basi Ru(II)-Catalyzed Oxidative Functionalization of Arylhydrazine-1,2-dicarboxylates with Internal Alkynes for the Synthesis of Enecarbamates. ACS omega 3(8) (2018) 9746-9753
Space group: P -1
Cell volume: 1142.53
Cell parameters: 8.0473; 11.4044; 13.7456; 70.394; 75.041; 79.862;  

COD ID: 4515934
CIF file Formula: - C21 H24 N2 O5 -
Comments: Reddy, Chatrala Ravikumar; Sridhar, Balasubramanian; V Subba Reddy, Basi Ru(II)-Catalyzed Oxidative Functionalization of Arylhydrazine-1,2-dicarboxylates with Internal Alkynes for the Synthesis of Enecarbamates. ACS omega 3(8) (2018) 9746-9753
Space group: P -1
Cell volume: 980.27
Cell parameters: 8.9744; 9.5414; 11.6948; 95.027; 97.388; 96.992;  

COD ID: 4515935
CIF file Formula: - C14 H18 I2 N2 O Pt -
Comments: Fard, Mahmood A.; Behnia, Ava; Puddephatt, Richard J. Supramolecular Polymer and Sheet and a Double Cubane Structure in Platinum(IV) Iodide Chemistry: Solution of a Longstanding Puzzle. ACS omega 3(8) (2018) 10267-10272
Space group: P b c a
Cell volume: 3492
Cell parameters: 7.942; 19.31; 22.77; 90; 90; 90;  

COD ID: 4515936
CIF file Formula: - C17 H24 I2 N2 O2 Pt -
Comments: Fard, Mahmood A.; Behnia, Ava; Puddephatt, Richard J. Supramolecular Polymer and Sheet and a Double Cubane Structure in Platinum(IV) Iodide Chemistry: Solution of a Longstanding Puzzle. ACS omega 3(8) (2018) 10267-10272
Space group: P 1 21/c 1
Cell volume: 2107.3
Cell parameters: 11.333; 13.086; 14.249; 90; 94.272; 90;  

COD ID: 4515937
CIF file Formula: - C10 H30 I6 Pt4 -
Comments: Fard, Mahmood A.; Behnia, Ava; Puddephatt, Richard J. Supramolecular Polymer and Sheet and a Double Cubane Structure in Platinum(IV) Iodide Chemistry: Solution of a Longstanding Puzzle. ACS omega 3(8) (2018) 10267-10272
Space group: P -1
Cell volume: 627.9
Cell parameters: 8.361; 8.63; 10.095; 92.018; 113.755; 106.974;  

COD ID: 4515938
CIF file Formula: - C11 H10 Cl2 O3 -
Comments: Dethe, Dattatraya H.; Boda, Raghavender Synthetic Studies toward the Natural Product Tripartin, the First Natural Histone Lysine Demethylase Inhibitor. ACS omega 3(8) (2018) 9303-9309
Space group: C 1 2/c 1
Cell volume: 2185.3
Cell parameters: 17.4884; 7.707; 16.2535; 90; 94.034; 90;  

COD ID: 4515939
CIF file Formula: - C12 H34 B12 N4 -
Comments: Kelley, Steven P.; Rachiero, Giovanni P.; Titi, Hatem M.; Rogers, Robin D. New Reactions for Old Ions: Cage Rearrangements, Hydrolysis, and Two-Electron Reduction of <i>nido</i>-Decaborane in Neat 1-Ethyl-3-Methylimidazolium Acetate. ACS omega 3(8) (2018) 8491-8496
Space group: P 1 21/c 1
Cell volume: 2189.9
Cell parameters: 15.002; 8.676; 16.83; 90; 91.384; 90;  

COD ID: 4515940
CIF file Formula: - C12 H32 B10 N4 -
Comments: Kelley, Steven P.; Rachiero, Giovanni P.; Titi, Hatem M.; Rogers, Robin D. New Reactions for Old Ions: Cage Rearrangements, Hydrolysis, and Two-Electron Reduction of <i>nido</i>-Decaborane in Neat 1-Ethyl-3-Methylimidazolium Acetate. ACS omega 3(8) (2018) 8491-8496
Space group: C 1 2/c 1
Cell volume: 2140.4
Cell parameters: 14.0962; 10.5765; 14.3649; 90; 91.92; 90;  

COD ID: 4515941
CIF file Formula: - C14 H38 B10 N4 O2 -
Comments: Kelley, Steven P.; Rachiero, Giovanni P.; Titi, Hatem M.; Rogers, Robin D. New Reactions for Old Ions: Cage Rearrangements, Hydrolysis, and Two-Electron Reduction of <i>nido</i>-Decaborane in Neat 1-Ethyl-3-Methylimidazolium Acetate. ACS omega 3(8) (2018) 8491-8496
Space group: P 1 21/c 1
Cell volume: 2407.8
Cell parameters: 9.553; 28.914; 9.7711; 90; 116.859; 90;  

COD ID: 4515942
CIF file Formula: - C27 H21 B3 Cl6 F6 N4 O3 -
Comments: Zhang, Xiaohong; Shi, Jun; Song, Jintong; Wang, Man; Xu, Xuemei; Qu, Lang; Zhou, Xiangge; Xiang, Haifeng Nonconjugated Fluorescent Molecular Cages of Trinuclear Fluoroborate Complexes with Salicylaldehyde-Based Schiff Base Ligands. ACS omega 3(8) (2018) 8992-9002
Space group: P 1 21/n 1
Cell volume: 3295.84
Cell parameters: 14.8016; 12.2438; 18.4551; 90; 99.793; 90;  

COD ID: 4515943
CIF file Formula: - C27 H27 B3 F6 N4 O3 -
Comments: Zhang, Xiaohong; Shi, Jun; Song, Jintong; Wang, Man; Xu, Xuemei; Qu, Lang; Zhou, Xiangge; Xiang, Haifeng Nonconjugated Fluorescent Molecular Cages of Trinuclear Fluoroborate Complexes with Salicylaldehyde-Based Schiff Base Ligands. ACS omega 3(8) (2018) 8992-9002
Space group: P 1 21/c 1
Cell volume: 2745.94
Cell parameters: 11.6042; 17.3471; 13.6414; 90; 90.3913; 90;  

COD ID: 4515944
CIF file Formula: - C29 H21 N O2 -
Comments: Baig, Moghal Zubair Khalid; Prusti, Banchhanidhi; Roy, Durba; Sahu, Prabhat Kumar; Sarkar, Moloy; Sharma, Aayushi; Chakravarty, Manab Weak Donor-/Strong Acceptor-Linked Anthracenyl π-Conjugates as Solvato(fluoro)chromophore and AEEgens: Contrast between Nitro and Cyano Functionality. ACS omega 3(8) (2018) 9114-9125
Space group: P -1
Cell volume: 1054.98
Cell parameters: 8.25787; 8.7682; 15.6385; 96.208; 97.1322; 108.099;  

COD ID: 4515945
CIF file Formula: - C31 H25 N O2 -
Comments: Baig, Moghal Zubair Khalid; Prusti, Banchhanidhi; Roy, Durba; Sahu, Prabhat Kumar; Sarkar, Moloy; Sharma, Aayushi; Chakravarty, Manab Weak Donor-/Strong Acceptor-Linked Anthracenyl π-Conjugates as Solvato(fluoro)chromophore and AEEgens: Contrast between Nitro and Cyano Functionality. ACS omega 3(8) (2018) 9114-9125
Space group: P -1
Cell volume: 1121
Cell parameters: 8.0332; 8.569; 18.521; 86.059; 79.08; 63.59;  

COD ID: 4515946
CIF file Formula: - C32 H25 N -
Comments: Baig, Moghal Zubair Khalid; Prusti, Banchhanidhi; Roy, Durba; Sahu, Prabhat Kumar; Sarkar, Moloy; Sharma, Aayushi; Chakravarty, Manab Weak Donor-/Strong Acceptor-Linked Anthracenyl π-Conjugates as Solvato(fluoro)chromophore and AEEgens: Contrast between Nitro and Cyano Functionality. ACS omega 3(8) (2018) 9114-9125
Space group: P -1
Cell volume: 1136.33
Cell parameters: 8.5961; 11.2877; 12.684; 110.581; 95.048; 95.743;  

COD ID: 4515947
CIF file Formula: - C31 H25 N O2 -
Comments: Baig, Moghal Zubair Khalid; Prusti, Banchhanidhi; Roy, Durba; Sahu, Prabhat Kumar; Sarkar, Moloy; Sharma, Aayushi; Chakravarty, Manab Weak Donor-/Strong Acceptor-Linked Anthracenyl π-Conjugates as Solvato(fluoro)chromophore and AEEgens: Contrast between Nitro and Cyano Functionality. ACS omega 3(8) (2018) 9114-9125
Space group: P 1 21/c 1
Cell volume: 2245.6
Cell parameters: 19.4514; 8.0224; 14.5787; 90; 99.218; 90;  

COD ID: 4515948
CIF file Formula: - C31 H26 -
Comments: Baig, Moghal Zubair Khalid; Prusti, Banchhanidhi; Roy, Durba; Sahu, Prabhat Kumar; Sarkar, Moloy; Sharma, Aayushi; Chakravarty, Manab Weak Donor-/Strong Acceptor-Linked Anthracenyl π-Conjugates as Solvato(fluoro)chromophore and AEEgens: Contrast between Nitro and Cyano Functionality. ACS omega 3(8) (2018) 9114-9125
Space group: P -1
Cell volume: 1073.66
Cell parameters: 8.9806; 11.4991; 11.998; 114.199; 96.923; 102.313;  

COD ID: 4515949
CIF file Formula: - C27 H34 Cl N O3 -
Comments: Aghazadeh Meshgi, Mohammad; Zaitsev, Kirill V.; Vener, Mikhail V.; Churakov, Andrei V.; Baumgartner, Judith; Marschner, Christoph Hypercoordinated Oligosilanes Based on Aminotrisphenols. ACS omega 3(8) (2018) 10317-10330
Space group: F d d 2
Cell volume: 10071
Cell parameters: 25.666; 46.332; 8.4689; 90; 90; 90;  

COD ID: 4515950
CIF file Formula: - C18 H12 Cl N O3 Si -
Comments: Aghazadeh Meshgi, Mohammad; Zaitsev, Kirill V.; Vener, Mikhail V.; Churakov, Andrei V.; Baumgartner, Judith; Marschner, Christoph Hypercoordinated Oligosilanes Based on Aminotrisphenols. ACS omega 3(8) (2018) 10317-10330
Space group: P 1 21/n 1
Cell volume: 1517.4
Cell parameters: 9.2802; 14.072; 11.6193; 90; 90.084; 90;  

COD ID: 4515951
CIF file Formula: - C54 H60 N2 O7 Si2 -
Comments: Aghazadeh Meshgi, Mohammad; Zaitsev, Kirill V.; Vener, Mikhail V.; Churakov, Andrei V.; Baumgartner, Judith; Marschner, Christoph Hypercoordinated Oligosilanes Based on Aminotrisphenols. ACS omega 3(8) (2018) 10317-10330
Space group: R -3 :H
Cell volume: 4418.7
Cell parameters: 14.414; 14.414; 24.558; 90; 90; 120;  

COD ID: 4515952
CIF file Formula: - C27 H39 N O3 Si5 -
Comments: Aghazadeh Meshgi, Mohammad; Zaitsev, Kirill V.; Vener, Mikhail V.; Churakov, Andrei V.; Baumgartner, Judith; Marschner, Christoph Hypercoordinated Oligosilanes Based on Aminotrisphenols. ACS omega 3(8) (2018) 10317-10330
Space group: C 1 2/c 1
Cell volume: 12903
Cell parameters: 60.459; 12.913; 16.786; 90; 100.08; 90;  

COD ID: 4515953
CIF file Formula: - C37 H69 N O3 Si10 -
Comments: Aghazadeh Meshgi, Mohammad; Zaitsev, Kirill V.; Vener, Mikhail V.; Churakov, Andrei V.; Baumgartner, Judith; Marschner, Christoph Hypercoordinated Oligosilanes Based on Aminotrisphenols. ACS omega 3(8) (2018) 10317-10330
Space group: P 1 21/c 1
Cell volume: 5032.2
Cell parameters: 19.675; 13.965; 18.335; 90; 92.701; 90;  

COD ID: 4515954
CIF file Formula: - C40 H65 N O4 Si5 -
Comments: Aghazadeh Meshgi, Mohammad; Zaitsev, Kirill V.; Vener, Mikhail V.; Churakov, Andrei V.; Baumgartner, Judith; Marschner, Christoph Hypercoordinated Oligosilanes Based on Aminotrisphenols. ACS omega 3(8) (2018) 10317-10330
Space group: P -1
Cell volume: 4482
Cell parameters: 13.822; 17.584; 20.129; 87.588; 75.904; 70.969;  

COD ID: 4515955
CIF file Formula: - C36 H57 N O3 Si5 -
Comments: Aghazadeh Meshgi, Mohammad; Zaitsev, Kirill V.; Vener, Mikhail V.; Churakov, Andrei V.; Baumgartner, Judith; Marschner, Christoph Hypercoordinated Oligosilanes Based on Aminotrisphenols. ACS omega 3(8) (2018) 10317-10330
Space group: P -3 c 1
Cell volume: 3972.7
Cell parameters: 14.3849; 14.3849; 22.169; 90; 90; 120;  

COD ID: 4515956
CIF file Formula: - C26 H17 N3 O5 -
Comments: Mupparapu, Nagaraju; Khan, Shahnawaz; Bandhoria, Pankaj; Athimoolam, Shunmuganarayanan; Ahmed, Qazi Naveed One-Pot Tandem Approach to Functionalized 3-Hydroxy-2-furanyl-acrylamides. ACS omega 3(5) (2018) 5445-5452
Space group: P b c a
Cell volume: 4546
Cell parameters: 13.19; 16.96; 20.32; 90; 90; 90;  

COD ID: 4515957
CIF file Formula: - C26 H16 Br2 N2 O3 -
Comments: Mupparapu, Nagaraju; Khan, Shahnawaz; Bandhoria, Pankaj; Athimoolam, Shunmuganarayanan; Ahmed, Qazi Naveed One-Pot Tandem Approach to Functionalized 3-Hydroxy-2-furanyl-acrylamides. ACS omega 3(5) (2018) 5445-5452
Space group: P 1 21/c 1
Cell volume: 2271
Cell parameters: 13.399; 10.904; 16.85; 90; 112.68; 90;  

COD ID: 4515958
CIF file Formula: - C12 H16 N4 O2 S -
Comments: Yan, Xiao-Sheng; Luo, Huan; Zou, Kun-Shan; Cao, Jin-Lian; Li, Zhao; Jiang, Yun-Bao Short Azapeptides of Folded Structures in Aqueous Solutions. ACS omega 3(5) (2018) 4786-4790
Space group: P 21 21 21
Cell volume: 1401.79
Cell parameters: 7.661; 7.8138; 23.4172; 90; 90; 90;  

COD ID: 4515959
CIF file Formula: - C15 H24 N4 O3 S -
Comments: Yan, Xiao-Sheng; Luo, Huan; Zou, Kun-Shan; Cao, Jin-Lian; Li, Zhao; Jiang, Yun-Bao Short Azapeptides of Folded Structures in Aqueous Solutions. ACS omega 3(5) (2018) 4786-4790
Space group: P 1 21 1
Cell volume: 906.61
Cell parameters: 10.0167; 7.5935; 12.506; 90; 107.618; 90;  

COD ID: 4515960
CIF file Formula: - C19 H24 N4 O3 S -
Comments: Yan, Xiao-Sheng; Luo, Huan; Zou, Kun-Shan; Cao, Jin-Lian; Li, Zhao; Jiang, Yun-Bao Short Azapeptides of Folded Structures in Aqueous Solutions. ACS omega 3(5) (2018) 4786-4790
Space group: P 21 21 2
Cell volume: 1957.6
Cell parameters: 19.453; 7.6077; 13.2277; 90; 90; 90;  

COD ID: 4515961
CIF file Formula: - C46 H38 O2 -
Comments: Liu, Rui; Ran, Huijuan; Zhao, Zhen; Yang, Xueli; Zhang, Jiali; Chen, Lijuan; Sun, Huaming; Hu, Jian-Yong Synthesis and Optical Properties of Donor-Acceptor-Type 1,3,5,9-Tetraarylpyrenes: Controlling Intramolecular Charge-Transfer Pathways by the Change of π-Conjugation Directions for Emission Color Modulations. ACS omega 3(5) (2018) 5866-5875
Space group: P -1
Cell volume: 6704
Cell parameters: 11.561; 20.663; 28.603; 99.883; 90.591; 94.939;  

COD ID: 4515962
CIF file Formula: - C46 H34 O2 -
Comments: Liu, Rui; Ran, Huijuan; Zhao, Zhen; Yang, Xueli; Zhang, Jiali; Chen, Lijuan; Sun, Huaming; Hu, Jian-Yong Synthesis and Optical Properties of Donor-Acceptor-Type 1,3,5,9-Tetraarylpyrenes: Controlling Intramolecular Charge-Transfer Pathways by the Change of π-Conjugation Directions for Emission Color Modulations. ACS omega 3(5) (2018) 5866-5875
Space group: R -3 :H
Cell volume: 15240.2
Cell parameters: 51.797; 51.797; 6.5592; 90; 90; 120;  

COD ID: 4515963
CIF file Formula: - C44 H65 B Cl7 Co N9 O3 -
Comments: Pavlov, Alexander A.; Savkina, Svetlana A.; Belov, Alexander S.; Voloshin, Yan Z.; Nelyubina, Yulia V.; Novikov, Valentin V. Very Large Magnetic Anisotropy of Cage Cobalt(II) Complexes with a Rigid Cholesteryl Substituent from Paramagnetic NMR Spectroscopy. ACS omega 3(5) (2018) 4941-4946
Space group: P 1 21 1
Cell volume: 2594.6
Cell parameters: 13.8545; 8.0296; 23.616; 90; 99.037; 90;  

COD ID: 4515964
CIF file Formula: - C48 H66 B Cl Co N6 O7 -
Comments: Pavlov, Alexander A.; Savkina, Svetlana A.; Belov, Alexander S.; Voloshin, Yan Z.; Nelyubina, Yulia V.; Novikov, Valentin V. Very Large Magnetic Anisotropy of Cage Cobalt(II) Complexes with a Rigid Cholesteryl Substituent from Paramagnetic NMR Spectroscopy. ACS omega 3(5) (2018) 4941-4946
Space group: P 1
Cell volume: 2310.7
Cell parameters: 10.867; 10.9382; 22.644; 90.95; 103.366; 116.98;  

COD ID: 4515965
CIF file Formula: - C20 H24 N O P -
Comments: Soengas, Raquel; Belmonte Sánchez, Eva; Iglesias, María José; López Ortiz, Fernando Synthesis of P-Stereogenic Benzoazaphosphole 1-Oxides via Alkynylation of P-Stereogenic ortho-Aurated and ortho-Iodo Phosphinic Amides. ACS omega 3(5) (2018) 5116-5124
Space group: P 1 21 1
Cell volume: 879.4
Cell parameters: 9.384; 11.242; 9.451; 90; 118.112; 90;  

COD ID: 4515966
CIF file Formula: - C20 H28 Cl N O P Sn -
Comments: Soengas, Raquel; Belmonte Sánchez, Eva; Iglesias, María José; López Ortiz, Fernando Synthesis of P-Stereogenic Benzoazaphosphole 1-Oxides via Alkynylation of P-Stereogenic ortho-Aurated and ortho-Iodo Phosphinic Amides. ACS omega 3(5) (2018) 5116-5124
Space group: P 21 21 21
Cell volume: 2209.4
Cell parameters: 9.4402; 15.011; 15.5913; 90; 90; 90;  

COD ID: 4515967
CIF file Formula: - C25 H26 N2 O2 -
Comments: Kim, Sonam; Lee, Hyuck Jin; Nam, Eunju; Jeong, Donghyun; Cho, Jaeheung; Lim, Mi Hee; You, Youngmin Tailoring Hydrophobic Interactions between Probes and Amyloid-β Peptides for Fluorescent Monitoring of Amyloid-β Aggregation. ACS omega 3(5) (2018) 5141-5154
Space group: P 1 21/n 1
Cell volume: 2041.5
Cell parameters: 7.8531; 7.4811; 34.767; 90; 91.88; 90;  

COD ID: 4515968
CIF file Formula: - C27 H18 F2 N2 -
Comments: Adak, Anirban; Panda, Tamas; Raveendran, Anju; Bejoymohandas, Kochan Sathyaseelan; Asha, K. S.; Prakasham, A. P.; Mukhopadhyay, Balaram; Panda, Manas K. Distinct Mechanoresponsive Luminescence, Thermochromism, Vapochromism, and Chlorine Gas Sensing by a Solid-State Organic Emitter. ACS omega 3(5) (2018) 5291-5300
Space group: P -1
Cell volume: 3155.3
Cell parameters: 9.8032; 10.2942; 32.2199; 84.987; 82.061; 79.035;  

COD ID: 4515969
CIF file Formula: - C22 H28 N2 O3 -
Comments: Kalshetti, Manojkumar G.; Argade, Narshinha P. Diastereoselective Synthesis of (±)-<i>epi</i>-Subincanadine C. ACS omega 3(5) (2018) 5308-5316
Space group: P 21 21 21
Cell volume: 1936.7
Cell parameters: 8.1549; 14.3911; 16.5026; 90; 90; 90;  

COD ID: 4515970
CIF file Formula: - C22 H26 N2 O -
Comments: Kalshetti, Manojkumar G.; Argade, Narshinha P. Diastereoselective Synthesis of (±)-<i>epi</i>-Subincanadine C. ACS omega 3(5) (2018) 5308-5316
Space group: P 1 21/c 1
Cell volume: 1842.5
Cell parameters: 6.8071; 23.863; 11.839; 90; 106.646; 90;  

COD ID: 4515971
CIF file Formula: - C64 H28.36 Cl8 Cu I7.64 N7 -
Comments: Thomassen, Ivar K.; McCormick, Laura J.; Ghosh, Abhik Synthesis and Molecular Structure of a Copper Octaiodocorrole. ACS omega 3(5) (2018) 5106-5110
Space group: P -1
Cell volume: 3308.7
Cell parameters: 13.9951; 14.273; 17.845; 111.769; 91.652; 90.047;  

COD ID: 4515972
CIF file Formula: - C30 H29 N O2 -
Comments: Yang, Ren-Yin; Sun, Jing; Yan, Chao-Guo HOAc-Mediated Domino Diels-Alder Reaction for Synthesis of Spiro[cyclohexane-1,3'-indolines] in Ionic Liquid [Bmim]Br. ACS omega 3(5) (2018) 5406-5416
Space group: P -1
Cell volume: 1205.56
Cell parameters: 9.3213; 10.4713; 13.69; 74.53; 72.545; 75.112;  

COD ID: 4515973
CIF file Formula: - C40 H33 N O2 -
Comments: Yang, Ren-Yin; Sun, Jing; Yan, Chao-Guo HOAc-Mediated Domino Diels-Alder Reaction for Synthesis of Spiro[cyclohexane-1,3'-indolines] in Ionic Liquid [Bmim]Br. ACS omega 3(5) (2018) 5406-5416
Space group: P -1
Cell volume: 1528.8
Cell parameters: 10.7035; 11.4095; 14.0481; 73.172; 79.467; 69.183;  

COD ID: 4515974
CIF file Formula: - C40 H32 Cl N O2 -
Comments: Yang, Ren-Yin; Sun, Jing; Yan, Chao-Guo HOAc-Mediated Domino Diels-Alder Reaction for Synthesis of Spiro[cyclohexane-1,3'-indolines] in Ionic Liquid [Bmim]Br. ACS omega 3(5) (2018) 5406-5416
Space group: P -1
Cell volume: 1591.1
Cell parameters: 10.5416; 12.2467; 14.2079; 68.214; 81.502; 69.115;  

COD ID: 4515975
CIF file Formula: - C34 H36 F N O3 -
Comments: Yang, Ren-Yin; Sun, Jing; Yan, Chao-Guo HOAc-Mediated Domino Diels-Alder Reaction for Synthesis of Spiro[cyclohexane-1,3'-indolines] in Ionic Liquid [Bmim]Br. ACS omega 3(5) (2018) 5406-5416
Space group: P 1 21/n 1
Cell volume: 2852.7
Cell parameters: 11.358; 17.3299; 14.9918; 90; 104.821; 90;  

COD ID: 4515976
CIF file Formula: - C32 H23 N O4 -
Comments: Yang, Ren-Yin; Sun, Jing; Yan, Chao-Guo HOAc-Mediated Domino Diels-Alder Reaction for Synthesis of Spiro[cyclohexane-1,3'-indolines] in Ionic Liquid [Bmim]Br. ACS omega 3(5) (2018) 5406-5416
Space group: P -1
Cell volume: 1251
Cell parameters: 10.1699; 11.6903; 12.6092; 96.819; 108.525; 113.464;  

COD ID: 4515977
CIF file Formula: - C16 H34 Br N Ni P2 -
Comments: Wellala, Nadeesha P. N.; Luebking, John D.; Krause, Jeanette A.; Guan, Hairong Roles of Hydrogen Bonding in Proton Transfer to κ<sup>P</sup>,κ<sup>N</sup>,κ<sup>P</sup>-N(CH<sub>2</sub>CH<sub>2</sub>P <i> <sup>i</sup> </i> Pr<sub>2</sub>)<sub>2</sub>-Ligated Nickel Pincer Complexes. ACS omega 3(5) (2018) 4986-5001
Space group: P 1 21 1
Cell volume: 2100.5
Cell parameters: 10.7169; 14.4134; 13.8384; 90; 100.691; 90;  

COD ID: 4515978
CIF file Formula: - C16 H37 Br2 N Ni P2 -
Comments: Wellala, Nadeesha P. N.; Luebking, John D.; Krause, Jeanette A.; Guan, Hairong Roles of Hydrogen Bonding in Proton Transfer to κ<sup>P</sup>,κ<sup>N</sup>,κ<sup>P</sup>-N(CH<sub>2</sub>CH<sub>2</sub>P <i> <sup>i</sup> </i> Pr<sub>2</sub>)<sub>2</sub>-Ligated Nickel Pincer Complexes. ACS omega 3(5) (2018) 4986-5001
Space group: P 1 c 1
Cell volume: 2213.3
Cell parameters: 8.6545; 10.983; 23.2849; 90; 90.049; 90;  

COD ID: 4515979
CIF file Formula: - C22 H41 N Ni P2 -
Comments: Wellala, Nadeesha P. N.; Luebking, John D.; Krause, Jeanette A.; Guan, Hairong Roles of Hydrogen Bonding in Proton Transfer to κ<sup>P</sup>,κ<sup>N</sup>,κ<sup>P</sup>-N(CH<sub>2</sub>CH<sub>2</sub>P <i> <sup>i</sup> </i> Pr<sub>2</sub>)<sub>2</sub>-Ligated Nickel Pincer Complexes. ACS omega 3(5) (2018) 4986-5001
Space group: P 1 21/n 1
Cell volume: 2335.67
Cell parameters: 10.0515; 12.4032; 18.8698; 90; 96.8592; 90;  

COD ID: 4515980
CIF file Formula: - C22 H39 N Ni P2 -
Comments: Wellala, Nadeesha P. N.; Luebking, John D.; Krause, Jeanette A.; Guan, Hairong Roles of Hydrogen Bonding in Proton Transfer to κ<sup>P</sup>,κ<sup>N</sup>,κ<sup>P</sup>-N(CH<sub>2</sub>CH<sub>2</sub>P <i> <sup>i</sup> </i> Pr<sub>2</sub>)<sub>2</sub>-Ligated Nickel Pincer Complexes. ACS omega 3(5) (2018) 4986-5001
Space group: P 1 21/n 1
Cell volume: 2329.1
Cell parameters: 10.1178; 12.3184; 18.8095; 90; 96.5365; 90;  

COD ID: 4515981
CIF file Formula: - C22 H42 Br N Ni P2 -
Comments: Wellala, Nadeesha P. N.; Luebking, John D.; Krause, Jeanette A.; Guan, Hairong Roles of Hydrogen Bonding in Proton Transfer to κ<sup>P</sup>,κ<sup>N</sup>,κ<sup>P</sup>-N(CH<sub>2</sub>CH<sub>2</sub>P <i> <sup>i</sup> </i> Pr<sub>2</sub>)<sub>2</sub>-Ligated Nickel Pincer Complexes. ACS omega 3(5) (2018) 4986-5001
Space group: P 1 21/n 1
Cell volume: 2519.8
Cell parameters: 8.0453; 26.962; 11.6488; 90; 94.268; 90;  

COD ID: 4515982
CIF file Formula: - C22 H42 F6 N Ni P3 -
Comments: Wellala, Nadeesha P. N.; Luebking, John D.; Krause, Jeanette A.; Guan, Hairong Roles of Hydrogen Bonding in Proton Transfer to κ<sup>P</sup>,κ<sup>N</sup>,κ<sup>P</sup>-N(CH<sub>2</sub>CH<sub>2</sub>P <i> <sup>i</sup> </i> Pr<sub>2</sub>)<sub>2</sub>-Ligated Nickel Pincer Complexes. ACS omega 3(5) (2018) 4986-5001
Space group: P 1 21/m 1
Cell volume: 1359.6
Cell parameters: 8.5129; 14.7798; 10.922; 90; 98.3608; 90;  

COD ID: 4515983
CIF file Formula: - C52 H74 B N Ni O1.5 P2 -
Comments: Wellala, Nadeesha P. N.; Luebking, John D.; Krause, Jeanette A.; Guan, Hairong Roles of Hydrogen Bonding in Proton Transfer to κ<sup>P</sup>,κ<sup>N</sup>,κ<sup>P</sup>-N(CH<sub>2</sub>CH<sub>2</sub>P <i> <sup>i</sup> </i> Pr<sub>2</sub>)<sub>2</sub>-Ligated Nickel Pincer Complexes. ACS omega 3(5) (2018) 4986-5001
Space group: C 1 2/c 1
Cell volume: 9729.9
Cell parameters: 23.872; 12.8733; 32.405; 90; 102.298; 90;  

COD ID: 4515984
CIF file Formula: - C68 H85 Cl4 D24 N2 Ni3 O0.5 P4 -
Comments: Wellala, Nadeesha P. N.; Luebking, John D.; Krause, Jeanette A.; Guan, Hairong Roles of Hydrogen Bonding in Proton Transfer to κ<sup>P</sup>,κ<sup>N</sup>,κ<sup>P</sup>-N(CH<sub>2</sub>CH<sub>2</sub>P <i> <sup>i</sup> </i> Pr<sub>2</sub>)<sub>2</sub>-Ligated Nickel Pincer Complexes. ACS omega 3(5) (2018) 4986-5001
Space group: C 1 2/c 1
Cell volume: 7463.2
Cell parameters: 32.1922; 15.3802; 17.2936; 90; 119.352; 90;  

COD ID: 4515985
CIF file Formula: - C17 H39 N Ni P2 -
Comments: Wellala, Nadeesha P. N.; Luebking, John D.; Krause, Jeanette A.; Guan, Hairong Roles of Hydrogen Bonding in Proton Transfer to κ<sup>P</sup>,κ<sup>N</sup>,κ<sup>P</sup>-N(CH<sub>2</sub>CH<sub>2</sub>P <i> <sup>i</sup> </i> Pr<sub>2</sub>)<sub>2</sub>-Ligated Nickel Pincer Complexes. ACS omega 3(5) (2018) 4986-5001
Space group: P -1
Cell volume: 1034.14
Cell parameters: 7.5986; 8.7665; 17.3743; 76.1042; 85.058; 67.0003;  

COD ID: 4515986
CIF file Formula: - C17 H40 Cl N Ni P2 -
Comments: Wellala, Nadeesha P. N.; Luebking, John D.; Krause, Jeanette A.; Guan, Hairong Roles of Hydrogen Bonding in Proton Transfer to κ<sup>P</sup>,κ<sup>N</sup>,κ<sup>P</sup>-N(CH<sub>2</sub>CH<sub>2</sub>P <i> <sup>i</sup> </i> Pr<sub>2</sub>)<sub>2</sub>-Ligated Nickel Pincer Complexes. ACS omega 3(5) (2018) 4986-5001
Space group: P 1 21/n 1
Cell volume: 2170.5
Cell parameters: 12.6037; 8.7388; 19.9677; 90; 99.276; 90;  

COD ID: 4515987
CIF file Formula: - C17 H40 Br N Ni P2 -
Comments: Wellala, Nadeesha P. N.; Luebking, John D.; Krause, Jeanette A.; Guan, Hairong Roles of Hydrogen Bonding in Proton Transfer to κ<sup>P</sup>,κ<sup>N</sup>,κ<sup>P</sup>-N(CH<sub>2</sub>CH<sub>2</sub>P <i> <sup>i</sup> </i> Pr<sub>2</sub>)<sub>2</sub>-Ligated Nickel Pincer Complexes. ACS omega 3(5) (2018) 4986-5001
Space group: P 1 21/n 1
Cell volume: 2215.1
Cell parameters: 12.7823; 8.7196; 20.1343; 90; 99.226; 90;  

COD ID: 4515988
CIF file Formula: - C41 H60 B N Ni P2 -
Comments: Wellala, Nadeesha P. N.; Luebking, John D.; Krause, Jeanette A.; Guan, Hairong Roles of Hydrogen Bonding in Proton Transfer to κ<sup>P</sup>,κ<sup>N</sup>,κ<sup>P</sup>-N(CH<sub>2</sub>CH<sub>2</sub>P <i> <sup>i</sup> </i> Pr<sub>2</sub>)<sub>2</sub>-Ligated Nickel Pincer Complexes. ACS omega 3(5) (2018) 4986-5001
Space group: P 1 21/n 1
Cell volume: 3899.2
Cell parameters: 17.6124; 12.9737; 18.4955; 90; 112.686; 90;  

COD ID: 4515989
CIF file Formula: - C16 H37 Cl2 N Ni P2 -
Comments: Wellala, Nadeesha P. N.; Luebking, John D.; Krause, Jeanette A.; Guan, Hairong Roles of Hydrogen Bonding in Proton Transfer to κ<sup>P</sup>,κ<sup>N</sup>,κ<sup>P</sup>-N(CH<sub>2</sub>CH<sub>2</sub>P <i> <sup>i</sup> </i> Pr<sub>2</sub>)<sub>2</sub>-Ligated Nickel Pincer Complexes. ACS omega 3(5) (2018) 4986-5001
Space group: P 1 c 1
Cell volume: 2148.16
Cell parameters: 8.7102; 10.8084; 22.818; 90; 90.016; 90;  

COD ID: 4515990
CIF file Formula: - C12 H21 I N2 Ni -
Comments: Wellala, Nadeesha P. N.; Luebking, John D.; Krause, Jeanette A.; Guan, Hairong Roles of Hydrogen Bonding in Proton Transfer to κ<sup>P</sup>,κ<sup>N</sup>,κ<sup>P</sup>-N(CH<sub>2</sub>CH<sub>2</sub>P <i> <sup>i</sup> </i> Pr<sub>2</sub>)<sub>2</sub>-Ligated Nickel Pincer Complexes. ACS omega 3(5) (2018) 4986-5001
Space group: P 42/n :2
Cell volume: 2948.58
Cell parameters: 18.8225; 18.8225; 8.3226; 90; 90; 90;  

COD ID: 4515991
CIF file Formula: - C48 H30 Eu2 N12 O12 -
Comments: Yao, Jin; Zhao, Yan-Wu; Zhang, Xian-Ming Breathing Europium-Terbium Co-doped Luminescent MOF as a Broad-Range Ratiometric Thermometer with a Contrasting Temperature-Intensity Relationship. ACS omega 3(5) (2018) 5754-5760
Space group: P 1 21/c 1
Cell volume: 9434.7
Cell parameters: 29.3277; 21.7233; 15.2203; 90; 103.351; 90;  

COD ID: 4515992
CIF file Formula: - C64 H100 N8 Ni4 O36 Y4 -
Comments: Kalita, Pankaj; Goura, Joydeb; Herrera, Juan Manuel; Colacio, Enrique; Chandrasekhar, Vadapalli Heterometallic Octanuclear Ni<sup>II</sup><sub>4</sub>Ln<sup>III</sup><sub>4</sub> (Ln = Y, Gd, Tb, Dy, Ho, Er) Complexes Containing Ni<sup>II</sup><sub>2</sub>Ln<sup>III</sup><sub>2</sub>O<sub>4</sub> Distorted Cubane Motifs: Synthesis, Structure, and Magnetic Properties. ACS omega 3(5) (2018) 5202-5211
Space group: P 1 21/n 1
Cell volume: 4706.3
Cell parameters: 12.9768; 15.5079; 23.549; 90; 96.737; 90;  

COD ID: 4515993
CIF file Formula: - C64 H100 Gd4 N8 Ni4 O36 -
Comments: Kalita, Pankaj; Goura, Joydeb; Herrera, Juan Manuel; Colacio, Enrique; Chandrasekhar, Vadapalli Heterometallic Octanuclear Ni<sup>II</sup><sub>4</sub>Ln<sup>III</sup><sub>4</sub> (Ln = Y, Gd, Tb, Dy, Ho, Er) Complexes Containing Ni<sup>II</sup><sub>2</sub>Ln<sup>III</sup><sub>2</sub>O<sub>4</sub> Distorted Cubane Motifs: Synthesis, Structure, and Magnetic Properties. ACS omega 3(5) (2018) 5202-5211
Space group: P 1 21/n 1
Cell volume: 4622.7
Cell parameters: 12.8381; 15.4317; 23.4889; 90; 96.593; 90;  

COD ID: 4515994
CIF file Formula: - C64 H100 N8 Ni4 O36 Tb4 -
Comments: Kalita, Pankaj; Goura, Joydeb; Herrera, Juan Manuel; Colacio, Enrique; Chandrasekhar, Vadapalli Heterometallic Octanuclear Ni<sup>II</sup><sub>4</sub>Ln<sup>III</sup><sub>4</sub> (Ln = Y, Gd, Tb, Dy, Ho, Er) Complexes Containing Ni<sup>II</sup><sub>2</sub>Ln<sup>III</sup><sub>2</sub>O<sub>4</sub> Distorted Cubane Motifs: Synthesis, Structure, and Magnetic Properties. ACS omega 3(5) (2018) 5202-5211
Space group: P 1 21/n 1
Cell volume: 4687.6
Cell parameters: 12.9219; 15.516; 23.5346; 90; 96.576; 90;  

COD ID: 4515995
CIF file Formula: - C64 H100 Dy4 N8 Ni4 O36 -
Comments: Kalita, Pankaj; Goura, Joydeb; Herrera, Juan Manuel; Colacio, Enrique; Chandrasekhar, Vadapalli Heterometallic Octanuclear Ni<sup>II</sup><sub>4</sub>Ln<sup>III</sup><sub>4</sub> (Ln = Y, Gd, Tb, Dy, Ho, Er) Complexes Containing Ni<sup>II</sup><sub>2</sub>Ln<sup>III</sup><sub>2</sub>O<sub>4</sub> Distorted Cubane Motifs: Synthesis, Structure, and Magnetic Properties. ACS omega 3(5) (2018) 5202-5211
Space group: P 1 21/n 1
Cell volume: 4599.6
Cell parameters: 12.832; 15.413; 23.419; 90; 96.765; 90;  

COD ID: 4515996
CIF file Formula: - C64 H100 Ho4 N8 Ni4 O36 -
Comments: Kalita, Pankaj; Goura, Joydeb; Herrera, Juan Manuel; Colacio, Enrique; Chandrasekhar, Vadapalli Heterometallic Octanuclear Ni<sup>II</sup><sub>4</sub>Ln<sup>III</sup><sub>4</sub> (Ln = Y, Gd, Tb, Dy, Ho, Er) Complexes Containing Ni<sup>II</sup><sub>2</sub>Ln<sup>III</sup><sub>2</sub>O<sub>4</sub> Distorted Cubane Motifs: Synthesis, Structure, and Magnetic Properties. ACS omega 3(5) (2018) 5202-5211
Space group: P 1 21/n 1
Cell volume: 4708.2
Cell parameters: 12.9771; 15.5019; 23.5655; 90; 96.714; 90;  

COD ID: 4515997
CIF file Formula: - C64 H100 Er4 N8 Ni4 O36 -
Comments: Kalita, Pankaj; Goura, Joydeb; Herrera, Juan Manuel; Colacio, Enrique; Chandrasekhar, Vadapalli Heterometallic Octanuclear Ni<sup>II</sup><sub>4</sub>Ln<sup>III</sup><sub>4</sub> (Ln = Y, Gd, Tb, Dy, Ho, Er) Complexes Containing Ni<sup>II</sup><sub>2</sub>Ln<sup>III</sup><sub>2</sub>O<sub>4</sub> Distorted Cubane Motifs: Synthesis, Structure, and Magnetic Properties. ACS omega 3(5) (2018) 5202-5211
Space group: P 1 21/n 1
Cell volume: 4661.61
Cell parameters: 12.9222; 15.4758; 23.4658; 90; 96.601; 90;  

COD ID: 4515998
CIF file Formula: - C13 H18 N4 S -
Comments: Siddaraju, Yogesh; Prabhu, Kandikere Ramaiah Iodine-Catalyzed Chemoselective Hydroamination Reaction Using 5-Mercaptotetrazoles Derivatives. ACS omega 3(5) (2018) 4908-4917
Space group: P -1
Cell volume: 715.9
Cell parameters: 7.72; 8.727; 11.731; 82.547; 79.592; 67.366;  

COD ID: 4515999
CIF file Formula: - C21 H30 Au B Cl P -
Comments: Boom, Devin H. A.; Ehlers, Andreas W.; Nieger, Martin; Devillard, Marc; Bouhadir, Ghenwa; Bourissou, Didier; Slootweg, J. Chris Gold(I) Complexes of the Geminal Phosphinoborane <i>t</i>Bu<sub>2</sub>PCH<sub>2</sub>BPh<sub>2</sub>. ACS omega 3(4) (2018) 3945-3951
Space group: P 1 21/c 1
Cell volume: 2123.26
Cell parameters: 17.0948; 7.0396; 17.6526; 90; 91.814; 90;  

COD ID: 4516000
CIF file Formula: - C42 H60 Au B2 Cl P2 -
Comments: Boom, Devin H. A.; Ehlers, Andreas W.; Nieger, Martin; Devillard, Marc; Bouhadir, Ghenwa; Bourissou, Didier; Slootweg, J. Chris Gold(I) Complexes of the Geminal Phosphinoborane <i>t</i>Bu<sub>2</sub>PCH<sub>2</sub>BPh<sub>2</sub>. ACS omega 3(4) (2018) 3945-3951
Space group: C 1 2/c 1
Cell volume: 8096.7
Cell parameters: 28.3351; 11.3935; 27.095; 90; 112.237; 90;  

COD ID: 4516001
CIF file Formula: - C44 H57 Au B Cl P2 -
Comments: Boom, Devin H. A.; Ehlers, Andreas W.; Nieger, Martin; Devillard, Marc; Bouhadir, Ghenwa; Bourissou, Didier; Slootweg, J. Chris Gold(I) Complexes of the Geminal Phosphinoborane <i>t</i>Bu<sub>2</sub>PCH<sub>2</sub>BPh<sub>2</sub>. ACS omega 3(4) (2018) 3945-3951
Space group: P b c a
Cell volume: 8289.2
Cell parameters: 19.0712; 18.7238; 23.2135; 90; 90; 90;  

COD ID: 4516002
CIF file Formula: - C40 H40 Ag2 Br4 N4 -
Comments: Liu, Qing-Xiang; Hu, Ze-Liang; Yu, Shao-Cong; Zhao, Zhi-Xiang; Wei, Deng-Che; Li, Hui-Long NHC Pd(II) and Ag(I) Complexes: Synthesis, Structure, and Catalytic Activity in Three Types of C-C Coupling Reactions. ACS omega 3(4) (2018) 4035-4047
Space group: P -1
Cell volume: 2385.6
Cell parameters: 11.398; 13.023; 18.513; 100.166; 103.867; 110.924;  

COD ID: 4516003
CIF file Formula: - C39 H38 Ag2 Br2 Cl2 N6 -
Comments: Liu, Qing-Xiang; Hu, Ze-Liang; Yu, Shao-Cong; Zhao, Zhi-Xiang; Wei, Deng-Che; Li, Hui-Long NHC Pd(II) and Ag(I) Complexes: Synthesis, Structure, and Catalytic Activity in Three Types of C-C Coupling Reactions. ACS omega 3(4) (2018) 4035-4047
Space group: P 1 21/c 1
Cell volume: 3759.8
Cell parameters: 8.4181; 29.944; 15.6855; 90; 108.026; 90;  

COD ID: 4516004
CIF file Formula: - C32 H34 Ag2 Br2 N4 -
Comments: Liu, Qing-Xiang; Hu, Ze-Liang; Yu, Shao-Cong; Zhao, Zhi-Xiang; Wei, Deng-Che; Li, Hui-Long NHC Pd(II) and Ag(I) Complexes: Synthesis, Structure, and Catalytic Activity in Three Types of C-C Coupling Reactions. ACS omega 3(4) (2018) 4035-4047
Space group: P 1 21/c 1
Cell volume: 2988.8
Cell parameters: 13.0472; 12.5773; 18.2141; 90; 90.564; 90;  

COD ID: 4516005
CIF file Formula: - C30 H34 Cl4 N4 Pd2 -
Comments: Liu, Qing-Xiang; Hu, Ze-Liang; Yu, Shao-Cong; Zhao, Zhi-Xiang; Wei, Deng-Che; Li, Hui-Long NHC Pd(II) and Ag(I) Complexes: Synthesis, Structure, and Catalytic Activity in Three Types of C-C Coupling Reactions. ACS omega 3(4) (2018) 4035-4047
Space group: P 1 21/c 1
Cell volume: 3124.8
Cell parameters: 20.0687; 8.9504; 18.1404; 90; 106.464; 90;  

COD ID: 4516006
CIF file Formula: - C18 H26 N2 O5 -
Comments: Nandi, Sujay Kumar; Maji, Krishnendu; Haldar, Debasish Self-Healing Hydrogel from a Dipeptide and HCl Sensing. ACS omega 3(4) (2018) 3744-3751
Space group: P 21 21 21
Cell volume: 1825.62
Cell parameters: 6.2327; 10.6629; 27.47; 90; 90; 90;  

COD ID: 4516007
CIF file Formula: - C32 H32 N10 O10 -
Comments: Havel, Václav; Sadilová, Tereza; Šindelář, Vladimír Unsubstituted Bambusurils: Post-Macrocyclization Modification of Versatile Intermediates. ACS omega 3(4) (2018) 4657-4663
Space group: P 1 21/n 1
Cell volume: 3315.56
Cell parameters: 20.8293; 7.7968; 22.183; 90; 113.025; 90;  

COD ID: 4516008
CIF file Formula: - C10 H5 F3 N4 S -
Comments: Liu, Jin; Wang, Yu-Ling; Zhang, Ji-Hong; Yang, Jian-Shan; Mou, Han-Chuan; Lin, Jun; Yan, Sheng-Jiao Phosphatase CDC25B Inhibitors Produced by Basic Alumina-Supported One-Pot Gram-Scale Synthesis of Fluorinated 2-Alkylthio-4-aminoquinazolines Using Microwave Irradiation. ACS omega 3(4) (2018) 4534-4544
Space group: P -1
Cell volume: 531
Cell parameters: 7.2243; 8.0299; 9.8872; 110.099; 90.348; 98.938;  

COD ID: 4516009
CIF file Formula: - C23 H18 N4 O2 -
Comments: Sabat, Nazarii; Poštová Slavětínská, Lenka; Klepetářová, Blanka; Hocek, Michal C-H Imidation of 7-Deazapurines. ACS omega 3(4) (2018) 4674-4678
Space group: P 1 21/n 1
Cell volume: 1843.75
Cell parameters: 6.07198; 26.2431; 11.6359; 90; 96.071; 90;  

COD ID: 4516010
CIF file Formula: - C48 H54 Co1.5 N6 -
Comments: Koide, Taro; Aritome, Isao; Saeki, Tatsuya; Morita, Yoshitsugu; Shiota, Yoshihito; Yoshizawa, Kazunari; Shimakoshi, Hisashi; Hisaeda, Yoshio Cobalt-Carbon Bond Formation Reaction via Ligand Reduction of Porphycene-Cobalt(II) Complex and Its Noninnocent Reactivity. ACS omega 3(4) (2018) 4027-4034
Space group: P -1
Cell volume: 1891.05
Cell parameters: 5.2108; 17.0359; 21.6439; 98.767; 92.401; 94.199;  

COD ID: 4516011
CIF file Formula: - C72 H68 Cu2 N8 O14 -
Comments: Bhattacharyya, Sohini; Chakraborty, Anindita; Hazra, Arpan; Maji, Tapas Kumar Tetracarboxylate Linker-Based Flexible Cu<sup>II</sup> Frameworks: Efficient Separation of CO<sub>2</sub> from CO<sub>2</sub>/N<sub>2</sub> and C<sub>2</sub>H<sub>2</sub> from C<sub>2</sub>H<sub>2</sub>/C<sub>2</sub>H<sub>4</sub> Mixtures. ACS omega 3(2) (2018) 2018-2026
Space group: P 1 21/c 1
Cell volume: 7424.6
Cell parameters: 23.6733; 18.9166; 17.611; 90; 109.708; 90;  

COD ID: 4516012
CIF file Formula: - C112 H100 Cu4 N12 O37 -
Comments: Bhattacharyya, Sohini; Chakraborty, Anindita; Hazra, Arpan; Maji, Tapas Kumar Tetracarboxylate Linker-Based Flexible Cu<sup>II</sup> Frameworks: Efficient Separation of CO<sub>2</sub> from CO<sub>2</sub>/N<sub>2</sub> and C<sub>2</sub>H<sub>2</sub> from C<sub>2</sub>H<sub>2</sub>/C<sub>2</sub>H<sub>4</sub> Mixtures. ACS omega 3(2) (2018) 2018-2026
Space group: C 1 2/c 1
Cell volume: 12274.8
Cell parameters: 44.8511; 19.046; 14.7115; 90; 102.38; 90;  

COD ID: 4516013
CIF file Formula: - H81.32 K12.87 O150.66 P5 W30 -
Comments: Hayashi, Akio; Wihadi, Muh Nur Khoiru; Ota, Hiromi; López, Xavier; Ichihashi, Katsuya; Nishihara, Sadafumi; Inoue, Katsuya; Tsunoji, Nao; Sano, Tsuneji; Sadakane, Masahiro Preparation of Preyssler-type Phosphotungstate with One Central Potassium Cation and Potassium Cation Migration into the Preyssler Molecule to form Di-Potassium-Encapsulated Derivative. ACS omega 3(2) (2018) 2363-2373
Space group: P n n a
Cell volume: 13397.9
Cell parameters: 32.6621; 21.5252; 19.0566; 90; 90; 90;  

COD ID: 4516014
CIF file Formula: - C27 H32 N0 O3 S -
Comments: Liu, Teng; Liu, Jianjun; Xia, Shubiao; Meng, Jie; Shen, Xianfu; Zhu, Xiufang; Chen, Wenchang; Sun, Chengke; Cheng, Feixiang Catalyst-Free 1,6-Conjugate Addition/Aromatization/Sulfonylation of <i>para</i>-Quinone Methides: Facile Access to Diarylmethyl Sulfones. ACS omega 3(2) (2018) 1409-1415
Space group: P 1 21/c 1
Cell volume: 2436.4
Cell parameters: 12.43; 9.127; 21.477; 90; 90.584; 90;  

COD ID: 4516015
CIF file Formula: - C29 H22 F3 N3 O3 S -
Comments: Dutta, Champak; Ghorai, Debasish; Choudhury, Joyanta To "Rollover" or Not? Stereoelectronically Guided C-H Functionalization Pathways from Rhodium-Abnormal NHC Intermediates. ACS omega 3(2) (2018) 1614-1620
Space group: P 1 21/c 1
Cell volume: 2556.1
Cell parameters: 15.7722; 8.8439; 23.3357; 90; 128.255; 90;  

COD ID: 4516016
CIF file Formula: - C20 H26 Cl F6 N3 P Rh -
Comments: Dutta, Champak; Ghorai, Debasish; Choudhury, Joyanta To "Rollover" or Not? Stereoelectronically Guided C-H Functionalization Pathways from Rhodium-Abnormal NHC Intermediates. ACS omega 3(2) (2018) 1614-1620
Space group: P 1 21/c 1
Cell volume: 2305.7
Cell parameters: 14.831; 8.5492; 18.749; 90; 104.09; 90;  

COD ID: 4516017
CIF file Formula: - C24 H22 F6 N3 P -
Comments: Dutta, Champak; Ghorai, Debasish; Choudhury, Joyanta To "Rollover" or Not? Stereoelectronically Guided C-H Functionalization Pathways from Rhodium-Abnormal NHC Intermediates. ACS omega 3(2) (2018) 1614-1620
Space group: C 1 2/c 1
Cell volume: 4421.4
Cell parameters: 24.1002; 15.1276; 13.5007; 90; 116.068; 90;  

COD ID: 4516018
CIF file Formula: - C24 H28 Cl F6 N3 P Rh -
Comments: Dutta, Champak; Ghorai, Debasish; Choudhury, Joyanta To "Rollover" or Not? Stereoelectronically Guided C-H Functionalization Pathways from Rhodium-Abnormal NHC Intermediates. ACS omega 3(2) (2018) 1614-1620
Space group: P 1 21/n 1
Cell volume: 2478.4
Cell parameters: 9.1839; 27.796; 9.7373; 90; 94.388; 90;  

COD ID: 4516019
CIF file Formula: - C36 H48 Cl2 N4 O Ru -
Comments: Kumar, Dharmendra; Prakasham, A. P.; Das, Sharmistha; Datta, Anindya; Ghosh, Prasenjit Cyanosilylation of Aromatic Aldehydes by Cationic Ruthenium(II) Complexes of Benzimidazole-Derived O-Functionalized N-Heterocyclic Carbenes at Ambient Temperature under Solvent-Free Conditions. ACS omega 3(2) (2018) 1922-1938
Space group: P -1
Cell volume: 1789.83
Cell parameters: 11.612; 13.3307; 13.8927; 62.692; 85.611; 70.196;  

COD ID: 4516020
CIF file Formula: - C34 H44 Cl5 N3 O Ru -
Comments: Kumar, Dharmendra; Prakasham, A. P.; Das, Sharmistha; Datta, Anindya; Ghosh, Prasenjit Cyanosilylation of Aromatic Aldehydes by Cationic Ruthenium(II) Complexes of Benzimidazole-Derived O-Functionalized N-Heterocyclic Carbenes at Ambient Temperature under Solvent-Free Conditions. ACS omega 3(2) (2018) 1922-1938
Space group: P -1
Cell volume: 1836.57
Cell parameters: 11.04197; 13.3361; 13.4517; 69.6572; 83.3894; 82.6029;  

COD ID: 4516021
CIF file Formula: - C30 H39 Cl2 N3 O2 Ru -
Comments: Kumar, Dharmendra; Prakasham, A. P.; Das, Sharmistha; Datta, Anindya; Ghosh, Prasenjit Cyanosilylation of Aromatic Aldehydes by Cationic Ruthenium(II) Complexes of Benzimidazole-Derived O-Functionalized N-Heterocyclic Carbenes at Ambient Temperature under Solvent-Free Conditions. ACS omega 3(2) (2018) 1922-1938
Space group: P -1
Cell volume: 1469.48
Cell parameters: 9.9088; 11.7379; 14.6956; 109.254; 99.6774; 107.508;  

COD ID: 4516022
CIF file Formula: - C46 H56 Ag2 N6 O2 -
Comments: Kumar, Dharmendra; Prakasham, A. P.; Das, Sharmistha; Datta, Anindya; Ghosh, Prasenjit Cyanosilylation of Aromatic Aldehydes by Cationic Ruthenium(II) Complexes of Benzimidazole-Derived O-Functionalized N-Heterocyclic Carbenes at Ambient Temperature under Solvent-Free Conditions. ACS omega 3(2) (2018) 1922-1938
Space group: P 1 21/n 1
Cell volume: 2109.85
Cell parameters: 9.8105; 15.9779; 14.0138; 90; 106.163; 90;  

COD ID: 4516023
CIF file Formula: - C33 H29 N2 O7 S2 -
Comments: Wang, Ai-Fang; Hao, Wen-Juan; Zhu, Yi-Long; Li, Guigen; Zhou, Peng; Tu, Shu-Jiang; Jiang, Bo Double SO<sub>2</sub> Insertion into 1,7-Diynes Leading to Functionalized Naphtho[1,2-<i>c</i>]thiophene 2,2-dioxides. ACS omega 3(2) (2018) 1482-1491
Space group: P -1
Cell volume: 1508.1
Cell parameters: 11.585; 11.6149; 13.2151; 99.42; 113.923; 103.89;  

COD ID: 4516024
CIF file Formula: - C25 H33 Cl2 N3 Pd -
Comments: Singh, Chandan; Prakasham, A. P.; Gangwar, Manoj Kumar; Butcher, Raymond J.; Ghosh, Prasenjit One-Pot Tandem Hiyama Alkynylation/Cyclizations by Palladium(II) Acyclic Diaminocarbene (ADC) Complexes Yielding Biologically Relevant Benzofuran Scaffolds. ACS omega 3(2) (2018) 1740-1756
Space group: P 1 21/n 1
Cell volume: 2497.8
Cell parameters: 8.6965; 13.393; 21.541; 90; 95.392; 90;  

COD ID: 4516025
CIF file Formula: - C24 H31 Cl2 N3 Pd -
Comments: Singh, Chandan; Prakasham, A. P.; Gangwar, Manoj Kumar; Butcher, Raymond J.; Ghosh, Prasenjit One-Pot Tandem Hiyama Alkynylation/Cyclizations by Palladium(II) Acyclic Diaminocarbene (ADC) Complexes Yielding Biologically Relevant Benzofuran Scaffolds. ACS omega 3(2) (2018) 1740-1756
Space group: P n a 21
Cell volume: 2478.35
Cell parameters: 14.7426; 8.5735; 19.6079; 90; 90; 90;  

COD ID: 4516026
CIF file Formula: - C24 H30 Cl2 N3 O Pd -
Comments: Singh, Chandan; Prakasham, A. P.; Gangwar, Manoj Kumar; Butcher, Raymond J.; Ghosh, Prasenjit One-Pot Tandem Hiyama Alkynylation/Cyclizations by Palladium(II) Acyclic Diaminocarbene (ADC) Complexes Yielding Biologically Relevant Benzofuran Scaffolds. ACS omega 3(2) (2018) 1740-1756
Space group: P 1 21/n 1
Cell volume: 2475.12
Cell parameters: 8.6515; 13.5074; 21.4232; 90; 98.636; 90;  

COD ID: 4516027
CIF file Formula: - C22 H30 Cl N O4 -
Comments: Lan, Ping; Herlt, Anthony J.; Willis, Anthony C.; Taylor, Walter C.; Mander, Lewis N. Structures of New Alkaloids from Rain Forest Trees <i>Galbulimima belgraveana</i> and <i>Galbulimima baccata</i> in Papua New Guinea, Indonesia, and Northern Australia. ACS omega 3(2) (2018) 1912-1921
Space group: P 21 21 21
Cell volume: 2020.22
Cell parameters: 8.5727; 9.0053; 26.1687; 90; 90; 90;  

COD ID: 4516028
CIF file Formula: - C21.488 H33.976 N O3 -
Comments: Lan, Ping; Herlt, Anthony J.; Willis, Anthony C.; Taylor, Walter C.; Mander, Lewis N. Structures of New Alkaloids from Rain Forest Trees <i>Galbulimima belgraveana</i> and <i>Galbulimima baccata</i> in Papua New Guinea, Indonesia, and Northern Australia. ACS omega 3(2) (2018) 1912-1921
Space group: P 21 21 21
Cell volume: 1972.6
Cell parameters: 7.8673; 9.5188; 26.3409; 90; 90; 90;  

COD ID: 4516029
CIF file Formula: - C24 H33 N O5 -
Comments: Lan, Ping; Herlt, Anthony J.; Willis, Anthony C.; Taylor, Walter C.; Mander, Lewis N. Structures of New Alkaloids from Rain Forest Trees <i>Galbulimima belgraveana</i> and <i>Galbulimima baccata</i> in Papua New Guinea, Indonesia, and Northern Australia. ACS omega 3(2) (2018) 1912-1921
Space group: P 1
Cell volume: 1073.44
Cell parameters: 8.3874; 10.6644; 13.5952; 69.268; 89.374; 71.779;  

COD ID: 4516030
CIF file Formula: - C21 H32 Cl N O2 -
Comments: Lan, Ping; Herlt, Anthony J.; Willis, Anthony C.; Taylor, Walter C.; Mander, Lewis N. Structures of New Alkaloids from Rain Forest Trees <i>Galbulimima belgraveana</i> and <i>Galbulimima baccata</i> in Papua New Guinea, Indonesia, and Northern Australia. ACS omega 3(2) (2018) 1912-1921
Space group: P 21 21 21
Cell volume: 2047.55
Cell parameters: 7.4614; 9.6133; 28.5458; 90; 90; 90;  

COD ID: 4516031
CIF file Formula: - C22 H32 Cl N O4 -
Comments: Lan, Ping; Herlt, Anthony J.; Willis, Anthony C.; Taylor, Walter C.; Mander, Lewis N. Structures of New Alkaloids from Rain Forest Trees <i>Galbulimima belgraveana</i> and <i>Galbulimima baccata</i> in Papua New Guinea, Indonesia, and Northern Australia. ACS omega 3(2) (2018) 1912-1921
Space group: P 21 21 21
Cell volume: 4158.5
Cell parameters: 9.0105; 13.7999; 33.4435; 90; 90; 90;  

COD ID: 4516032
CIF file Formula: - C46 H70 N2 O8 -
Comments: Lan, Ping; Herlt, Anthony J.; Willis, Anthony C.; Taylor, Walter C.; Mander, Lewis N. Structures of New Alkaloids from Rain Forest Trees <i>Galbulimima belgraveana</i> and <i>Galbulimima baccata</i> in Papua New Guinea, Indonesia, and Northern Australia. ACS omega 3(2) (2018) 1912-1921
Space group: P 21 21 21
Cell volume: 4533.5
Cell parameters: 12.707; 18.741; 19.0369; 90; 90; 90;  

COD ID: 4516033
CIF file Formula: - C21 H30 Cl N O2 -
Comments: Lan, Ping; Herlt, Anthony J.; Willis, Anthony C.; Taylor, Walter C.; Mander, Lewis N. Structures of New Alkaloids from Rain Forest Trees <i>Galbulimima belgraveana</i> and <i>Galbulimima baccata</i> in Papua New Guinea, Indonesia, and Northern Australia. ACS omega 3(2) (2018) 1912-1921
Space group: P 1 21 1
Cell volume: 923.7
Cell parameters: 10.1135; 8.7052; 11.4139; 90; 113.189; 90;  

COD ID: 4516034
CIF file Formula: - C21 H20 Cl N3 O5 -
Comments: Joshi, Mayank; Roy Choudhury, Angshuman Salts of Amoxapine with Improved Solubility for Enhanced Pharmaceutical Applicability. ACS omega 3(2) (2018) 2406-2416
Space group: P 1 21/c 1
Cell volume: 1969.47
Cell parameters: 20.5724; 9.8586; 9.7866; 90; 97.143; 90;  

COD ID: 4516035
CIF file Formula: - C37 H40 Cl2 N6 O8 -
Comments: Joshi, Mayank; Roy Choudhury, Angshuman Salts of Amoxapine with Improved Solubility for Enhanced Pharmaceutical Applicability. ACS omega 3(2) (2018) 2406-2416
Space group: P 1 21/c 1
Cell volume: 3629.8
Cell parameters: 21.344; 9.9544; 17.4685; 90; 102.041; 90;  

COD ID: 4516036
CIF file Formula: - C40 H42 Cl2 N6 O10 -
Comments: Joshi, Mayank; Roy Choudhury, Angshuman Salts of Amoxapine with Improved Solubility for Enhanced Pharmaceutical Applicability. ACS omega 3(2) (2018) 2406-2416
Space group: P -1
Cell volume: 1943.33
Cell parameters: 9.2238; 12.4815; 17.0725; 86.285; 89.375; 82.224;  

COD ID: 4516037
CIF file Formula: - C38 H48 Cl2 N6 O11 -
Comments: Joshi, Mayank; Roy Choudhury, Angshuman Salts of Amoxapine with Improved Solubility for Enhanced Pharmaceutical Applicability. ACS omega 3(2) (2018) 2406-2416
Space group: P 1 21/c 1
Cell volume: 7802.1
Cell parameters: 15.721; 19.4546; 25.7568; 90; 97.94; 90;  

COD ID: 4516038
CIF file Formula: - C22.75 H23 Cl2 Fe N12 O12.75 -
Comments: Kimura, Akifumi; Ishida, Takayuki Spin-Crossover Temperature Predictable from DFT Calculation for Iron(II) Complexes with 4-Substituted Pybox and Related Heteroaromatic Ligands. ACS omega 3(6) (2018) 6737-6747
Space group: P -1
Cell volume: 3021.4
Cell parameters: 11.085; 16.394; 17.644; 71.995; 83.901; 83.563;  

COD ID: 4516039
CIF file Formula: - C23 H24 Br2 Cl2 Fe N6 O13 -
Comments: Kimura, Akifumi; Ishida, Takayuki Spin-Crossover Temperature Predictable from DFT Calculation for Iron(II) Complexes with 4-Substituted Pybox and Related Heteroaromatic Ligands. ACS omega 3(6) (2018) 6737-6747
Space group: P -1
Cell volume: 1538
Cell parameters: 9.678; 9.79; 16.669; 85.581; 80.683; 81.201;  

COD ID: 4516040
CIF file Formula: - C34 H36 Cl2 Fe N8 O14 -
Comments: Kimura, Akifumi; Ishida, Takayuki Spin-Crossover Temperature Predictable from DFT Calculation for Iron(II) Complexes with 4-Substituted Pybox and Related Heteroaromatic Ligands. ACS omega 3(6) (2018) 6737-6747
Space group: P 21 21 21
Cell volume: 3813.1
Cell parameters: 14.284; 15.268; 17.484; 90; 90; 90;  

COD ID: 4516041
CIF file Formula: - C8 H12 F6 O6 Pt S2 -
Comments: Mishra, Vishwesh; Thirupathi, Natesan Critical Role of Anions in Platinum(II) Precursors upon the Structural Motifs of Six-Membered Cycloplatinated <i>N</i>,<i>N</i>',<i>N</i>″-Triarylguanidines. ACS omega 3(6) (2018) 6075-6090
Space group: P 1 21/c 1
Cell volume: 1597.37
Cell parameters: 10.4074; 8.6512; 18.1328; 90; 101.926; 90;  

COD ID: 4516042
CIF file Formula: - C24 H24 F3 N3 O5 -
Comments: Mishra, Vishwesh; Thirupathi, Natesan Critical Role of Anions in Platinum(II) Precursors upon the Structural Motifs of Six-Membered Cycloplatinated <i>N</i>,<i>N</i>',<i>N</i>″-Triarylguanidines. ACS omega 3(6) (2018) 6075-6090
Space group: P 1 21/c 1
Cell volume: 2379.24
Cell parameters: 17.013; 8.5689; 16.9747; 90; 105.959; 90;  

COD ID: 4516043
CIF file Formula: - C47 H49 Cl N6 O2 Pt -
Comments: Mishra, Vishwesh; Thirupathi, Natesan Critical Role of Anions in Platinum(II) Precursors upon the Structural Motifs of Six-Membered Cycloplatinated <i>N</i>,<i>N</i>',<i>N</i>″-Triarylguanidines. ACS omega 3(6) (2018) 6075-6090
Space group: P -1
Cell volume: 2117.7
Cell parameters: 12.0242; 13.0156; 14.2406; 91.582; 102.85; 102.152;  

COD ID: 4516044
CIF file Formula: - C46 H45 F3 N6 O2 Pt -
Comments: Mishra, Vishwesh; Thirupathi, Natesan Critical Role of Anions in Platinum(II) Precursors upon the Structural Motifs of Six-Membered Cycloplatinated <i>N</i>,<i>N</i>',<i>N</i>″-Triarylguanidines. ACS omega 3(6) (2018) 6075-6090
Space group: P -1
Cell volume: 2181.88
Cell parameters: 12.8497; 13.011; 14.5696; 113.345; 91.507; 100.935;  

COD ID: 4516045
CIF file Formula: - C26 H28 F3 N3 O3 Pt S -
Comments: Mishra, Vishwesh; Thirupathi, Natesan Critical Role of Anions in Platinum(II) Precursors upon the Structural Motifs of Six-Membered Cycloplatinated <i>N</i>,<i>N</i>',<i>N</i>″-Triarylguanidines. ACS omega 3(6) (2018) 6075-6090
Space group: P 1 21/c 1
Cell volume: 2623.36
Cell parameters: 20.2522; 8.1634; 15.925; 90; 94.862; 90;  

COD ID: 4516046
CIF file Formula: - C26 H28 F3 N3 O6 Pt S -
Comments: Mishra, Vishwesh; Thirupathi, Natesan Critical Role of Anions in Platinum(II) Precursors upon the Structural Motifs of Six-Membered Cycloplatinated <i>N</i>,<i>N</i>',<i>N</i>″-Triarylguanidines. ACS omega 3(6) (2018) 6075-6090
Space group: P b c a
Cell volume: 5668.6
Cell parameters: 20.8435; 7.8008; 34.8632; 90; 90; 90;  

COD ID: 4516047
CIF file Formula: - C44 H46 Cl2 N6 Pt -
Comments: Mishra, Vishwesh; Thirupathi, Natesan Critical Role of Anions in Platinum(II) Precursors upon the Structural Motifs of Six-Membered Cycloplatinated <i>N</i>,<i>N</i>',<i>N</i>″-Triarylguanidines. ACS omega 3(6) (2018) 6075-6090
Space group: P -1
Cell volume: 2036
Cell parameters: 11.2411; 13.8079; 14.6138; 90.265; 106.81; 109.349;  

COD ID: 4516048
CIF file Formula: - C44 H44 Cl2 N6 Pt2 -
Comments: Mishra, Vishwesh; Thirupathi, Natesan Critical Role of Anions in Platinum(II) Precursors upon the Structural Motifs of Six-Membered Cycloplatinated <i>N</i>,<i>N</i>',<i>N</i>″-Triarylguanidines. ACS omega 3(6) (2018) 6075-6090
Space group: P 1 21/n 1
Cell volume: 1998.1
Cell parameters: 9.7792; 18.2967; 11.3037; 90; 98.915; 90;  

COD ID: 4516049
CIF file Formula: - C57 H64 Cl2 N6 Pt2 -
Comments: Mishra, Vishwesh; Thirupathi, Natesan Critical Role of Anions in Platinum(II) Precursors upon the Structural Motifs of Six-Membered Cycloplatinated <i>N</i>,<i>N</i>',<i>N</i>″-Triarylguanidines. ACS omega 3(6) (2018) 6075-6090
Space group: P -1
Cell volume: 2532.71
Cell parameters: 11.4693; 15.1911; 16.1768; 99.025; 105.146; 106.101;  

COD ID: 4516050
CIF file Formula: - C49 H46 Cl2 F6 N6 O4 Pt2 -
Comments: Mishra, Vishwesh; Thirupathi, Natesan Critical Role of Anions in Platinum(II) Precursors upon the Structural Motifs of Six-Membered Cycloplatinated <i>N</i>,<i>N</i>',<i>N</i>″-Triarylguanidines. ACS omega 3(6) (2018) 6075-6090
Space group: P 1 21/n 1
Cell volume: 5152
Cell parameters: 12.3755; 18.4144; 22.6884; 90; 94.834; 90;  

COD ID: 4516051
CIF file Formula: - C25 H19 N11 O4 -
Comments: De, Avik; Mondal, Raju Toxic Metal Sequestration Exploiting a Unprecedented Low-Molecular-Weight Hydrogel-to-Metallogel Transformation. ACS omega 3(6) (2018) 6022-6030
Space group: C 1 2/c 1
Cell volume: 2367.1
Cell parameters: 20.463; 8.8637; 14.0198; 90; 111.426; 90;  

COD ID: 4516052
CIF file Formula: - C19 H14 Ag Cl N4 O4 -
Comments: Santos, Ane F.; Ferreira, Isabella P.; Pinheiro, Carlos B.; Santos, Verlane G.; Lopes, Miriam T. P.; Teixeira, Letícia R; Rocha, Willian R.; Rodrigues, Gabriel L. S.; Beraldo, Heloisa [Ag(L)NO<sub>3</sub>] Complexes with 2-Benzoylpyridine-Derived Hydrazones: Cytotoxic Activity and Interaction with Biomolecules. ACS omega 3(6) (2018) 7027-7035
Space group: P 1 21/n 1
Cell volume: 1886.02
Cell parameters: 7.1699; 20.7822; 12.9758; 90; 102.72; 90;  

COD ID: 4516053
CIF file Formula: - C20 H17 Ag N4 O4 -
Comments: Santos, Ane F.; Ferreira, Isabella P.; Pinheiro, Carlos B.; Santos, Verlane G.; Lopes, Miriam T. P.; Teixeira, Letícia R; Rocha, Willian R.; Rodrigues, Gabriel L. S.; Beraldo, Heloisa [Ag(L)NO<sub>3</sub>] Complexes with 2-Benzoylpyridine-Derived Hydrazones: Cytotoxic Activity and Interaction with Biomolecules. ACS omega 3(6) (2018) 7027-7035
Space group: I 1 2/a 1
Cell volume: 3830.4
Cell parameters: 12.3045; 14.5456; 21.5645; 90; 97.044; 90;  

COD ID: 4516054
CIF file Formula: - C19 H15 Ag N4 O4 -
Comments: Santos, Ane F.; Ferreira, Isabella P.; Pinheiro, Carlos B.; Santos, Verlane G.; Lopes, Miriam T. P.; Teixeira, Letícia R; Rocha, Willian R.; Rodrigues, Gabriel L. S.; Beraldo, Heloisa [Ag(L)NO<sub>3</sub>] Complexes with 2-Benzoylpyridine-Derived Hydrazones: Cytotoxic Activity and Interaction with Biomolecules. ACS omega 3(6) (2018) 7027-7035
Space group: P 1 21/c 1
Cell volume: 1794.96
Cell parameters: 9.0545; 9.0558; 21.896; 90; 91.239; 90;  

COD ID: 4516055
CIF file Formula: - C14 H21 N O5 -
Comments: Hu, Xing-Mei; Zhou, Bei; Yang, Chang-Long; Lin, Jun; Yan, Sheng-Jiao Site-Selective Reaction of Enaminones and Enamine Esters for the Synthesis of Novel Diverse Morphan Derivatives. ACS omega 3(6) (2018) 5994-6005
Space group: P 1 21/n 1
Cell volume: 1438
Cell parameters: 10.275; 9.5886; 14.718; 90; 97.405; 90;  

COD ID: 4516056
CIF file Formula: - C29 H33 F N2 O6 -
Comments: Hu, Xing-Mei; Zhou, Bei; Yang, Chang-Long; Lin, Jun; Yan, Sheng-Jiao Site-Selective Reaction of Enaminones and Enamine Esters for the Synthesis of Novel Diverse Morphan Derivatives. ACS omega 3(6) (2018) 5994-6005
Space group: P -1
Cell volume: 1652.5
Cell parameters: 11.496; 12.24; 13.457; 79.41; 67.16; 71.68;  

COD ID: 4516057
CIF file Formula: - C16 H22 F3 N O5 -
Comments: Hu, Xing-Mei; Zhou, Bei; Yang, Chang-Long; Lin, Jun; Yan, Sheng-Jiao Site-Selective Reaction of Enaminones and Enamine Esters for the Synthesis of Novel Diverse Morphan Derivatives. ACS omega 3(6) (2018) 5994-6005
Space group: P 1 21/c 1
Cell volume: 1792.5
Cell parameters: 8.7813; 8.4703; 24.136; 90; 93.158; 90;  

COD ID: 4516058
CIF file Formula: - C25 H26 F N O4 -
Comments: Hu, Xing-Mei; Zhou, Bei; Yang, Chang-Long; Lin, Jun; Yan, Sheng-Jiao Site-Selective Reaction of Enaminones and Enamine Esters for the Synthesis of Novel Diverse Morphan Derivatives. ACS omega 3(6) (2018) 5994-6005
Space group: P 1 21/c 1
Cell volume: 2115.8
Cell parameters: 11.1233; 16.7726; 12.5093; 90; 114.965; 90;  

COD ID: 4516059
CIF file Formula: - C63.5 H118 N12 O16.5 -
Comments: Tsuji, Genichiro; Misawa, Takashi; Doi, Mitsunobu; Demizu, Yosuke Extent of Helical Induction Caused by Introducing α-Aminoisobutyric Acid into an Oligovaline Sequence. ACS omega 3(6) (2018) 6395-6399
Space group: P 1
Cell volume: 3796
Cell parameters: 10.612; 17.232; 21.162; 88.192; 87.296; 79.182;  

COD ID: 4516060
CIF file Formula: - C24 H36 Cl2 N Nb O3 -
Comments: Srisupap, Natta; Wised, Kritdikul; Tsutsumi, Ken; Nomura, Kotohiro Synthesis of (Arylmido)niobium(V) Complexes Containing Ketimide, Phenoxide Ligands, and Some Reactions with Phenols and Alcohols. ACS omega 3(6) (2018) 6166-6181
Space group: P 1 21/c 1
Cell volume: 2625.5
Cell parameters: 13.572; 9.116; 21.854; 90; 103.824; 90;  

COD ID: 4516061
CIF file Formula: - C30 H32 Cl2 N Nb O3 -
Comments: Srisupap, Natta; Wised, Kritdikul; Tsutsumi, Ken; Nomura, Kotohiro Synthesis of (Arylmido)niobium(V) Complexes Containing Ketimide, Phenoxide Ligands, and Some Reactions with Phenols and Alcohols. ACS omega 3(6) (2018) 6166-6181
Space group: P -1
Cell volume: 1505.05
Cell parameters: 9.9108; 12.5655; 13.0149; 95.967; 101.025; 106.341;  

COD ID: 4516062
CIF file Formula: - C39 H64 Cl2 N3 Nb O -
Comments: Srisupap, Natta; Wised, Kritdikul; Tsutsumi, Ken; Nomura, Kotohiro Synthesis of (Arylmido)niobium(V) Complexes Containing Ketimide, Phenoxide Ligands, and Some Reactions with Phenols and Alcohols. ACS omega 3(6) (2018) 6166-6181
Space group: P 1 21/c 1
Cell volume: 4107.5
Cell parameters: 15.469; 10.6814; 24.897; 90; 93.169; 90;  

COD ID: 4516063
CIF file Formula: - C40 H66 N3 Nb O -
Comments: Srisupap, Natta; Wised, Kritdikul; Tsutsumi, Ken; Nomura, Kotohiro Synthesis of (Arylmido)niobium(V) Complexes Containing Ketimide, Phenoxide Ligands, and Some Reactions with Phenols and Alcohols. ACS omega 3(6) (2018) 6166-6181
Space group: P -1
Cell volume: 4022.2
Cell parameters: 12.5502; 14.0719; 23.5634; 89.366; 88.443; 75.219;  

COD ID: 4516064
CIF file Formula: - C45 H55 F15 N3 Nb O3 -
Comments: Srisupap, Natta; Wised, Kritdikul; Tsutsumi, Ken; Nomura, Kotohiro Synthesis of (Arylmido)niobium(V) Complexes Containing Ketimide, Phenoxide Ligands, and Some Reactions with Phenols and Alcohols. ACS omega 3(6) (2018) 6166-6181
Space group: P -1
Cell volume: 2699.58
Cell parameters: 11.3778; 12.9307; 18.995; 86.879; 81.525; 77.672;  

COD ID: 4516065
CIF file Formula: - C39 H64 F9 N4 Nb O -
Comments: Srisupap, Natta; Wised, Kritdikul; Tsutsumi, Ken; Nomura, Kotohiro Synthesis of (Arylmido)niobium(V) Complexes Containing Ketimide, Phenoxide Ligands, and Some Reactions with Phenols and Alcohols. ACS omega 3(6) (2018) 6166-6181
Space group: P 1 21/n 1
Cell volume: 4333.79
Cell parameters: 11.7181; 18.3197; 20.1982; 90; 91.823; 90;  

COD ID: 4516066
CIF file Formula: - C32 H48 F12 N3 Nb O2 -
Comments: Srisupap, Natta; Wised, Kritdikul; Tsutsumi, Ken; Nomura, Kotohiro Synthesis of (Arylmido)niobium(V) Complexes Containing Ketimide, Phenoxide Ligands, and Some Reactions with Phenols and Alcohols. ACS omega 3(6) (2018) 6166-6181
Space group: P 1 21/n 1
Cell volume: 3834.6
Cell parameters: 17.905; 12.0354; 19.691; 90; 115.352; 90;  

COD ID: 4516067
CIF file Formula: - C41 H64 F5 N4 Nb O -
Comments: Srisupap, Natta; Wised, Kritdikul; Tsutsumi, Ken; Nomura, Kotohiro Synthesis of (Arylmido)niobium(V) Complexes Containing Ketimide, Phenoxide Ligands, and Some Reactions with Phenols and Alcohols. ACS omega 3(6) (2018) 6166-6181
Space group: P 1 21/n 1
Cell volume: 4349
Cell parameters: 11.903; 18.13; 20.798; 90; 104.299; 90;  

COD ID: 4516068
CIF file Formula: - C72 H78 Al2 Er2 N6 O18 -
Comments: Peng, Yan; Mereacre, Valeriu; Anson, Christopher E.; Powell, Annie K. Butterfly M<sub>2</sub><sup>III</sup>Er<sub>2</sub> (M<sup>III</sup> = Fe and Al) SMMs: Synthesis, Characterization, and Magnetic Properties. ACS omega 3(6) (2018) 6360-6368
Space group: C 1 2/c 1
Cell volume: 7204.05
Cell parameters: 27.6738; 10.7124; 24.3659; 90; 94.188; 90;  

COD ID: 4516069
CIF file Formula: - C72 H78 Er2 Fe2 N6 O18 -
Comments: Peng, Yan; Mereacre, Valeriu; Anson, Christopher E.; Powell, Annie K. Butterfly M<sub>2</sub><sup>III</sup>Er<sub>2</sub> (M<sup>III</sup> = Fe and Al) SMMs: Synthesis, Characterization, and Magnetic Properties. ACS omega 3(6) (2018) 6360-6368
Space group: C 1 2/c 1
Cell volume: 7345.5
Cell parameters: 28.6269; 10.5683; 24.3695; 90; 94.926; 90;  

COD ID: 4516070
CIF file Formula: - C14 H19 Br O Ti -
Comments: Boyde, Nicholas C.; Steelman, Grant W.; Hanusa, Timothy P. Multicomponent Mechanochemical Synthesis of Cyclopentadienyl Titanium <i>tert</i>-Butoxy Halides, Cp <sub> <i>x</i> </sub> TiX <sub> <i>y</i> </sub> (O <sup> <i>t</i> </sup> Bu)<sub>4-(<i>x</i>+<i>y</i>)</sub> (<i>x</i>, <i>y</i> = 1, 2; X = Cl, Br). ACS omega 3(7) (2018) 8149-8159
Space group: P 1 21/c 1
Cell volume: 2868.45
Cell parameters: 15.0669; 12.2725; 15.5128; 90; 90.079; 90;  

COD ID: 4516071
CIF file Formula: - C14 H19 Cl O Ti -
Comments: Boyde, Nicholas C.; Steelman, Grant W.; Hanusa, Timothy P. Multicomponent Mechanochemical Synthesis of Cyclopentadienyl Titanium <i>tert</i>-Butoxy Halides, Cp <sub> <i>x</i> </sub> TiX <sub> <i>y</i> </sub> (O <sup> <i>t</i> </sup> Bu)<sub>4-(<i>x</i>+<i>y</i>)</sub> (<i>x</i>, <i>y</i> = 1, 2; X = Cl, Br). ACS omega 3(7) (2018) 8149-8159
Space group: P b c a
Cell volume: 2758.4
Cell parameters: 15.01162; 11.84446; 15.51368; 90; 90; 90;  

COD ID: 4516072
CIF file Formula: - C9 H14 Br2 O Ti -
Comments: Boyde, Nicholas C.; Steelman, Grant W.; Hanusa, Timothy P. Multicomponent Mechanochemical Synthesis of Cyclopentadienyl Titanium <i>tert</i>-Butoxy Halides, Cp <sub> <i>x</i> </sub> TiX <sub> <i>y</i> </sub> (O <sup> <i>t</i> </sup> Bu)<sub>4-(<i>x</i>+<i>y</i>)</sub> (<i>x</i>, <i>y</i> = 1, 2; X = Cl, Br). ACS omega 3(7) (2018) 8149-8159
Space group: P 1 21/c 1
Cell volume: 2464.41
Cell parameters: 12.9173; 16.12491; 12.6854; 90; 111.141; 90;  

COD ID: 4516073
CIF file Formula: - C10.91 H12.73 Cl1.09 O0.91 Ti -
Comments: Boyde, Nicholas C.; Steelman, Grant W.; Hanusa, Timothy P. Multicomponent Mechanochemical Synthesis of Cyclopentadienyl Titanium <i>tert</i>-Butoxy Halides, Cp <sub> <i>x</i> </sub> TiX <sub> <i>y</i> </sub> (O <sup> <i>t</i> </sup> Bu)<sub>4-(<i>x</i>+<i>y</i>)</sub> (<i>x</i>, <i>y</i> = 1, 2; X = Cl, Br). ACS omega 3(7) (2018) 8149-8159
Space group: P b c a
Cell volume: 2092.94
Cell parameters: 12.489; 11.4556; 14.6289; 90; 90; 90;  

COD ID: 4516074
CIF file Formula: - C12 H15 Cl O Ti -
Comments: Boyde, Nicholas C.; Steelman, Grant W.; Hanusa, Timothy P. Multicomponent Mechanochemical Synthesis of Cyclopentadienyl Titanium <i>tert</i>-Butoxy Halides, Cp <sub> <i>x</i> </sub> TiX <sub> <i>y</i> </sub> (O <sup> <i>t</i> </sup> Bu)<sub>4-(<i>x</i>+<i>y</i>)</sub> (<i>x</i>, <i>y</i> = 1, 2; X = Cl, Br). ACS omega 3(7) (2018) 8149-8159
Space group: P 1 21/n 1
Cell volume: 1125.5
Cell parameters: 7.9901; 17.6571; 7.9779; 90; 90.444; 90;  

COD ID: 4516075
CIF file Formula: - C13 H17 Cl O Ti -
Comments: Boyde, Nicholas C.; Steelman, Grant W.; Hanusa, Timothy P. Multicomponent Mechanochemical Synthesis of Cyclopentadienyl Titanium <i>tert</i>-Butoxy Halides, Cp <sub> <i>x</i> </sub> TiX <sub> <i>y</i> </sub> (O <sup> <i>t</i> </sup> Bu)<sub>4-(<i>x</i>+<i>y</i>)</sub> (<i>x</i>, <i>y</i> = 1, 2; X = Cl, Br). ACS omega 3(7) (2018) 8149-8159
Space group: P n m a
Cell volume: 1303.6
Cell parameters: 13.089; 10.6775; 9.3276; 90; 90; 90;  

COD ID: 4516076
CIF file Formula: - C16 H10 F N O2 -
Comments: Saraiah, Bonagiri; Gautam, Vibha; Acharya, Anand; Pasha, Mohamed Afzal; Ila, Hiriyakkanavar One-Pot Synthesis of 2-(Het)aryl/alkyl-3-cyanobenzofurans from 2-(2-Bromoaryl)-3-(het)aryl-3-(methylthio)acrylonitriles and Benzyl Carbamate. ACS omega 3(7) (2018) 8355-8364
Space group: P -1
Cell volume: 632.4
Cell parameters: 7.9674; 8.6081; 10.2555; 87.587; 76.718; 67.665;  

COD ID: 4516077
CIF file Formula: - C10 H12 N4 -
Comments: Yunusova, Sevilya N.; Bolotin, Dmitrii S.; Suslonov, Vitalii V.; Vovk, Mikhail A.; Tolstoy, Peter M.; Kukushkin, Vadim Yu 3-Dialkylamino-1,2,4-triazoles via Zn<sup>II</sup>-Catalyzed Acyl Hydrazide-Dialkylcyanamide Coupling. ACS omega 3(7) (2018) 7224-7234
Space group: I 41/a :2
Cell volume: 3912.7
Cell parameters: 13.7647; 13.7647; 20.651; 90; 90; 90;  

COD ID: 4516078
CIF file Formula: - C10 H12 N4 -
Comments: Yunusova, Sevilya N.; Bolotin, Dmitrii S.; Suslonov, Vitalii V.; Vovk, Mikhail A.; Tolstoy, Peter M.; Kukushkin, Vadim Yu 3-Dialkylamino-1,2,4-triazoles via Zn<sup>II</sup>-Catalyzed Acyl Hydrazide-Dialkylcyanamide Coupling. ACS omega 3(7) (2018) 7224-7234
Space group: P -1
Cell volume: 955.83
Cell parameters: 8.4665; 10.312; 11.9037; 100.24; 103.121; 103.246;  

COD ID: 4516079
CIF file Formula: - C10 H13 Cl N4 O -
Comments: Yunusova, Sevilya N.; Bolotin, Dmitrii S.; Suslonov, Vitalii V.; Vovk, Mikhail A.; Tolstoy, Peter M.; Kukushkin, Vadim Yu 3-Dialkylamino-1,2,4-triazoles via Zn<sup>II</sup>-Catalyzed Acyl Hydrazide-Dialkylcyanamide Coupling. ACS omega 3(7) (2018) 7224-7234
Space group: I 1 2/c 1
Cell volume: 2298.8
Cell parameters: 13.8204; 7.1084; 24.264; 90; 105.34; 90;  

COD ID: 4516080
CIF file Formula: - C11 H14 N4 O -
Comments: Yunusova, Sevilya N.; Bolotin, Dmitrii S.; Suslonov, Vitalii V.; Vovk, Mikhail A.; Tolstoy, Peter M.; Kukushkin, Vadim Yu 3-Dialkylamino-1,2,4-triazoles via Zn<sup>II</sup>-Catalyzed Acyl Hydrazide-Dialkylcyanamide Coupling. ACS omega 3(7) (2018) 7224-7234
Space group: I 41/a :2
Cell volume: 4515
Cell parameters: 14.9349; 14.9349; 20.242; 90; 90; 90;  

COD ID: 4516081
CIF file Formula: - C12 H16 N4 -
Comments: Yunusova, Sevilya N.; Bolotin, Dmitrii S.; Suslonov, Vitalii V.; Vovk, Mikhail A.; Tolstoy, Peter M.; Kukushkin, Vadim Yu 3-Dialkylamino-1,2,4-triazoles via Zn<sup>II</sup>-Catalyzed Acyl Hydrazide-Dialkylcyanamide Coupling. ACS omega 3(7) (2018) 7224-7234
Space group: P -1
Cell volume: 1199.33
Cell parameters: 8.6523; 11.7604; 12.8395; 75.686; 82.561; 71.602;  

COD ID: 4516082
CIF file Formula: - C12 H14 N4 -
Comments: Yunusova, Sevilya N.; Bolotin, Dmitrii S.; Suslonov, Vitalii V.; Vovk, Mikhail A.; Tolstoy, Peter M.; Kukushkin, Vadim Yu 3-Dialkylamino-1,2,4-triazoles via Zn<sup>II</sup>-Catalyzed Acyl Hydrazide-Dialkylcyanamide Coupling. ACS omega 3(7) (2018) 7224-7234
Space group: I 41/a :2
Cell volume: 4494.72
Cell parameters: 14.81904; 14.81904; 20.4674; 90; 90; 90;  

COD ID: 4516083
CIF file Formula: - C22 H18 N2 -
Comments: Salfeena, Chettiyan Thodi F.; Jalaja, Renjitha; Davis, Rincy; Suresh, Eringathodi; Somappa, Sasidhar B. Synthesis of 1,2,4-Trisubstituted-(1<i>H</i>)-imidazoles through Cu(OTf)<sub>2</sub>-/I<sub>2</sub>-Catalyzed C-C Bond Cleavage of Chalcones and Benzylamines. ACS omega 3(7) (2018) 8074-8082
Space group: P 1 21/n 1
Cell volume: 1627
Cell parameters: 9.7088; 11.3662; 14.8567; 90; 97.069; 90;  

COD ID: 4516084
CIF file Formula: - C17 H16 O13 -
Comments: Tokutomi, Hisashi; Takeda, Takashi; Hoshino, Norihisa; Akutagawa, Tomoyuki Molecular Structure of the Photo-Oxidation Product of Ellagic Acid in Solution. ACS omega 3(9) (2018) 11179-11183
Space group: P c a 21
Cell volume: 3524.14
Cell parameters: 19.3428; 6.4501; 28.2467; 90; 90; 90;  

COD ID: 4516085
CIF file Formula: - C26.67 H27 F6 N5.33 O P Ru -
Comments: Nakagawa, Yoko; Imokawa, Yusuke; Fujisawa, Ikuhide; Nakayama, Naofumi; Goto, Hitoshi; Chanthamath, Soda; Shibatomi, Kazutaka; Iwasa, Seiji Ligand Exchange Reaction on a Ru(II)-Pheox Complex as a Mechanistic Study of Catalytic Reactions. ACS omega 3(9) (2018) 11286-11289
Space group: R 3 :H
Cell volume: 6878
Cell parameters: 28.322; 28.322; 9.9011; 90; 90; 120;  

COD ID: 4516086
CIF file Formula: - C38 H26 N2 O6 Zn -
Comments: Dutta, Basudeb; Dey, Arka; Maity, Suvendu; Sinha, Chittaranjan; Ray, Partha Pratim; Mir, Mohammad Hedayetullah Supramolecular Assembly of a Zn(II)-Based 1D Coordination Polymer through Hydrogen Bonding and π···π Interactions: Crystal Structure and Device Applications. ACS omega 3(9) (2018) 12060-12067
Space group: P 1 c 1
Cell volume: 3118.3
Cell parameters: 15.9559; 20.5495; 9.8687; 90; 105.489; 90;  

COD ID: 4516087
CIF file Formula: - C20 H19 N3 O3 -
Comments: Chennapuram, Madhu; Owolabi, Isiaka Alade; Seki, Chigusa; Okuyama, Yuko; Kwon, Eunsang; Uwai, Koji; Tokiwa, Michio; Takeshita, Mitsuhiro; Nakano, Hiroto New Hybrid-type Squaramide-Fused Amino Alcohol Organocatalyst for Enantioselective Domino Michael Addition/Cyclization Reaction of Oxoindolines with Cyclic 1,3-Diketones. ACS omega 3(9) (2018) 11718-11726
Space group: P 1 21 1
Cell volume: 857.46
Cell parameters: 6.79795; 9.9618; 12.8161; 90; 98.897; 90;  

COD ID: 4516088
CIF file Formula: - C14 H15 N O2 -
Comments: Bai, Hairui; Liu, Fujun; Wang, Xiaojing; Wang, Ping; Huang, Chao Three-Component One-Pot Approach to Highly Efficient and Sustainable Synthesis of the Functionalized Quinolones via Linear/Branched Domino Protocols, Key Synthetic Methods for the Floxacin of Quinolone Drugs. ACS omega 3(9) (2018) 11233-11251
Space group: P 1 21/n 1
Cell volume: 2441.5
Cell parameters: 12.6496; 9.9333; 19.755; 90; 100.395; 90;  

COD ID: 4516089
CIF file Formula: - C32 H56 N6 Ni2 O20 -
Comments: Kumar, Navnita; Khullar, Sadhika; Mandal, Sanjay K. Encapsulation of a Water Octamer Chain in a Chiral 2D Sheetlike Supramolecular Coordination Network Composed of Dinickel-Dicarboxylate Subunits. ACS omega 3(9) (2018) 11062-11070
Space group: C 1 2 1
Cell volume: 2124.67
Cell parameters: 20.1803; 6.2496; 17.1447; 90; 100.701; 90;  

COD ID: 4516090
CIF file Formula: - C36 H48 Cl2 O2 S2 Ti -
Comments: Lapenta, Rosita; Buonerba, Antonio; Luciano, Ermanno; Della Monica, Francesco; De Nisi, Assunta; Monari, Magda; Grassi, Alfonso; Capacchione, Carmine; Milione, Stefano Phenylene-Bridged OSSO-Type Titanium Complexes in the Polymerization of Ethylene and Propylene. ACS omega 3(9) (2018) 11608-11616
Space group: P 1 21/c 1
Cell volume: 3617.3
Cell parameters: 14.2494; 15.1062; 17.1323; 90; 101.223; 90;  

COD ID: 4516091
CIF file Formula: - C64 H40 Cl2 O12 P2 Re2 S4 -
Comments: Procopio, Elsa Quartapelle; Dova, Davide; Cauteruccio, Silvia; Forni, Alessandra; Licandro, Emanuela; Panigati, Monica Dirhenium Coordination Complex Endowed with an Intrinsically Chiral Helical-Shaped Diphosphine Oxide. ACS omega 3(9) (2018) 11649-11654
Space group: P 1 21/n 1
Cell volume: 6320
Cell parameters: 19.755; 13.633; 24.145; 90; 103.603; 90;  

COD ID: 4516092
CIF file Formula: - C21 H23 N3 O -
Comments: Fanna, Daniel J.; Lima, Luís M P; Craze, Alexander R.; Trinchi, Adrian; Wuhrer, Richard; Lindoy, Leonard F.; Wei, Gang; Reynolds, Jason K.; Li, Feng Ultrasensitive Colorimetric and Ratiometric Detection of Cu<sup>2+</sup>: Acid-Base Properties, Complexation, and Binding Studies. ACS omega 3(9) (2018) 10471-10480
Space group: P b c n
Cell volume: 3500.9
Cell parameters: 25.524; 13.835; 9.914; 90; 90; 90;  

COD ID: 4516093
CIF file Formula: - C22 H30 N4 O2 -
Comments: Ghosh, Milan; Ta, Sabyasachi; Banerjee, Mahuya; Das, Debasis Metal-Ion Displacement Approach for Optical Recognition of Thorium: Application of a Molybdenum(VI) Complex for Nanomolar Determination and Enrichment of Th(IV). ACS omega 3(11) (2018) 16089-16098
Space group: P -1
Cell volume: 508.6
Cell parameters: 6.898; 8.2874; 9.6802; 79.149; 69.618; 83.152;  

COD ID: 4516094
CIF file Formula: - C35 H51 Mo2 N6 O10 -
Comments: Ghosh, Milan; Ta, Sabyasachi; Banerjee, Mahuya; Das, Debasis Metal-Ion Displacement Approach for Optical Recognition of Thorium: Application of a Molybdenum(VI) Complex for Nanomolar Determination and Enrichment of Th(IV). ACS omega 3(11) (2018) 16089-16098
Space group: P -1
Cell volume: 1958.5
Cell parameters: 12.6435; 12.8892; 13.5633; 65.757; 76.834; 81.409;  

COD ID: 4516095
CIF file Formula: - C34 H29 I N O4 -
Comments: Yaragorla, Srinivasarao; Bag, Debojyoti; Dada, Ravikrishna; Jose, K. V. Jovan Iodo-Cycloisomerization of Aryl(indol-3-yl)methane-Tethered Propargyl Alcohols to 3-Iodocarbazoles via Selective 1,2-Alkyl Migration. ACS omega 3(11) (2018) 15024-15034
Space group: I 1 2/a 1
Cell volume: 5892.3
Cell parameters: 14.6664; 10.081; 40.221; 90; 97.759; 90;  

COD ID: 4516096
CIF file Formula: - C36 H27 I N2 O -
Comments: Yaragorla, Srinivasarao; Bag, Debojyoti; Dada, Ravikrishna; Jose, K. V. Jovan Iodo-Cycloisomerization of Aryl(indol-3-yl)methane-Tethered Propargyl Alcohols to 3-Iodocarbazoles via Selective 1,2-Alkyl Migration. ACS omega 3(11) (2018) 15024-15034
Space group: P 1 21/c 1
Cell volume: 3161.1
Cell parameters: 15.8788; 9.357; 21.2905; 90; 92.12; 90;  

COD ID: 4516097
CIF file Formula: - C48 H37 I N2 O2 -
Comments: Yaragorla, Srinivasarao; Bag, Debojyoti; Dada, Ravikrishna; Jose, K. V. Jovan Iodo-Cycloisomerization of Aryl(indol-3-yl)methane-Tethered Propargyl Alcohols to 3-Iodocarbazoles via Selective 1,2-Alkyl Migration. ACS omega 3(11) (2018) 15024-15034
Space group: P 1 21/c 1
Cell volume: 3841.3
Cell parameters: 11.5071; 38.741; 9.4077; 90; 113.662; 90;  

COD ID: 4516098
CIF file Formula: - C67 H82 B2 Cl4 F8 N4 O4 Ru2 -
Comments: César, Vincent; Mallardo, Valentina; Nano, Adela; DePeter, Sadie F.; Bastin, Stéphanie; Sournia-Saquet, Alix; Maisse-François, Aline; Lugan, Noël; Bellemin-Laponnaz, Stéphane Homo- and Heteropolymetallic Complexes of the Hybrid, Ambidentate N-Heterocyclic Carbene Ligand IMes-acac. ACS omega 3(11) (2018) 15582-15591
Space group: P 1 21/n 1
Cell volume: 3637.1
Cell parameters: 10.653; 19.224; 17.802; 90; 93.951; 90;  

COD ID: 4516099
CIF file Formula: - Cs2 Hg2 Sb2 Se6 -
Comments: Du, Cui-Xia; Qi, Fei-Yan; Chen, Juan; Baiyin, Menghe Two Mercury Antimony Chalcogenides Cs<sub>2</sub>HgSb<sub>4</sub>S<sub>8</sub> and Cs<sub>2</sub>Hg<sub>2</sub>Sb<sub>2</sub>Se<sub>6</sub> with Cesium Cations as Counterions. ACS omega 3(11) (2018) 15168-15173
Space group: P -1
Cell volume: 770.5
Cell parameters: 8.029; 8.869; 12.091; 68.492; 84.217; 74.128;  

COD ID: 4516100
CIF file Formula: - Cs2 Hg S8 Sb4 -
Comments: Du, Cui-Xia; Qi, Fei-Yan; Chen, Juan; Baiyin, Menghe Two Mercury Antimony Chalcogenides Cs<sub>2</sub>HgSb<sub>4</sub>S<sub>8</sub> and Cs<sub>2</sub>Hg<sub>2</sub>Sb<sub>2</sub>Se<sub>6</sub> with Cesium Cations as Counterions. ACS omega 3(11) (2018) 15168-15173
Space group: P -1
Cell volume: 901.4
Cell parameters: 7.3196; 10.6224; 11.7739; 99.51; 92.06; 92.1;  

COD ID: 4516101
CIF file Formula: - C0 H0 Cs2 Hg N0 O0 S8 Sb4 -
Comments: Du, Cui-Xia; Qi, Fei-Yan; Chen, Juan; Baiyin, Menghe Two Mercury Antimony Chalcogenides Cs<sub>2</sub>HgSb<sub>4</sub>S<sub>8</sub> and Cs<sub>2</sub>Hg<sub>2</sub>Sb<sub>2</sub>Se<sub>6</sub> with Cesium Cations as Counterions. ACS omega 3(11) (2018) 15168-15173
Space group: P -1
Cell volume: 901.4
Cell parameters: 7.3196; 10.6224; 11.7739; 99.51; 92.06; 92.1;  

COD ID: 4516102
CIF file Formula: - Cs2 Hg2 Sb2 Se6 -
Comments: Du, Cui-Xia; Qi, Fei-Yan; Chen, Juan; Baiyin, Menghe Two Mercury Antimony Chalcogenides Cs<sub>2</sub>HgSb<sub>4</sub>S<sub>8</sub> and Cs<sub>2</sub>Hg<sub>2</sub>Sb<sub>2</sub>Se<sub>6</sub> with Cesium Cations as Counterions. ACS omega 3(11) (2018) 15168-15173
Space group: P -1
Cell volume: 770.5
Cell parameters: 8.029; 8.869; 12.091; 68.492; 84.217; 74.128;  

COD ID: 4516103
CIF file Formula: - C46 H46 Cl6 S8 Si4 -
Comments: Li, Bingbing; Zhang, Sheng; Li, Lu; Ma, Zhiying; Li, Chunli; Xu, Li; Wang, Hua All-Thiophene-Based Double Helix: Synthesis, Crystal Structure, Chiroptical Property and Arylation. ACS omega 3(11) (2018) 16014-16020
Space group: P -1
Cell volume: 2798.6
Cell parameters: 11.9267; 15.095; 17.872; 108.373; 105.652; 101.258;  

COD ID: 4516104
CIF file Formula: - C15 H18 Cu3 I6 N3 -
Comments: Wheaton, Amelia M.; Streep, Michaela E.; Ohlhaver, Christopher M.; Nicholas, Aaron D.; Barnes, Francis H.; Patterson, Howard H.; Pike, Robert D. Alkyl Pyridinium Iodocuprate(I) Clusters: Structural Types and Charge Transfer Behavior. ACS omega 3(11) (2018) 15281-15292
Space group: P 1 21/m 1
Cell volume: 1335.28
Cell parameters: 8.804; 14.0866; 11.5559; 90; 111.296; 90;  

COD ID: 4516105
CIF file Formula: - C18 H27 Cu6 I8 N3 -
Comments: Wheaton, Amelia M.; Streep, Michaela E.; Ohlhaver, Christopher M.; Nicholas, Aaron D.; Barnes, Francis H.; Patterson, Howard H.; Pike, Robert D. Alkyl Pyridinium Iodocuprate(I) Clusters: Structural Types and Charge Transfer Behavior. ACS omega 3(11) (2018) 15281-15292
Space group: P 1 21/n 1
Cell volume: 3593.4
Cell parameters: 13.9901; 10.819; 24.0532; 90; 99.243; 90;  

COD ID: 4516106
CIF file Formula: - C36 H56 Cu10 I14 N4 -
Comments: Wheaton, Amelia M.; Streep, Michaela E.; Ohlhaver, Christopher M.; Nicholas, Aaron D.; Barnes, Francis H.; Patterson, Howard H.; Pike, Robert D. Alkyl Pyridinium Iodocuprate(I) Clusters: Structural Types and Charge Transfer Behavior. ACS omega 3(11) (2018) 15281-15292
Space group: P 1 21/c 1
Cell volume: 6495.3
Cell parameters: 10.455; 26.2454; 23.854; 90; 97.093; 90;  

COD ID: 4516107
CIF file Formula: - C46 H75 Cu10 I14 N5 -
Comments: Wheaton, Amelia M.; Streep, Michaela E.; Ohlhaver, Christopher M.; Nicholas, Aaron D.; Barnes, Francis H.; Patterson, Howard H.; Pike, Robert D. Alkyl Pyridinium Iodocuprate(I) Clusters: Structural Types and Charge Transfer Behavior. ACS omega 3(11) (2018) 15281-15292
Space group: C 1 2/c 1
Cell volume: 7507.5
Cell parameters: 33.6214; 10.7706; 25.1921; 90; 124.618; 90;  

COD ID: 4516108
CIF file Formula: - C20 H29 Cl2 Cu5 I7 N3 -
Comments: Wheaton, Amelia M.; Streep, Michaela E.; Ohlhaver, Christopher M.; Nicholas, Aaron D.; Barnes, Francis H.; Patterson, Howard H.; Pike, Robert D. Alkyl Pyridinium Iodocuprate(I) Clusters: Structural Types and Charge Transfer Behavior. ACS omega 3(11) (2018) 15281-15292
Space group: P 1 21/c 1
Cell volume: 3786.3
Cell parameters: 14.4604; 10.8225; 25.1937; 90; 106.194; 90;  

COD ID: 4516109
CIF file Formula: - C20 H29 Br2 Cu5 I7 N3 -
Comments: Wheaton, Amelia M.; Streep, Michaela E.; Ohlhaver, Christopher M.; Nicholas, Aaron D.; Barnes, Francis H.; Patterson, Howard H.; Pike, Robert D. Alkyl Pyridinium Iodocuprate(I) Clusters: Structural Types and Charge Transfer Behavior. ACS omega 3(11) (2018) 15281-15292
Space group: P 1 21/c 1
Cell volume: 7498.4
Cell parameters: 28.346; 11.4404; 24.058; 90; 106.029; 90;  

COD ID: 4516110
CIF file Formula: - C18 H26 Cu3 I7 N2 -
Comments: Wheaton, Amelia M.; Streep, Michaela E.; Ohlhaver, Christopher M.; Nicholas, Aaron D.; Barnes, Francis H.; Patterson, Howard H.; Pike, Robert D. Alkyl Pyridinium Iodocuprate(I) Clusters: Structural Types and Charge Transfer Behavior. ACS omega 3(11) (2018) 15281-15292
Space group: P -1
Cell volume: 1585.08
Cell parameters: 9.1888; 11.3217; 16.2778; 73.591; 77.461; 87.998;  

COD ID: 4516111
CIF file Formula: - C22 H29 Cu5 I7 N5 -
Comments: Wheaton, Amelia M.; Streep, Michaela E.; Ohlhaver, Christopher M.; Nicholas, Aaron D.; Barnes, Francis H.; Patterson, Howard H.; Pike, Robert D. Alkyl Pyridinium Iodocuprate(I) Clusters: Structural Types and Charge Transfer Behavior. ACS omega 3(11) (2018) 15281-15292
Space group: P 1 21/c 1
Cell volume: 3688.5
Cell parameters: 14.1523; 10.6793; 25.264; 90; 104.984; 90;  

COD ID: 4516112
CIF file Formula: - C21 H33.5 Cu5 I7 N2.5 O2 -
Comments: Wheaton, Amelia M.; Streep, Michaela E.; Ohlhaver, Christopher M.; Nicholas, Aaron D.; Barnes, Francis H.; Patterson, Howard H.; Pike, Robert D. Alkyl Pyridinium Iodocuprate(I) Clusters: Structural Types and Charge Transfer Behavior. ACS omega 3(11) (2018) 15281-15292
Space group: C 1 2/c 1
Cell volume: 7583.2
Cell parameters: 36.7069; 10.6697; 24.9824; 90; 129.192; 90;  

COD ID: 4516113
CIF file Formula: - C34 H28 Br2 Cl N3 Pd -
Comments: Mollar-Cuni, Andrés; Ventura-Espinosa, David; Martín, Santiago; Mayoral, Álvaro; Borja, Pilar; Mata, Jose A. Stabilization of Nanoparticles Produced by Hydrogenation of Palladium-N-Heterocyclic Carbene Complexes on the Surface of Graphene and Implications in Catalysis. ACS omega 3(11) (2018) 15217-15228
Space group: P -1
Cell volume: 1493.48
Cell parameters: 9.14864; 11.5032; 15.6073; 72.6495; 81.6726; 72.6336;  

COD ID: 4516114
CIF file Formula: - C48 H40 Co F12 N8 O8 P2 -
Comments: Emhoff, Kylin A.; Balaraman, Lakshmi; Simpson, Sydney R.; Stromyer, Michael L.; Kalil, Haitham F.; Beemiller, James R.; Sikatzki, Philipp; Eshelman, Teya S.; Salem, Ahmed M. H.; DeBord, Michael A.; Panzner, Matthew J.; Youngs, Wiley J.; Boyd, W. Christopher Synthesis and Characterization of Cobalt(II) <i>N</i>,<i>N</i>'-Diphenylazodioxide Complexes. ACS omega 3(11) (2018) 16021-16027
Space group: I 41/a :2
Cell volume: 5007.5
Cell parameters: 12.8106; 12.8106; 30.5131; 90; 90; 90;  

COD ID: 4516115
CIF file Formula: - C35 H30 Cl2 Co F12 N6 O4 P2 -
Comments: Emhoff, Kylin A.; Balaraman, Lakshmi; Simpson, Sydney R.; Stromyer, Michael L.; Kalil, Haitham F.; Beemiller, James R.; Sikatzki, Philipp; Eshelman, Teya S.; Salem, Ahmed M. H.; DeBord, Michael A.; Panzner, Matthew J.; Youngs, Wiley J.; Boyd, W. Christopher Synthesis and Characterization of Cobalt(II) <i>N</i>,<i>N</i>'-Diphenylazodioxide Complexes. ACS omega 3(11) (2018) 16021-16027
Space group: C 1 2/c 1
Cell volume: 9278.2
Cell parameters: 28.0797; 13.4393; 25.3112; 90; 103.746; 90;  

COD ID: 4516116
CIF file Formula: - C22 H18 Mn N4 O10 -
Comments: Roy, Manasi; Adhikary, Amit; Mondal, Amit Kumar; Mondal, Raju Multifunctional Properties of a 1D Helical Co(II) Coordination Polymer: Toward Single-Ion Magnetic Behavior and Efficient Dye Degradation. ACS omega 3(11) (2018) 15315-15324
Space group: P b c a
Cell volume: 2249.9
Cell parameters: 7.5725; 11.9171; 24.932; 90; 90; 90;  

COD ID: 4516117
CIF file Formula: - C22 H18 Co N4 O10 -
Comments: Roy, Manasi; Adhikary, Amit; Mondal, Amit Kumar; Mondal, Raju Multifunctional Properties of a 1D Helical Co(II) Coordination Polymer: Toward Single-Ion Magnetic Behavior and Efficient Dye Degradation. ACS omega 3(11) (2018) 15315-15324
Space group: P b c a
Cell volume: 2198
Cell parameters: 7.4271; 11.953; 24.759; 90; 90; 90;  

COD ID: 4516118
CIF file Formula: - C55 H47 Co2 N10 O10 -
Comments: Roy, Manasi; Adhikary, Amit; Mondal, Amit Kumar; Mondal, Raju Multifunctional Properties of a 1D Helical Co(II) Coordination Polymer: Toward Single-Ion Magnetic Behavior and Efficient Dye Degradation. ACS omega 3(11) (2018) 15315-15324
Space group: P 1 21/n 1
Cell volume: 2839.1
Cell parameters: 10.0616; 10.8559; 26.2066; 90; 97.322; 90;  

COD ID: 4516119
CIF file Formula: - C30 H27 N O -
Comments: Chen, Jianfeng; Tian, Jiaxin; Liu, Feng; Liu, Yong; Zhao, Guoqing; Yuan, Weicheng; Zhao, Baoguo Intramolecular Umpolung Synthesis of Exocyclic β-Amino Alcohols through Decarboxylative Amination. ACS omega 3(11) (2018) 14671-14679
Space group: P -1
Cell volume: 1136
Cell parameters: 8.9867; 9.0117; 14.865; 99.135; 106.863; 90.159;  

COD ID: 4516120
CIF file Formula: - C16 H14 Cl N O2 -
Comments: Chen, Jianfeng; Tian, Jiaxin; Liu, Feng; Liu, Yong; Zhao, Guoqing; Yuan, Weicheng; Zhao, Baoguo Intramolecular Umpolung Synthesis of Exocyclic β-Amino Alcohols through Decarboxylative Amination. ACS omega 3(11) (2018) 14671-14679
Space group: P 21 21 21
Cell volume: 1351.8
Cell parameters: 4.6994; 11.1712; 25.7495; 90; 90; 90;  

COD ID: 4516121
CIF file Formula: - C55 H54 B Br Cl9 F4 N5 O9 P2 Pd -
Comments: Leitão, Maria Inês P S; Herrera, Federico; Petronilho, Ana N-Heterocyclic Carbenes Derived from Guanosine: Synthesis and Evidences of Their Antiproliferative Activity. ACS omega 3(11) (2018) 15653-15656
Space group: P 1
Cell volume: 3312.32
Cell parameters: 14.1735; 14.6182; 17.4983; 110.609; 92.046; 100.845;  

COD ID: 4516122
CIF file Formula: - C15 H12 N2 -
Comments: Mohamady, Samy; Kralt, Braden; Samwel, Shery K.; Taylor, Scott D. Efficient One-Pot, Two-Component Modular Synthesis of 3,5-Disubstituted Pyrazoles. ACS omega 3(11) (2018) 15566-15574
Space group: C 1 2/c 1
Cell volume: 4834.6
Cell parameters: 16.9414; 17.1524; 17.6605; 90; 109.597; 90;  

COD ID: 4516123
CIF file Formula: - C22 H18 N2 O3 -
Comments: Cai, Panyuan; Zhang, Enshen; Wu, Yinsong; Fang, Taibei; Li, Qianqian; Yang, Chen; Wang, Jian; Shang, Yongjia Ru(II)/Ir(III)-Catalyzed C-H Bond Activation/Annulation of Cyclic Amides with 1,3-Diketone-2-diazo Compounds: Facile Access to 8<i>H</i>-Isoquinolino[1,2-<i>b</i>]quinazolin-8-ones and Phthalazino[2,3-<i>a</i>]cinnoline-8,13-diones. ACS omega 3(11) (2018) 14575-14584
Space group: P b c a
Cell volume: 3487.2
Cell parameters: 15.6529; 9.5364; 23.3615; 90; 90; 90;  

COD ID: 4516124
CIF file Formula: - C21 H16 N2 O2 -
Comments: Cai, Panyuan; Zhang, Enshen; Wu, Yinsong; Fang, Taibei; Li, Qianqian; Yang, Chen; Wang, Jian; Shang, Yongjia Ru(II)/Ir(III)-Catalyzed C-H Bond Activation/Annulation of Cyclic Amides with 1,3-Diketone-2-diazo Compounds: Facile Access to 8<i>H</i>-Isoquinolino[1,2-<i>b</i>]quinazolin-8-ones and Phthalazino[2,3-<i>a</i>]cinnoline-8,13-diones. ACS omega 3(11) (2018) 14575-14584
Space group: P b c a
Cell volume: 3113.13
Cell parameters: 16.3607; 8.454; 22.5078; 90; 90; 90;  

COD ID: 4516125
CIF file Formula: - C39 H21 Fe N8 O2 Sn -
Comments: Konarev, Dmitri V.; Kuzmin, Alexey V.; Batov, Mikhail S.; Khasanov, Salavat S.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Lyubovskaya, Rimma N. {CpFe<sup>II</sup>(CO)<sub>2</sub>Sn<sup>II</sup>(Macrocycle<sup>•3-</sup>)} Radicals with Intrinsic Charge Transfer from CpFe(CO)<sub>2</sub> to Macrocycles (Cp: Cp or Cp*); Effective Magnetic Coupling between Radical Trianionic Macrocycles<sup>•3</sup>. ACS omega 3(11) (2018) 14875-14888
Space group: P 1 21/c 1
Cell volume: 3126.16
Cell parameters: 13.9836; 20.8953; 11.0131; 90; 103.717; 90;  

COD ID: 4516126
CIF file Formula: - C39 H21 Fe N8 O2 Sn -
Comments: Konarev, Dmitri V.; Kuzmin, Alexey V.; Batov, Mikhail S.; Khasanov, Salavat S.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Lyubovskaya, Rimma N. {CpFe<sup>II</sup>(CO)<sub>2</sub>Sn<sup>II</sup>(Macrocycle<sup>•3-</sup>)} Radicals with Intrinsic Charge Transfer from CpFe(CO)<sub>2</sub> to Macrocycles (Cp: Cp or Cp*); Effective Magnetic Coupling between Radical Trianionic Macrocycles<sup>•3</sup>. ACS omega 3(11) (2018) 14875-14888
Space group: P -1
Cell volume: 1535.85
Cell parameters: 11.7126; 11.7544; 12.9014; 108.604; 101.649; 105.849;  

COD ID: 4516127
CIF file Formula: - C47 H33 Cl Fe N8 O2 Sn -
Comments: Konarev, Dmitri V.; Kuzmin, Alexey V.; Batov, Mikhail S.; Khasanov, Salavat S.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Lyubovskaya, Rimma N. {CpFe<sup>II</sup>(CO)<sub>2</sub>Sn<sup>II</sup>(Macrocycle<sup>•3-</sup>)} Radicals with Intrinsic Charge Transfer from CpFe(CO)<sub>2</sub> to Macrocycles (Cp: Cp or Cp*); Effective Magnetic Coupling between Radical Trianionic Macrocycles<sup>•3</sup>. ACS omega 3(11) (2018) 14875-14888
Space group: P -1
Cell volume: 2029.38
Cell parameters: 10.3737; 11.6856; 16.95; 90.491; 91.962; 98.758;  

COD ID: 4516128
CIF file Formula: - C72 H47 Cl4 Fe N8 O2 Sn -
Comments: Konarev, Dmitri V.; Kuzmin, Alexey V.; Batov, Mikhail S.; Khasanov, Salavat S.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Lyubovskaya, Rimma N. {CpFe<sup>II</sup>(CO)<sub>2</sub>Sn<sup>II</sup>(Macrocycle<sup>•3-</sup>)} Radicals with Intrinsic Charge Transfer from CpFe(CO)<sub>2</sub> to Macrocycles (Cp: Cp or Cp*); Effective Magnetic Coupling between Radical Trianionic Macrocycles<sup>•3</sup>. ACS omega 3(11) (2018) 14875-14888
Space group: P -1
Cell volume: 2943.4
Cell parameters: 11.6681; 16.5135; 16.9193; 66.775; 86.024; 79.263;  

COD ID: 4516129
CIF file Formula: - C51 H33 Fe N4 O2 Sn -
Comments: Konarev, Dmitri V.; Kuzmin, Alexey V.; Batov, Mikhail S.; Khasanov, Salavat S.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Lyubovskaya, Rimma N. {CpFe<sup>II</sup>(CO)<sub>2</sub>Sn<sup>II</sup>(Macrocycle<sup>•3-</sup>)} Radicals with Intrinsic Charge Transfer from CpFe(CO)<sub>2</sub> to Macrocycles (Cp: Cp or Cp*); Effective Magnetic Coupling between Radical Trianionic Macrocycles<sup>•3</sup>. ACS omega 3(11) (2018) 14875-14888
Space group: P -1
Cell volume: 1894.66
Cell parameters: 11.2634; 11.312; 14.9929; 90.824; 91.078; 97.186;  

COD ID: 4516130
CIF file Formula: - C39 H21 Fe In N8 O2 -
Comments: Konarev, Dmitri V.; Kuzmin, Alexey V.; Batov, Mikhail S.; Khasanov, Salavat S.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Lyubovskaya, Rimma N. {CpFe<sup>II</sup>(CO)<sub>2</sub>Sn<sup>II</sup>(Macrocycle<sup>•3-</sup>)} Radicals with Intrinsic Charge Transfer from CpFe(CO)<sub>2</sub> to Macrocycles (Cp: Cp or Cp*); Effective Magnetic Coupling between Radical Trianionic Macrocycles<sup>•3</sup>. ACS omega 3(11) (2018) 14875-14888
Space group: P 1 21/c 1
Cell volume: 3164.91
Cell parameters: 13.977; 21.1365; 11.0927; 90; 105.033; 90;  

COD ID: 4516131
CIF file Formula: - C32 H63 Cl3 Cu2 N11 O12.5 -
Comments: Invernici, Michele; Ciarrocchi, Carlo; Dondi, Daniele; Fabbrizzi, Luigi; Lazzaroni, Simone; Licchelli, Maurizio; Boiocchi, Massimo; Bonizzoni, Marco Bimacrocyclic Effect in Anion Recognition by a Copper(II) Bicyclam Complex. ACS omega 3(11) (2018) 15692-15701
Space group: P b c n
Cell volume: 9380.8
Cell parameters: 24.6695; 18.6531; 20.3858; 90; 90; 90;  

COD ID: 4516132
CIF file Formula: - C23 H18 N6 -
Comments: Banerji, Biswadip; Chandrasekhar, Kadaiahgari; Sreenath, Kancham; Roy, Saheli; Nag, Sayoni; Saha, Krishna Das Synthesis of Triazole-Substituted Quinazoline Hybrids for Anticancer Activity and a Lead Compound as the EGFR Blocker and ROS Inducer Agent. ACS omega 3(11) (2018) 16134-16142
Space group: P n a 21
Cell volume: 1929.7
Cell parameters: 12.7702; 28.911; 5.2268; 90; 90; 90;  

COD ID: 4516133
CIF file Formula: - C24 H14 N2 O -
Comments: Tabasi, Zahra A.; Younes, Eyad A.; Walsh, Joshua C.; Thompson, David W.; Bodwell, Graham J.; Zhao, Yuming Pyrenoimidazolyl-Benzaldehyde Fluorophores: Synthesis, Properties, and Sensing Function for Fluoride Anions. ACS omega 3(11) (2018) 16387-16397
Space group: P 1 21/c 1
Cell volume: 1585.89
Cell parameters: 15.833; 6.44809; 15.5345; 90; 90.5223; 90;  

COD ID: 4516134
CIF file Formula: - C28 H26 N2 O3 S2 -
Comments: Tabasi, Zahra A.; Younes, Eyad A.; Walsh, Joshua C.; Thompson, David W.; Bodwell, Graham J.; Zhao, Yuming Pyrenoimidazolyl-Benzaldehyde Fluorophores: Synthesis, Properties, and Sensing Function for Fluoride Anions. ACS omega 3(11) (2018) 16387-16397
Space group: P 1 21/n 1
Cell volume: 2420.25
Cell parameters: 13.7747; 8.1613; 22.0303; 90; 102.249; 90;  

COD ID: 4516135
CIF file Formula: - C34 H32 Cl2 Cu2 N6 P2 -
Comments: Kumar, Saurabh; Mondal, Dipanjan; Balakrishna, Maravanji S. Diverse Architectures and Luminescence Properties of Group 11 Complexes Containing Pyrimidine-Based Phosphine, <i>N</i>-((Diphenylphosphine)methyl)pyrimidin-2-amine. ACS omega 3(12) (2018) 16601-16614
Space group: P 1 21/n 1
Cell volume: 1638.22
Cell parameters: 13.4961; 7.3977; 17.2981; 90; 108.456; 90;  

COD ID: 4516136
CIF file Formula: - C17 H16 Br Cu N3 P -
Comments: Kumar, Saurabh; Mondal, Dipanjan; Balakrishna, Maravanji S. Diverse Architectures and Luminescence Properties of Group 11 Complexes Containing Pyrimidine-Based Phosphine, <i>N</i>-((Diphenylphosphine)methyl)pyrimidin-2-amine. ACS omega 3(12) (2018) 16601-16614
Space group: P 1 21/n 1
Cell volume: 1691.34
Cell parameters: 13.4532; 7.4445; 17.5935; 90; 106.285; 90;  

COD ID: 4516137
CIF file Formula: - C38 H38 Cu4 I4 N8 P2 -
Comments: Kumar, Saurabh; Mondal, Dipanjan; Balakrishna, Maravanji S. Diverse Architectures and Luminescence Properties of Group 11 Complexes Containing Pyrimidine-Based Phosphine, <i>N</i>-((Diphenylphosphine)methyl)pyrimidin-2-amine. ACS omega 3(12) (2018) 16601-16614
Space group: P -1
Cell volume: 1118.36
Cell parameters: 9.636; 10.2333; 12.8232; 69.01; 81.979; 71.386;  

COD ID: 4516138
CIF file Formula: - C36 H32 Ag2 F6 N6 O6 P2 S2 -
Comments: Kumar, Saurabh; Mondal, Dipanjan; Balakrishna, Maravanji S. Diverse Architectures and Luminescence Properties of Group 11 Complexes Containing Pyrimidine-Based Phosphine, <i>N</i>-((Diphenylphosphine)methyl)pyrimidin-2-amine. ACS omega 3(12) (2018) 16601-16614
Space group: P 21 21 21
Cell volume: 4038.4
Cell parameters: 9.3162; 18.1124; 23.9326; 90; 90; 90;  

COD ID: 4516139
CIF file Formula: - C34 H32 Ag2 B2 F8 N6 P2 -
Comments: Kumar, Saurabh; Mondal, Dipanjan; Balakrishna, Maravanji S. Diverse Architectures and Luminescence Properties of Group 11 Complexes Containing Pyrimidine-Based Phosphine, <i>N</i>-((Diphenylphosphine)methyl)pyrimidin-2-amine. ACS omega 3(12) (2018) 16601-16614
Space group: P -1
Cell volume: 890.77
Cell parameters: 9.3737; 10.3726; 11.0196; 108.252; 102.115; 110.351;  

COD ID: 4516140
CIF file Formula: - C17 H16 Au Cl N3 P -
Comments: Kumar, Saurabh; Mondal, Dipanjan; Balakrishna, Maravanji S. Diverse Architectures and Luminescence Properties of Group 11 Complexes Containing Pyrimidine-Based Phosphine, <i>N</i>-((Diphenylphosphine)methyl)pyrimidin-2-amine. ACS omega 3(12) (2018) 16601-16614
Space group: P 1 21/c 1
Cell volume: 3490.7
Cell parameters: 19.4767; 8.5915; 20.9829; 90; 96.19; 90;  

COD ID: 4516141
CIF file Formula: - C32 H48 Bi2 Br10 N4 -
Comments: Moon, Tae Hwan; Oh, Seung-Jin; Ok, Kang Min [((<i>R</i>)-C<sub>8</sub>H<sub>12</sub>N)<sub>4</sub>][Bi<sub>2</sub>Br<sub>10</sub>] and [((<i>S</i>)-C<sub>8</sub>H<sub>12</sub>N)<sub>4</sub>][Bi<sub>2</sub>Br<sub>10</sub>]: Chiral Hybrid Bismuth Bromides Templated by Chiral Organic Cations. ACS omega 3(12) (2018) 17895-17903
Space group: P 1 21 1
Cell volume: 2441.2
Cell parameters: 11.9962; 14.6765; 13.8899; 90; 93.394; 90;  

COD ID: 4516142
CIF file Formula: - C32 H48 Bi2 Br10 N4 -
Comments: Moon, Tae Hwan; Oh, Seung-Jin; Ok, Kang Min [((<i>R</i>)-C<sub>8</sub>H<sub>12</sub>N)<sub>4</sub>][Bi<sub>2</sub>Br<sub>10</sub>] and [((<i>S</i>)-C<sub>8</sub>H<sub>12</sub>N)<sub>4</sub>][Bi<sub>2</sub>Br<sub>10</sub>]: Chiral Hybrid Bismuth Bromides Templated by Chiral Organic Cations. ACS omega 3(12) (2018) 17895-17903
Space group: P 1 21 1
Cell volume: 2458.6
Cell parameters: 11.997; 14.728; 13.94; 90; 93.44; 90;  

COD ID: 4516143
CIF file Formula: - C22 H13 F2 I O2 S -
Comments: Zhang, Jitan; Liang, Zhenda; Wang, Jun; Guo, Ziyi; Liu, Changqing; Xie, Meihua Metal-Free Synthesis of Functionalized Tetrasubstituted Alkenes by Three-Component Reaction of Alkynes, Iodine, and Sodium Sulfinates. ACS omega 3(12) (2018) 18002-18015
Space group: P 1 21/n 1
Cell volume: 2059.7
Cell parameters: 15.127; 9.2725; 15.5544; 90; 109.256; 90;  

COD ID: 4516144
CIF file Formula: - C22 H17 I O3 S -
Comments: Zhang, Jitan; Liang, Zhenda; Wang, Jun; Guo, Ziyi; Liu, Changqing; Xie, Meihua Metal-Free Synthesis of Functionalized Tetrasubstituted Alkenes by Three-Component Reaction of Alkynes, Iodine, and Sodium Sulfinates. ACS omega 3(12) (2018) 18002-18015
Space group: P n a 21
Cell volume: 2071
Cell parameters: 17.286; 8.3835; 14.2909; 90; 90; 90;  

COD ID: 4516145
CIF file Formula: - C17 H16 Br I O3 S -
Comments: Zhang, Jitan; Liang, Zhenda; Wang, Jun; Guo, Ziyi; Liu, Changqing; Xie, Meihua Metal-Free Synthesis of Functionalized Tetrasubstituted Alkenes by Three-Component Reaction of Alkynes, Iodine, and Sodium Sulfinates. ACS omega 3(12) (2018) 18002-18015
Space group: P -1
Cell volume: 888.96
Cell parameters: 8.3914; 10.1833; 11.436; 66.578; 82.676; 85.465;  

COD ID: 4516146
CIF file Formula: - C11 H16 N O13 P Pb2 S -
Comments: Cai, Xiao-Ou; Sun, Meng; Shao, Yu-Jing; Liu, Fang; Liu, Qun-Li; Zhu, Yan-Yu; Sun, Zhen-Gang; Dong, Da-Peng; Li, Jing Two Highly Stable Luminescent Lead Phosphonates Based on Mixed Ligands: Highly Selective and Sensitive Sensing for Thymine Molecule and VO<sub>3</sub><sup>-</sup> Anion. ACS omega 3(12) (2018) 16443-16452
Space group: P -1
Cell volume: 914.16
Cell parameters: 8.9059; 10.388; 11.1079; 64.715; 88.475; 80.124;  

COD ID: 4516147
CIF file Formula: - C17 H28 N2 O16 P2 Pb3 S -
Comments: Cai, Xiao-Ou; Sun, Meng; Shao, Yu-Jing; Liu, Fang; Liu, Qun-Li; Zhu, Yan-Yu; Sun, Zhen-Gang; Dong, Da-Peng; Li, Jing Two Highly Stable Luminescent Lead Phosphonates Based on Mixed Ligands: Highly Selective and Sensitive Sensing for Thymine Molecule and VO<sub>3</sub><sup>-</sup> Anion. ACS omega 3(12) (2018) 16443-16452
Space group: P -1
Cell volume: 1494.3
Cell parameters: 9.4266; 12.5779; 13.2779; 100.972; 90.825; 104.333;  

COD ID: 4516148
CIF file Formula: - C28 H32 F N O2 S -
Comments: Okolo, ChrisTina; Ali, Mohamad Akbar; Newman, Matthew; Chambers, Steven A.; Whitt, Jedidiah; Alsharif, Zakeyah A.; Day, Victor W.; Alam, Mohammad A. Hexafluoroisopropanol-Mediated Domino Reaction for the Synthesis of Thiazolo-androstenones: Potent Anticancer Agents. ACS omega 3(12) (2018) 17991-18001
Space group: P 1 21 1
Cell volume: 1192.7
Cell parameters: 10.19; 6.636; 18.242; 90; 104.79; 90;  

COD ID: 4516149
CIF file Formula: - C26 H28 F N O S -
Comments: Okolo, ChrisTina; Ali, Mohamad Akbar; Newman, Matthew; Chambers, Steven A.; Whitt, Jedidiah; Alsharif, Zakeyah A.; Day, Victor W.; Alam, Mohammad A. Hexafluoroisopropanol-Mediated Domino Reaction for the Synthesis of Thiazolo-androstenones: Potent Anticancer Agents. ACS omega 3(12) (2018) 17991-18001
Space group: P 21 21 21
Cell volume: 2147.9
Cell parameters: 7.212; 8.116; 36.696; 90; 90; 90;  

COD ID: 4516150
CIF file Formula: - C26 H28 Br N O S -
Comments: Okolo, ChrisTina; Ali, Mohamad Akbar; Newman, Matthew; Chambers, Steven A.; Whitt, Jedidiah; Alsharif, Zakeyah A.; Day, Victor W.; Alam, Mohammad A. Hexafluoroisopropanol-Mediated Domino Reaction for the Synthesis of Thiazolo-androstenones: Potent Anticancer Agents. ACS omega 3(12) (2018) 17991-18001
Space group: P 21 21 21
Cell volume: 20110
Cell parameters: 9.5976; 37.906; 55.277; 90; 90; 90;  

COD ID: 4516151
CIF file Formula: - C26 H28 F N O S -
Comments: Okolo, ChrisTina; Ali, Mohamad Akbar; Newman, Matthew; Chambers, Steven A.; Whitt, Jedidiah; Alsharif, Zakeyah A.; Day, Victor W.; Alam, Mohammad A. Hexafluoroisopropanol-Mediated Domino Reaction for the Synthesis of Thiazolo-androstenones: Potent Anticancer Agents. ACS omega 3(12) (2018) 17991-18001
Space group: P 1 21 1
Cell volume: 1061.1
Cell parameters: 9.603; 7.0203; 15.771; 90; 93.616; 90;  

COD ID: 4516152
CIF file Formula: - C22 H21 N O2 S -
Comments: Mane, Vaijinath; Baiju, Thekke V.; Namboothiri, Irishi N. N. Synthesis of Functionalized Thieno[2,3-<i>b</i>]indoles via One-Pot Reaction of Indoline-2-thiones with Morita-Baylis-Hillman and Rauhut-Currier Adducts of Nitroalkenes. ACS omega 3(12) (2018) 17617-17628
Space group: P 1 21/n 1
Cell volume: 1809.31
Cell parameters: 11.8883; 7.4114; 20.6224; 90; 95.281; 90;  

COD ID: 4516153
CIF file Formula: - C28 H33 N3 O4 S -
Comments: Mane, Vaijinath; Baiju, Thekke V.; Namboothiri, Irishi N. N. Synthesis of Functionalized Thieno[2,3-<i>b</i>]indoles via One-Pot Reaction of Indoline-2-thiones with Morita-Baylis-Hillman and Rauhut-Currier Adducts of Nitroalkenes. ACS omega 3(12) (2018) 17617-17628
Space group: P 1 21/c 1
Cell volume: 2761.1
Cell parameters: 15.959; 8.47; 21.482; 90; 108.034; 90;  


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