Crystallography Open Database

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4505740 CIFC21 H19 N3 O3P 1 21 110.9128; 6.0767; 13.7533
90; 94.08; 90
909.72Jagadish, Bhumasamudram; Carducci, Michael D.; Bosshard, Christian; Günter, Peter; Margolis, Jason I.; Williams, Lawrence J.; Mash, Eugene A.
Organic Crystal Engineering with Piperazine-2,5-diones. 4. Crystal Packing of Piperazinediones Derived from 2-Amino-7-cyano-4-methoxyindan-2-carboxylic Acid
Crystal Growth & Design, 2003, 3, 811
4505741 CIFC30 H38 N4 O7 S3C 1 2 116.4321; 10.3701; 12.2684
90; 130.242; 90
1595.78Jagadish, Bhumasamudram; Carducci, Michael D.; Bosshard, Christian; Günter, Peter; Margolis, Jason I.; Williams, Lawrence J.; Mash, Eugene A.
Organic Crystal Engineering with Piperazine-2,5-diones. 4. Crystal Packing of Piperazinediones Derived from 2-Amino-7-cyano-4-methoxyindan-2-carboxylic Acid
Crystal Growth & Design, 2003, 3, 811
4505742 CIFC30 H38 N4 O7 S3C 1 2/c 121.156; 8.8635; 18.64
90; 110.286; 90
3278.5Jagadish, Bhumasamudram; Carducci, Michael D.; Bosshard, Christian; Günter, Peter; Margolis, Jason I.; Williams, Lawrence J.; Mash, Eugene A.
Organic Crystal Engineering with Piperazine-2,5-diones. 4. Crystal Packing of Piperazinediones Derived from 2-Amino-7-cyano-4-methoxyindan-2-carboxylic Acid
Crystal Growth & Design, 2003, 3, 811
4505743 CIFC30 H38 N4 O7 S3P 1 21/n 119.919; 11.9916; 28.951
90; 108.562; 90
6555.5Jagadish, Bhumasamudram; Carducci, Michael D.; Bosshard, Christian; Günter, Peter; Margolis, Jason I.; Williams, Lawrence J.; Mash, Eugene A.
Organic Crystal Engineering with Piperazine-2,5-diones. 4. Crystal Packing of Piperazinediones Derived from 2-Amino-7-cyano-4-methoxyindan-2-carboxylic Acid
Crystal Growth & Design, 2003, 3, 811
4505744 CIFC36 H48 N4 O6 S2P 110.0589; 13.158; 15.7738
70.127; 76.419; 78.161
1890.5Jagadish, Bhumasamudram; Carducci, Michael D.; Bosshard, Christian; Günter, Peter; Margolis, Jason I.; Williams, Lawrence J.; Mash, Eugene A.
Organic Crystal Engineering with Piperazine-2,5-diones. 4. Crystal Packing of Piperazinediones Derived from 2-Amino-7-cyano-4-methoxyindan-2-carboxylic Acid
Crystal Growth & Design, 2003, 3, 811
4505745 CIFC27 H8 F16 S2P b c a12.157; 18.073; 22.72
90; 90; 90
4992Morimoto, Masakazu; Kobatake, Seiya; Irie, Masahiro
Aryl−Perfluoroaryl Interaction in Photochromic Diarylethene Crystals
Crystal Growth & Design, 2003, 3, 847
4505746 CIFC30 H11 F16 S2P -18.565; 12.886; 12.896
91.569; 101.802; 100.209
1368.2Morimoto, Masakazu; Kobatake, Seiya; Irie, Masahiro
Aryl−Perfluoroaryl Interaction in Photochromic Diarylethene Crystals
Crystal Growth & Design, 2003, 3, 847
4505747 CIFC37 H16 F16 S2C 1 2/c 129.337; 8.0513; 31.583
90; 117.188; 90
6636Morimoto, Masakazu; Kobatake, Seiya; Irie, Masahiro
Aryl−Perfluoroaryl Interaction in Photochromic Diarylethene Crystals
Crystal Growth & Design, 2003, 3, 847
4505748 CIFC14 H20 N6 Ni S4P -17.4343; 8.6973; 9.772
64.74; 70.307; 89.487
531.2Fourmigué, Marc; Mézière, Cécile; Dolou, Sébastien
Bifurcated Hydrogen Bonds as a Key Feature in the Solid State Organization of Paramagnetic Dithiolene Complexes
Crystal Growth & Design, 2003, 3, 805
4505749 CIFC11.8 H12 N5 Ni O0.4 S4P -111.4302; 13.7495; 15.4235
86.097; 80.736; 70.242
2251.3Fourmigué, Marc; Mézière, Cécile; Dolou, Sébastien
Bifurcated Hydrogen Bonds as a Key Feature in the Solid State Organization of Paramagnetic Dithiolene Complexes
Crystal Growth & Design, 2003, 3, 805
4505750 CIFC13 H6 N5 Ni S4P 1 21/c 116.5462; 6.3851; 17.4351
90; 118.047; 90
1625.7Fourmigué, Marc; Mézière, Cécile; Dolou, Sébastien
Bifurcated Hydrogen Bonds as a Key Feature in the Solid State Organization of Paramagnetic Dithiolene Complexes
Crystal Growth & Design, 2003, 3, 805
4505751 CIFC9 H12 N3 Ni S4P 1 21/c 18.9923; 15.603; 10.8481
90; 112.439; 90
1406.8Fourmigué, Marc; Mézière, Cécile; Dolou, Sébastien
Bifurcated Hydrogen Bonds as a Key Feature in the Solid State Organization of Paramagnetic Dithiolene Complexes
Crystal Growth & Design, 2003, 3, 805
4505752 CIFC11 H8 N3 Ni S4P -18.5003; 9.2896; 10.054
83.58; 76.04; 81.09
758.9Fourmigué, Marc; Mézière, Cécile; Dolou, Sébastien
Bifurcated Hydrogen Bonds as a Key Feature in the Solid State Organization of Paramagnetic Dithiolene Complexes
Crystal Growth & Design, 2003, 3, 805
4505753 CIFC16 H15 N O6P 1 21/n 17.7352; 23.0212; 8.315
90; 106.454; 90
1420Barooah, Nilotpal; Sarma, Rupam J.; Baruah, Jubaraj B.
Adducts of 2-Hydroxyethylphthalimide with 1,3-Dihydroxybenene and 1,3,5-Trihydroxybenzene
Crystal Growth & Design, 2003, 3, 639
4505754 CIFC16 H15 N O5C 1 2/c 123.306; 8.0979; 15.7049
90; 98.781; 90
2929.2Barooah, Nilotpal; Sarma, Rupam J.; Baruah, Jubaraj B.
Adducts of 2-Hydroxyethylphthalimide with 1,3-Dihydroxybenene and 1,3,5-Trihydroxybenzene
Crystal Growth & Design, 2003, 3, 639
4505755 CIFC9 H20 Ag Cl O4 S2P 1 21/c 18.774; 17.261; 10.025
90; 96.903; 90
1507.3Li, Jian-Rong; Zhang, Ruo-Hua; Bu, Xian-He
Structural Diversities of Silver(I) Coordination Compounds with Flexible Dithioether Ligands Based upon Changing the Ligand Spacers
Crystal Growth & Design, 2003, 3, 829
4505756 CIFC30 H66 Ag2 Cl2 O8 S6R -3 :H11.735; 11.735; 28.352
90; 90; 120
3381.3Li, Jian-Rong; Zhang, Ruo-Hua; Bu, Xian-He
Structural Diversities of Silver(I) Coordination Compounds with Flexible Dithioether Ligands Based upon Changing the Ligand Spacers
Crystal Growth & Design, 2003, 3, 829
4505757 CIFC11 H24 Ag Cl N0 O4 S2P 1 21/n 18.973; 11.276; 17.26
90; 94.843; 90
1740.1Li, Jian-Rong; Zhang, Ruo-Hua; Bu, Xian-He
Structural Diversities of Silver(I) Coordination Compounds with Flexible Dithioether Ligands Based upon Changing the Ligand Spacers
Crystal Growth & Design, 2003, 3, 829
4505758 CIFC18 H39 Ag Cl O4 S3P 1 21/n 110.971; 13.751; 17.288
90; 90.978; 90
2608Li, Jian-Rong; Zhang, Ruo-Hua; Bu, Xian-He
Structural Diversities of Silver(I) Coordination Compounds with Flexible Dithioether Ligands Based upon Changing the Ligand Spacers
Crystal Growth & Design, 2003, 3, 829
4505759 CIFC13 H28 Ag Cl O4 S2P -19.316; 9.699; 11.033
72.942; 87.615; 85.065
949.4Li, Jian-Rong; Zhang, Ruo-Hua; Bu, Xian-He
Structural Diversities of Silver(I) Coordination Compounds with Flexible Dithioether Ligands Based upon Changing the Ligand Spacers
Crystal Growth & Design, 2003, 3, 829
4505760 CIFC18 H16 Br2 F16 N2P -15.5807; 6.1359; 18.425
92.881; 92.386; 90.412
629.55Liantonio, Rosalba; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Stevenazzi, Andrea
Perfluorocarbon−Hydrocarbon Self-Assembly: First Crystalline Halogen-Bonded Complex Involving Bromoperfluoroalkanes
Crystal Growth & Design, 2003, 3, 799
4506416 CIFC15 H13 I O3 S2P n a 219.0219; 5.1183; 34.1133
90; 90; 90
1575.24Lee, Mijoon; Ikejiri, Masahiro; Klimpel, Dennis; Toth, Marta; Espahbodi, Mana; Hesek, Dusan; Forbes, Christopher; Kumarasiri, Malika; Noll, Bruce C.; Chang, Mayland; Mobashery, Shahriar
Structure-Activity Relationship for Thiirane-Based Gelatinase Inhibitors.
ACS medicinal chemistry letters, 2012, 3, 490-495
4506417 CIFC15 H9 F5 O3 S2C 1 2/c 121.3874; 5.5765; 26.7076
90; 100.485; 90
3132.1Lee, Mijoon; Ikejiri, Masahiro; Klimpel, Dennis; Toth, Marta; Espahbodi, Mana; Hesek, Dusan; Forbes, Christopher; Kumarasiri, Malika; Noll, Bruce C.; Chang, Mayland; Mobashery, Shahriar
Structure-Activity Relationship for Thiirane-Based Gelatinase Inhibitors.
ACS medicinal chemistry letters, 2012, 3, 490-495
4506418 CIFC15 H9 F4 I O3 S2P 1 21/n 116.9301; 5.6351; 18.5698
90; 111.768; 90
1645.28Lee, Mijoon; Ikejiri, Masahiro; Klimpel, Dennis; Toth, Marta; Espahbodi, Mana; Hesek, Dusan; Forbes, Christopher; Kumarasiri, Malika; Noll, Bruce C.; Chang, Mayland; Mobashery, Shahriar
Structure-Activity Relationship for Thiirane-Based Gelatinase Inhibitors.
ACS medicinal chemistry letters, 2012, 3, 490-495
4506419 CIFC16 H17 N O5 S3P 1 c 116.7476; 5.3576; 9.8572
90; 100.589; 90
869.39Lee, Mijoon; Ikejiri, Masahiro; Klimpel, Dennis; Toth, Marta; Espahbodi, Mana; Hesek, Dusan; Forbes, Christopher; Kumarasiri, Malika; Noll, Bruce C.; Chang, Mayland; Mobashery, Shahriar
Structure-Activity Relationship for Thiirane-Based Gelatinase Inhibitors.
ACS medicinal chemistry letters, 2012, 3, 490-495
4506420 CIFC15 H16 N2 O5 S3P -15.7099; 10.7256; 15.2849
107.324; 95.601; 99.714
869.86Lee, Mijoon; Ikejiri, Masahiro; Klimpel, Dennis; Toth, Marta; Espahbodi, Mana; Hesek, Dusan; Forbes, Christopher; Kumarasiri, Malika; Noll, Bruce C.; Chang, Mayland; Mobashery, Shahriar
Structure-Activity Relationship for Thiirane-Based Gelatinase Inhibitors.
ACS medicinal chemistry letters, 2012, 3, 490-495
4507431 CIFC192 H144 Cu4 N28 O12A b a 226.531; 29.2825; 21.2848
90; 90; 90
16536He, Qi-Ting; Li, Xiang-Ping; Chen, Lian-Fen; Zhang, Li; Wang, Wei; Su, Cheng-Yong
Nanosized Coordination Cages Incorporating Multiple Cu(I) Reactive Sites: Host‒Guest Modulated Catalytic Activity
ACS Catalysis, 2013, 3, 1
4507432 CIFC100 H80 Cu4 N20 O22P -113.373; 13.767; 14.926
104.973; 103.729; 109.545
2338.2He, Qi-Ting; Li, Xiang-Ping; Chen, Lian-Fen; Zhang, Li; Wang, Wei; Su, Cheng-Yong
Nanosized Coordination Cages Incorporating Multiple Cu(I) Reactive Sites: Host–Guest Modulated Catalytic Activity
ACS Catalysis, 2013, 3, 1
4507433 CIFC46 H50 Cl2 F5 N3 O3 RuP 1 21/n 124.2414; 12.5158; 30.0577
90; 106.816; 90
8729.6Nelson, David J.; Queval, Pierre; Rouen, Mathieu; Magrez, Magaly; Toupet, Loïc; Caijo, Frédéric; Borré, Etienne; Laurent, Isabelle; Crévisy, Christophe; Baslé, Olivier; Mauduit, Marc; Percy, Jonathan M.
Synergic Effects Between N-Heterocyclic Carbene and Chelating Benzylidene‒Ether Ligands Toward the Initiation Step of Hoveyda‒Grubbs Type Ru Complexes
ACS Catalysis, 2013, 3, 259-264
4507438 CIFC14 H8 Br Fe2 N O6 S2P -17.6922; 10.824; 11.227
74.383; 86.307; 80.513
887.7Dey, Subal; Rana, Atanu; Dey, Somdatta Ghosh; Dey, Abhishek
Electrochemical Hydrogen Production in Acidic Water by an Azadithiolate Bridged Synthetic Hydrogenese Mimic: Role of Aqueous Solvation in Lowering Overpotential
ACS Catalysis, 2013, 3, 429
4507767 CIFC20 H18 N2 O3P 1 21/n 110.5224; 8.7192; 20.0164
90; 102.322; 90
1794.1Zhang, Xiao-Nan; Shi, Min
Phosphine-Catalyzed [3 + 2] Cycloaddition of 4,4-Dicyano-2-methylenebut-3-enoates with Benzyl Buta-2,3-dienoate and Penta-3,4-dien-2-one
ACS Catalysis, 2013, 3, 507
4507768 CIFC11 H13 F3 N2 O7P 21 21 216.0338; 7.3229; 32.512
90; 90; 90
1436.5Wen, Lele; Yin, Liang; Shen, Qilong; Lu, Long
Enantioselective Organocatalytic Michael Addition of Nitroalkanes and Other Nucleophiles to β-Trifluoromethylated Acrylamides
ACS Catalysis, 2013, 3, 502
4507769 CIFC10 H11 F3 O4P 1 21 15.2612; 8.0356; 26.8522
90; 90.009; 90
1135.23Wen, Lele; Yin, Liang; Shen, Qilong; Lu, Long
Enantioselective Organocatalytic Michael Addition of Nitroalkanes and Other Nucleophiles to β-Trifluoromethylated Acrylamides
ACS Catalysis, 2013, 3, 502
4507770 CIFC7 H10 F3 N O3P 43 21 27.0694; 7.0694; 35.24
90; 90; 90
1761.2Wen, Lele; Yin, Liang; Shen, Qilong; Lu, Long
Enantioselective Organocatalytic Michael Addition of Nitroalkanes and Other Nucleophiles to β-Trifluoromethylated Acrylamides
ACS Catalysis, 2013, 3, 502
4507771 CIFC8 H12 F3 N O3P 21 21 216.4729; 7.3947; 21.763
90; 90; 90
1041.7Wen, Lele; Yin, Liang; Shen, Qilong; Lu, Long
Enantioselective Organocatalytic Michael Addition of Nitroalkanes and Other Nucleophiles to β-Trifluoromethylated Acrylamides
ACS Catalysis, 2013, 3, 502
4507772 CIFC12 H12 F3 N O3 SP 15.1139; 6.3453; 11.289
82.575; 79.056; 68.124
333.07Wen, Lele; Yin, Liang; Shen, Qilong; Lu, Long
Enantioselective Organocatalytic Michael Addition of Nitroalkanes and Other Nucleophiles to β-Trifluoromethylated Acrylamides
ACS Catalysis, 2013, 3, 502
4507773 CIFC19 H19 Cl2 N O2 SP -17.077; 7.792; 17.241
83.163; 83.039; 75.993
911.7Cheng, Jiajia; Tang, Xinjun; Ma, Shengming
Highly Selective FeCl3-Catalyzed Cyclization of β-Sulfonamidoallenes or β-Allenols and Aldehydes
ACS Catalysis, 2013, 3, 663
4507774 CIFC16 H22 Cl N O2 SP b c a14.8823; 15.0709; 15.0819
90; 90; 90
3382.7Cheng, Jiajia; Tang, Xinjun; Ma, Shengming
Highly Selective FeCl3-Catalyzed Cyclization of β-Sulfonamidoallenes or β-Allenols and Aldehydes
ACS Catalysis, 2013, 3, 663
4507775 CIFC22 H18 Br N O4 SP 21 21 218.6638; 10.6945; 21.769
90; 90; 90
2017Jia, Min-Qiang; You, Shu-Li
N-Heterocyclic Carbene-Catalyzed Enantioselective Intramolecular N-Tethered Aldehyde–Ketone Benzoin Reactions
ACS Catalysis, 2013, 3, 622
4507776 CIFC13 H15 N O2P -16.5346; 8.803; 10.4461
85.089; 75.857; 68.462
542Baronsky, Thilo; Beattie, Christopher; Harrington, Ross W.; Irfan, Reyhan; North, Michael; Osende, Javier G.; Young, Carl
Bimetallic Aluminum(salen) Catalyzed Synthesis of Oxazolidinones from Epoxides and Isocyanates
ACS Catalysis, 2013, 3, 790
4507881 CIFC60 H52 Cl2 F12 N10 O4 P2 Ru2C 1 2/c 119.5432; 27.2305; 23.3159
90; 99.748; 90
12228.9Aiki, Shota; Kijima, Yuhei; Kuwabara, Junpei; Taketoshi, Ayako; Koizumi, Take-aki; Akine, Shigehisa; Kanbara, Takaki
Ligand Modification of Cyclometalated Ruthenium Complexes in the Aerobic Oxidative Dehydrogenation of Imidazolines
ACS Catalysis, 2013, 3, 812
4507882 CIFC30 H27 Cl F6 N4 O2 P RuP 1 21/n 111.4748; 22.961; 11.4873
90; 95.161; 90
3014.3Aiki, Shota; Kijima, Yuhei; Kuwabara, Junpei; Taketoshi, Ayako; Koizumi, Take-aki; Akine, Shigehisa; Kanbara, Takaki
Ligand Modification of Cyclometalated Ruthenium Complexes in the Aerobic Oxidative Dehydrogenation of Imidazolines
ACS Catalysis, 2013, 3, 812
4507883 CIFC29 H34 Cl F9 N5 P RuP 1 21/n 18.6237; 30.965; 11.965
90; 109.38; 90
3014Aiki, Shota; Kijima, Yuhei; Kuwabara, Junpei; Taketoshi, Ayako; Koizumi, Take-aki; Akine, Shigehisa; Kanbara, Takaki
Ligand Modification of Cyclometalated Ruthenium Complexes in the Aerobic Oxidative Dehydrogenation of Imidazolines
ACS Catalysis, 2013, 3, 812
4508109 CIFC25 H20 Br N6 O4 ReP 1 21/n 111.6786; 19.4125; 11.7398
90; 104.932; 90
2571.7Andrade, Gabriel A.; Pistner, Allen J.; Yap, Glenn P. A.; Lutterman, Daniel A.; Rosenthal, Joel
Photocatalytic Conversion of CO2to CO Using Rhenium Bipyridine Platforms Containing Ancillary Phenyl or BODIPY Moieties
ACS Catalysis, 2013, 3, 1685
4508110 CIFC44 H72 O4 S2 VP 1 21/c 114.843; 16.907; 17.478
90; 93.767; 90
4376.6Toda, Tomoyuki; Nakata, Norio; Matsuo, Tsukasa; Ishii, Akihiko
Synthesis, Structure, and 1-Hexene Polymerization Catalytic Ability of Group 5 Metal Complexes Incorporating an [OSSO]-Type Ligand
ACS Catalysis, 2013, 3, 1764
4508111 CIFC56 H70 Cl3 Nb O2 S2P 1 21/c 117.747; 15.722; 19.957
90; 103.391; 90
5417Toda, Tomoyuki; Nakata, Norio; Matsuo, Tsukasa; Ishii, Akihiko
Synthesis, Structure, and 1-Hexene Polymerization Catalytic Ability of Group 5 Metal Complexes Incorporating an [OSSO]-Type Ligand
ACS Catalysis, 2013, 3, 1764
4508112 CIFC44 H64 Cl3 O2 S2 TaP 1 21 114.0634; 11.496; 14.0371
90; 101.661; 90
2222.6Toda, Tomoyuki; Nakata, Norio; Matsuo, Tsukasa; Ishii, Akihiko
Synthesis, Structure, and 1-Hexene Polymerization Catalytic Ability of Group 5 Metal Complexes Incorporating an [OSSO]-Type Ligand
ACS Catalysis, 2013, 3, 1764
4508362 CIFC18 H28 Cl2 F6 Ir N2 O2 PP 1 21/c 112.129; 11.4374; 17.545
90; 95.165; 90
2424Lehman, Matthew C.; Gary, J. Brannon; Boyle, Paul D.; Sanford, Melanie S.; Ison, Elon A.
Effect of Solvent and Ancillary Ligands on the Catalytic H/D Exchange Reactivity of Cp*IrIII(L) Complexes
ACS Catalysis, 2013, 3, 2304
4508363 CIFC32 H50 F6 Ir2 N4 O7 S2P -110.982; 13.584; 15.035
95.693; 108.315; 110.76
1934.2Lehman, Matthew C.; Gary, J. Brannon; Boyle, Paul D.; Sanford, Melanie S.; Ison, Elon A.
Effect of Solvent and Ancillary Ligands on the Catalytic H/D Exchange Reactivity of Cp*IrIII(L) Complexes
ACS Catalysis, 2013, 3, 2304
4508364 CIFC49 H45 Cl3 Mo N4 O2 P2 ZnP 1 21/c 120.0576; 14.3652; 17.229
90; 95.415; 90
4942.06Chakraborty, Subrata; Blacque, Olivier; Fox, Thomas; Berke, Heinz
Highly Efficient Large Bite Angle Diphosphine Substituted Molybdenum Catalyst for Hydrosilylation
ACS Catalysis, 2013, 3, 2208
4508365 CIFC153 H110 B2 F48 Mo2 N8 O4 P4P -112.4979; 15.4233; 19.774
88.382; 81.163; 87.527
3761.96Chakraborty, Subrata; Blacque, Olivier; Fox, Thomas; Berke, Heinz
Highly Efficient Large Bite Angle Diphosphine Substituted Molybdenum Catalyst for Hydrosilylation
ACS Catalysis, 2013, 3, 2208
4508366 CIFC151 H103 B2 Cl3 F48 Mo2 N4 O4 P4P -116.0776; 17.0716; 18.0135
105.257; 115.011; 98.938
4116.7Chakraborty, Subrata; Blacque, Olivier; Fox, Thomas; Berke, Heinz
Highly Efficient Large Bite Angle Diphosphine Substituted Molybdenum Catalyst for Hydrosilylation
ACS Catalysis, 2013, 3, 2208
4508367 CIFC45 H36 Cl Mo N O4 P2P 1 21/c 111.5883; 13.8586; 24.9475
90; 101.155; 90
3930.82Chakraborty, Subrata; Blacque, Olivier; Fox, Thomas; Berke, Heinz
Highly Efficient Large Bite Angle Diphosphine Substituted Molybdenum Catalyst for Hydrosilylation
ACS Catalysis, 2013, 3, 2208
4508368 CIFC82 H84 Cl2 Mo2 N2 O5 P6P 1 21/n 110.2639; 21.2569; 18.332
90; 105.192; 90
3859.88Chakraborty, Subrata; Blacque, Olivier; Fox, Thomas; Berke, Heinz
Highly Efficient Large Bite Angle Diphosphine Substituted Molybdenum Catalyst for Hydrosilylation
ACS Catalysis, 2013, 3, 2208
4508369 CIFC54 H43 Cl Mo N O2 P3P 1 21/n 119.3956; 12.6738; 20.4746
90; 114.639; 90
4574.74Chakraborty, Subrata; Blacque, Olivier; Fox, Thomas; Berke, Heinz
Highly Efficient Large Bite Angle Diphosphine Substituted Molybdenum Catalyst for Hydrosilylation
ACS Catalysis, 2013, 3, 2208
4508370 CIFC23 H39 Ir O3 P2P -18.288; 11.99; 13.424
100.742; 95.96; 103.708
1257.9Lao, David B.; Owens, Alisa C. E.; Heinekey, D. Michael; Goldberg, Karen I.
Partial Deoxygenation of Glycerol Catalyzed by Iridium Pincer Complexes
ACS Catalysis, 2013, 3, 2391
4508371 CIFC55 H52 B F24 Ir O3 P2C 1 2/c 116.707; 18.088; 39.933
90; 96.48; 90
11991Lao, David B.; Owens, Alisa C. E.; Heinekey, D. Michael; Goldberg, Karen I.
Partial Deoxygenation of Glycerol Catalyzed by Iridium Pincer Complexes
ACS Catalysis, 2013, 3, 2391
4508372 CIFC36 H47 N3 ZnP 1 21/n 112.4548; 12.8516; 20.4735
90; 93.992; 90
3269.12Boone, Courtney; Korobkov, Ilia; Nikonov, Georgii I.
Unexpected Role of Zinc Hydride in Catalytic Hydrosilylation of Ketones and Nitriles
ACS Catalysis, 2013, 3, 2336
4508373 CIFC24 H40 N2 O3 P RuC 1 2/c 132.0382; 11.1091; 16.1622
90; 118.402; 90
5060Huff, Chelsea A.; Sanford, Melanie S.
Catalytic CO2Hydrogenation to Formate by a Ruthenium Pincer Complex
ACS Catalysis, 2013, 3, 2412
4508374 CIFC34 H30 Cr O4 P2P b c a18.625; 20.786; 32.239
90; 90; 90
12481Zhang, Jun; Wang, Xiao; Zhang, Xuejun; Wu, Weijie; Zhang, Gengtao; Xu, Sheng; Shi, Min
Switchable Ethylene Tri-/Tetramerization with High Activity: Subtle Effect Presented by Backbone-Substituent of Carbon-Bridged Diphosphine Ligands
ACS Catalysis, 2013, 3, 2311
4508375 CIFC16 H27 Ir O5 SP b c a9.218; 16.424; 24.589
90; 90; 90
3722.7Frasco, Daniel A.; Lilly, Cassandra P.; Boyle, Paul D.; Ison, Elon A.
Cp*IrIII-Catalyzed Oxidative Coupling of Benzoic Acids with Alkynes
ACS Catalysis, 2013, 3, 2421
4508376 CIFC16 H21 F6 Ir O5 SP 21 21 219.08; 14.954; 15.588
90; 90; 90
2116.6Frasco, Daniel A.; Lilly, Cassandra P.; Boyle, Paul D.; Ison, Elon A.
Cp*IrIII-Catalyzed Oxidative Coupling of Benzoic Acids with Alkynes
ACS Catalysis, 2013, 3, 2421
4508377 CIFC19 H24 Ir N O5 SP 1 21/c 18.2462; 14.311; 16.825
90; 103.277; 90
1932.5Frasco, Daniel A.; Lilly, Cassandra P.; Boyle, Paul D.; Ison, Elon A.
Cp*IrIII-Catalyzed Oxidative Coupling of Benzoic Acids with Alkynes
ACS Catalysis, 2013, 3, 2421
4508378 CIFC19 H24 Cl Ir O3 SP 1 21/c 119.779; 8.4715; 30.216
90; 128.931; 90
3938.5Frasco, Daniel A.; Lilly, Cassandra P.; Boyle, Paul D.; Ison, Elon A.
Cp*IrIII-Catalyzed Oxidative Coupling of Benzoic Acids with Alkynes
ACS Catalysis, 2013, 3, 2421
4508379 CIFC44 H36 Cu4 F12 N8 O16 S4P 1 21/c 125.452; 13.8983; 15.856
90; 104.624; 90
5427.2Hoover, Jessica M.; Ryland, Bradford L.; Stahl, Shannon S.
Copper/TEMPO-Catalyzed Aerobic Alcohol Oxidation: Mechanistic Assessment of Different Catalyst Systems
ACS Catalysis, 2013, 3, 2599
4508380 CIFC32 H28 N2 O5P -19.231; 10.439; 15.222
92.356; 94.503; 113.508
1336.7Hao, Wen-Juan; Wang, Shun-Yi; Ji, Shun-Jun
Iodine-Catalyzed Cascade Formal [3 + 3] Cycloaddition Reaction of Indolyl Alcohol Derivatives with Enaminones: Constructions of Functionalized Spirodihydrocarbolines
ACS Catalysis, 2013, 3, 2501
4508381 CIFC31 H24 N3 O5.5C 1 2/c 115.715; 22.582; 16.682
90; 102.4; 90
5781.9Hao, Wen-Juan; Wang, Shun-Yi; Ji, Shun-Jun
Iodine-Catalyzed Cascade Formal [3 + 3] Cycloaddition Reaction of Indolyl Alcohol Derivatives with Enaminones: Constructions of Functionalized Spirodihydrocarbolines
ACS Catalysis, 2013, 3, 2501
4508603 CIFC15 H10 Cl N O2P 1 21/n 13.9967; 25.9143; 12.3646
90; 95.947; 90
1273.73Han, Runfeng; Qi, Jing; Gu, Jixiang; Ma, Donghui; Xie, Xingang; She, Xuegong
N-Heterocyclic Carbene-Catalyzed Formal [3+2] Annulation of Alkynyl Aldehydes with Nitrosobenzenes: A Highly Regioselective Umpolung Strategy
ACS Catalysis, 2013, 3, 2705
4508604 CIFC70 H102 N4 O2 Rh2P -111.021; 11.519; 14.052
68.604; 73.514; 74.287
1564.5Palacios, Laura; Artigas, Maria Jose; Polo, Victor; Lahoz, Fernando J.; Castarlenas, Ricardo; Pérez-Torrente, Jesús J.; Oro, Luis A.
Hydroxo–Rhodium–N-Heterocyclic Carbene Complexes as Efficient Catalyst Precursors for Alkyne Hydrothiolation
ACS Catalysis, 2013, 3, 2910
4508605 CIFC18 H21 N O2C 1 2 122.6541; 8.25169; 17.39574
90; 107.371; 90
3103.55Goubert, Guillaume; Demers-Carpentier, Vincent; Loach, Richard P.; Lafleur-Lambert, Raphaél; Lemay, Jean-Christian; Boukouvalas, John; McBreen, Peter H.
Aminolactone Chiral Modifiers for Heterogeneous Asymmetric Hydrogenation: Corrected Structure of Pantoyl-Naphthylethylamine, In-Situ Hydrogenolysis, and Scanning Tunneling Microscopy Observation of Supramolecular Aminolactone/Substrate Assemblies on Pt(111)
ACS Catalysis, 2013, 3, 2677
4508606 CIFC13 H21 Au Cl N3 O5 SC 1 2/c 128.7265; 8.8069; 14.8574
90; 95.337; 90
3742.5Tomás-Mendivil, Eder; Toullec, Patrick Y.; Borge, Javier; Conejero, Salvador; Michelet, Véronique; Cadierno, Victorio
Water-Soluble Gold(I) and Gold(III) Complexes with SulfonatedN-Heterocyclic Carbene Ligands: Synthesis, Characterization, and Application in the Catalytic Cycloisomerization of γ-Alkynoic Acids into Enol-Lactones
ACS Catalysis, 2013, 3, 3086
4508607 CIFC14 H21 Au Cl3 N3 O4 S2C 1 2/c 125.769; 11.48; 18.59
90; 107.214; 90
5253Tomás-Mendivil, Eder; Toullec, Patrick Y.; Borge, Javier; Conejero, Salvador; Michelet, Véronique; Cadierno, Victorio
Water-Soluble Gold(I) and Gold(III) Complexes with SulfonatedN-Heterocyclic Carbene Ligands: Synthesis, Characterization, and Application in the Catalytic Cycloisomerization of γ-Alkynoic Acids into Enol-Lactones
ACS Catalysis, 2013, 3, 3086
4508608 CIFC14.5 H20 Au Cl3 N3 O3.5 SP 1 2/c 124.0394; 8.8925; 21.0847
90; 116.022; 90
4050.36Tomás-Mendivil, Eder; Toullec, Patrick Y.; Borge, Javier; Conejero, Salvador; Michelet, Véronique; Cadierno, Victorio
Water-Soluble Gold(I) and Gold(III) Complexes with SulfonatedN-Heterocyclic Carbene Ligands: Synthesis, Characterization, and Application in the Catalytic Cycloisomerization of γ-Alkynoic Acids into Enol-Lactones
ACS Catalysis, 2013, 3, 3086
4508609 CIFC12 H14 Au Cl2 N3 O3 SP 1 21/n 19.717; 12.6841; 13.5632
90; 108.02; 90
1589.68Tomás-Mendivil, Eder; Toullec, Patrick Y.; Borge, Javier; Conejero, Salvador; Michelet, Véronique; Cadierno, Victorio
Water-Soluble Gold(I) and Gold(III) Complexes with SulfonatedN-Heterocyclic Carbene Ligands: Synthesis, Characterization, and Application in the Catalytic Cycloisomerization of γ-Alkynoic Acids into Enol-Lactones
ACS Catalysis, 2013, 3, 3086
4510840 CIFC17 H26 Cl N OP 1 21/c 111.898; 9.901; 27.23
90; 101.02; 90
3149Torres, Eva; Fernández, Roser; Miquet, Stéphanie; Font-Bardia, Mercè; Vanderlinden, Evelien; Naesens, Lieve; Vázquez, Santiago
Synthesis and Anti-influenza A Virus Activity of 2,2-Dialkylamantadines and Related Compounds
ACS Medicinal Chemistry Letters, 2012, 3, 1065
4511650 CIFC33 H26 Cu2 N3 O10.5P 1 21/m 110.2527; 18.973; 16.977
90; 100.46; 90
3247.6Abourahma, Heba; Bodwell, Graham J.; Lu, Jianjiang; Moulton, Brian; Pottie, Ian R.; Walsh, Rosa Bailey; Zaworotko, Michael J.
Coordination Polymers from Calixarene-Like [Cu2(Dicarboxylate)2]4Building Blocks: Structural Diversity via Atropisomerism
Crystal Growth & Design, 2003, 3, 513
4511651 CIFC25 H24 Cu2 N4 O9P 1 21/n 18.2043; 14.97; 10.6012
90; 90.191; 90
1302Abourahma, Heba; Bodwell, Graham J.; Lu, Jianjiang; Moulton, Brian; Pottie, Ian R.; Walsh, Rosa Bailey; Zaworotko, Michael J.
Coordination Polymers from Calixarene-Like [Cu2(Dicarboxylate)2]4Building Blocks: Structural Diversity via Atropisomerism
Crystal Growth & Design, 2003, 3, 513
4511652 CIFC18 H10 Cu N O5P 4/n c c :218.7912; 18.7912; 16.8886
90; 90; 90
5963.5Abourahma, Heba; Bodwell, Graham J.; Lu, Jianjiang; Moulton, Brian; Pottie, Ian R.; Walsh, Rosa Bailey; Zaworotko, Michael J.
Coordination Polymers from Calixarene-Like [Cu2(Dicarboxylate)2]4Building Blocks: Structural Diversity via Atropisomerism
Crystal Growth & Design, 2003, 3, 513
4511653 CIFC34 H26 Cl2 Cu2 N2 O8C 1 c 119.5148; 12.7678; 14.3466
90; 114.133; 90
3262.2Abourahma, Heba; Bodwell, Graham J.; Lu, Jianjiang; Moulton, Brian; Pottie, Ian R.; Walsh, Rosa Bailey; Zaworotko, Michael J.
Coordination Polymers from Calixarene-Like [Cu2(Dicarboxylate)2]4Building Blocks: Structural Diversity via Atropisomerism
Crystal Growth & Design, 2003, 3, 513
4511654 CIFC22 H16 Cu2 O10 S4C 1 2/c 115.637; 15.43; 13.332
90; 116.692; 90
2873.9Abourahma, Heba; Bodwell, Graham J.; Lu, Jianjiang; Moulton, Brian; Pottie, Ian R.; Walsh, Rosa Bailey; Zaworotko, Michael J.
Coordination Polymers from Calixarene-Like [Cu2(Dicarboxylate)2]4Building Blocks: Structural Diversity via Atropisomerism
Crystal Growth & Design, 2003, 3, 513
4511655 CIFC26 H26 Cu2 N4 O9P 1 21/n 18.4851; 14.639; 11.1455
90; 93.392; 90
1382Abourahma, Heba; Bodwell, Graham J.; Lu, Jianjiang; Moulton, Brian; Pottie, Ian R.; Walsh, Rosa Bailey; Zaworotko, Michael J.
Coordination Polymers from Calixarene-Like [Cu2(Dicarboxylate)2]4Building Blocks: Structural Diversity via Atropisomerism
Crystal Growth & Design, 2003, 3, 513
4511656 CIFC30 H28 Cu2 N2 O12P 4/n c c :218.8743; 18.8743; 17.356
90; 90; 90
6182.9Abourahma, Heba; Bodwell, Graham J.; Lu, Jianjiang; Moulton, Brian; Pottie, Ian R.; Walsh, Rosa Bailey; Zaworotko, Michael J.
Coordination Polymers from Calixarene-Like [Cu2(Dicarboxylate)2]4Building Blocks: Structural Diversity via Atropisomerism
Crystal Growth & Design, 2003, 3, 513
4511657 CIFC10 H10 Br2 Cl4 Cu N2C 1 2/c 112.938; 9.616; 13.784
90; 91.75; 90
1714.1Willett, Roger D.; Awwadi, Firas; Butcher, Robert; Haddad, Salim; Twamley, Brendan
The Aryl Bromine−Halide Ion Synthon and Its Role in the Control of the Crystal Structures of Tetrahalocuprate(II) Ions
Crystal Growth & Design, 2003, 3, 301
4511658 CIFC10 H10 Br2 Cl4 Cu N2P -17.5639; 7.815; 15.5441
82.11; 78.869; 67.06
828.3Willett, Roger D.; Awwadi, Firas; Butcher, Robert; Haddad, Salim; Twamley, Brendan
The Aryl Bromine−Halide Ion Synthon and Its Role in the Control of the Crystal Structures of Tetrahalocuprate(II) Ions
Crystal Growth & Design, 2003, 3, 301
4511659 CIFC10 H10 Br6 Cu N2P -16.501; 8.573; 16.192
89.76; 89.67; 78.7
884.9Willett, Roger D.; Awwadi, Firas; Butcher, Robert; Haddad, Salim; Twamley, Brendan
The Aryl Bromine−Halide Ion Synthon and Its Role in the Control of the Crystal Structures of Tetrahalocuprate(II) Ions
Crystal Growth & Design, 2003, 3, 301
4511660 CIFC10 H10 Br2 Cl4 Cu N2P 1 21/c 17.7752; 27.963; 8.7233
90; 116.251; 90
1701Willett, Roger D.; Awwadi, Firas; Butcher, Robert; Haddad, Salim; Twamley, Brendan
The Aryl Bromine−Halide Ion Synthon and Its Role in the Control of the Crystal Structures of Tetrahalocuprate(II) Ions
Crystal Growth & Design, 2003, 3, 301
4511661 CIFC10 H10 Br6 Cu N2C 1 2/c 116.904; 7.7659; 14.0292
90; 98.189; 90
1822.9Willett, Roger D.; Awwadi, Firas; Butcher, Robert; Haddad, Salim; Twamley, Brendan
The Aryl Bromine−Halide Ion Synthon and Its Role in the Control of the Crystal Structures of Tetrahalocuprate(II) Ions
Crystal Growth & Design, 2003, 3, 301
4513648 CIFGd K O12 P4C 1 2/c 17.875; 12.431; 10.537
90; 110.94; 90
963.384Ettis, H.; Mhiri, T.; Naili, H.
Synthesis and crystal structure of a new potassium-gadolinium cyclotetraphosphate, K Gd P4 O12
Crystal Growth and Design, 2003, 3, 599-602
4515854 CIFC25 H26 N2 O2 S2P -110.8541; 11.169; 12.0753
112.082; 94.659; 115.759
1168.1Gupta, 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, 2018, 3, 14341-14348
4515855 CIFC23 H22 N2 O2 S2P -110.0414; 15.0433; 15.5315
93.055; 107.51; 106.789
2116.64Gupta, 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, 2018, 3, 14341-14348
4515856 CIFC15 H15 N O2 SP 21 21 215.2088; 9.272; 28.3737
90; 90; 90
1370.34Gupta, 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, 2018, 3, 14341-14348
4515857 CIFC28 H32 B N S2P 1 21/n 116.9687; 9.905; 17.5869
90; 117.124; 90
2630.8Li, 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, 2018, 3, 12730-12736
4515858 CIFC40 H40 B N S2P 21 c n8.0507; 16.79; 25.3603
90; 90; 90
3428Li, 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, 2018, 3, 12730-12736
4515859 CIFC59 H44 Cl3 N2 O2 P2 RuC 1 2/c 127.173; 18.901; 23.601
90; 121.36; 90
10351Mondal, Sandip; Bera, Sachinath; Maity, Suvendu; Ghosh, Prasanta
Orthometalated <i>N</i>-(Benzophenoxazine)-<i>o</i>-aminophenol: Phenolato versus Phenoxyl States.
ACS omega, 2018, 3, 13323-13334
4515860 CIFC41 H29 Br2 Cl2 N2 O2 Os PP -111.7693; 12.6976; 14.8599
97.091; 107.794; 113.557
1859.94Mondal, Sandip; Bera, Sachinath; Maity, Suvendu; Ghosh, Prasanta
Orthometalated <i>N</i>-(Benzophenoxazine)-<i>o</i>-aminophenol: Phenolato versus Phenoxyl States.
ACS omega, 2018, 3, 13323-13334
4515861 CIFC41 H29 Br2 Cl2 N2 O2 Os PP -111.9432; 12.5744; 14.4985
99.789; 105.371; 115.439
1792.33Mondal, Sandip; Bera, Sachinath; Maity, Suvendu; Ghosh, Prasanta
Orthometalated <i>N</i>-(Benzophenoxazine)-<i>o</i>-aminophenol: Phenolato versus Phenoxyl States.
ACS omega, 2018, 3, 13323-13334
4515862 CIFC67 H54 Cl2 N6 O8 RuP 1 21/c 119.593; 17.367; 18.153
90; 108.269; 90
5866Pal, 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, 2018, 3, 14526-14537
4515863 CIFC14 H9 Br2 N3P 1 21/c 17.3587; 10.0065; 18.5152
90; 95.836; 90
1356.3Chen, 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, 2018, 3, 12520-12529
4515864 CIFC20 H18 F N O4P 1 21/c 16.081; 12.345; 22.898
90; 93.02; 90
1717Ramu, 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, 2018, 3, 12349-12360
4515865 CIFC38 H28 N8 O10P 1 21/c 110.5066; 35.89; 9.3401
90; 103.633; 90
3422.8Ramu, 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, 2018, 3, 12349-12360

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