Crystallography Open Database

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4036574 CIFC10.15 H7.69 Cl1.54 N0.62P -110.5292; 11.7378; 25.986
81.345; 85.62; 68.07
2944.6Zhang, Yu-Fei; Tian, Wan-Fa; Cao, Xiao-Ping; Kuck, Dietmar; Chow, Hak-Fun
o-Quinones Derived from Tribenzotriquinacenes: Functionalization of Inner Bay Positions and Use for Single-Wing Extensions.
The Journal of organic chemistry, 2016, 81, 2308-2319
4036575 CIFC27 H26 OP n 21 a20.9274; 15.0038; 6.3388
90; 90; 90
1990.32Zhang, Yu-Fei; Tian, Wan-Fa; Cao, Xiao-Ping; Kuck, Dietmar; Chow, Hak-Fun
o-Quinones Derived from Tribenzotriquinacenes: Functionalization of Inner Bay Positions and Use for Single-Wing Extensions.
The Journal of organic chemistry, 2016, 81, 2308-2319
4036576 CIFC30 H32 O4P 1 21/c 19.8861; 23.7464; 10.5247
90; 96.553; 90
2454.6Zhang, Yu-Fei; Tian, Wan-Fa; Cao, Xiao-Ping; Kuck, Dietmar; Chow, Hak-Fun
o-Quinones Derived from Tribenzotriquinacenes: Functionalization of Inner Bay Positions and Use for Single-Wing Extensions.
The Journal of organic chemistry, 2016, 81, 2308-2319
4036577 CIFC32 H24 F2 N2P 1 21/c 110.2489; 17.7216; 13.0766
90; 90.552; 90
2375Zhang, Yu-Fei; Tian, Wan-Fa; Cao, Xiao-Ping; Kuck, Dietmar; Chow, Hak-Fun
o-Quinones Derived from Tribenzotriquinacenes: Functionalization of Inner Bay Positions and Use for Single-Wing Extensions.
The Journal of organic chemistry, 2016, 81, 2308-2319
4036578 CIFC30 H28 O3P 1 21/c 117.9484; 8.6969; 16.5941
90; 109.72; 90
2438.35Zhang, Yu-Fei; Tian, Wan-Fa; Cao, Xiao-Ping; Kuck, Dietmar; Chow, Hak-Fun
o-Quinones Derived from Tribenzotriquinacenes: Functionalization of Inner Bay Positions and Use for Single-Wing Extensions.
The Journal of organic chemistry, 2016, 81, 2308-2319
4036579 CIFC29 H28 O3P 1 21/n 19.6832; 15.9129; 15.0454
90; 91.068; 90
2317.9Zhang, Yu-Fei; Tian, Wan-Fa; Cao, Xiao-Ping; Kuck, Dietmar; Chow, Hak-Fun
o-Quinones Derived from Tribenzotriquinacenes: Functionalization of Inner Bay Positions and Use for Single-Wing Extensions.
The Journal of organic chemistry, 2016, 81, 2308-2319
4036580 CIFC55 H42 O3P 1 21/n 110.8938; 33.139; 11.704
90; 103.521; 90
4108.2Zhang, Yu-Fei; Tian, Wan-Fa; Cao, Xiao-Ping; Kuck, Dietmar; Chow, Hak-Fun
o-Quinones Derived from Tribenzotriquinacenes: Functionalization of Inner Bay Positions and Use for Single-Wing Extensions.
The Journal of organic chemistry, 2016, 81, 2308-2319
4036581 CIFC24 H19 N3 O4P 1 21/n 19.9179; 24.4164; 9.9702
90; 118.045; 90
2130.88Li, Kaizhi; You, Jingsong
Cascade Oxidative Coupling/Cyclization: A Gateway to 3-Amino Polysubstituted Five-Membered Heterocycles.
The Journal of organic chemistry, 2016, 81, 2327-2339
4036582 CIFC26 H23 N3 O3P -110.5769; 10.9393; 11.0491
73.609; 78.749; 65.477
1111.37Li, Kaizhi; You, Jingsong
Cascade Oxidative Coupling/Cyclization: A Gateway to 3-Amino Polysubstituted Five-Membered Heterocycles.
The Journal of organic chemistry, 2016, 81, 2327-2339
4036583 CIFC19 H16 N2 O5P 1 21/c 18.2709; 11.1075; 18.799
90; 94.903; 90
1720.73Li, Kaizhi; You, Jingsong
Cascade Oxidative Coupling/Cyclization: A Gateway to 3-Amino Polysubstituted Five-Membered Heterocycles.
The Journal of organic chemistry, 2016, 81, 2327-2339
4036584 CIFC23 H24 N2 O5 SP b c a10.9656; 17.723; 23.255
90; 90; 90
4519.5Sankar, Ulaganathan; Surya Kumar, Ch Venkata; Subramanian, V.; Balasubramanian, K. K.; Mahalakshimi, S.
Stereo-, Regio-, and Chemoselective [3 + 2]-Cycloaddition of (2E,4E)-Ethyl 5-(Phenylsulfonyl)penta-2,4-dienoate with Various Azomethine Ylides, Nitrones, and Nitrile Oxides: Synthesis of Pyrrolidine, Isoxazolidine, and Isoxazoline Derivatives and a Computational Study.
The Journal of organic chemistry, 2016, 81, 2340-2354
4036585 CIFC24 H23 N O6 SP 1 21/n 17.0029; 17.986; 17.875
90; 93.089; 90
2248.2Sankar, Ulaganathan; Surya Kumar, Ch Venkata; Subramanian, V.; Balasubramanian, K. K.; Mahalakshimi, S.
Stereo-, Regio-, and Chemoselective [3 + 2]-Cycloaddition of (2E,4E)-Ethyl 5-(Phenylsulfonyl)penta-2,4-dienoate with Various Azomethine Ylides, Nitrones, and Nitrile Oxides: Synthesis of Pyrrolidine, Isoxazolidine, and Isoxazoline Derivatives and a Computational Study.
The Journal of organic chemistry, 2016, 81, 2340-2354
4036586 CIFC13 H9 F3 N2 O2P 1 21 18.6828; 6.4475; 11.5604
90; 96.958; 90
642.41Lou, Hengqiao; Wang, Yongtao; Jin, Enze; Lin, Xufeng
Organocatalytic Asymmetric Synthesis of Dihydrobenzoxazinones Bearing Trifluoromethylated Quaternary Stereocenters.
The Journal of organic chemistry, 2016, 81, 2019-2026
4036587 CIFC13 H21 N O3P 1 21 16.4322; 9.2132; 11.2253
90; 96.4282; 90
661.04Chattopadhyay, Amit Kumar; Menz, Helge; Ly, Vu Linh; Dorich, Stéphane; Hanessian, Stephen
Synthesis of a Model Tetracyclic Core Structure of Calyciphylline B-Type Alkaloids.
The Journal of organic chemistry, 2016, 81, 2182-2188
4036588 CIFC18 H29 N O4P 21 21 216.5732; 10.1967; 27.5648
90; 90; 90
1847.53Chattopadhyay, Amit Kumar; Menz, Helge; Ly, Vu Linh; Dorich, Stéphane; Hanessian, Stephen
Synthesis of a Model Tetracyclic Core Structure of Calyciphylline B-Type Alkaloids.
The Journal of organic chemistry, 2016, 81, 2182-2188
4036589 CIFC111 H171 B12 Cl9 N12R -3 :H17.318; 17.318; 34.804
90; 90; 120
9040Wakabayashi, Shigeharu; Hori, Yuka; Komeda, Seiji; Shimizu, Yuki; Ohki, Yasuhiro; Horiuchi, Misaki; Itoh, Takahito; Sugihara, Yoshikazu; Tatsumi, Kazuyuki
Self-Assembly of 4-(Diethylboryl)pyridine: Crystal Structures of the Cyclic Pentamer and Hexamer and Their Solvent-Dependent Selective Crystallization.
The Journal of organic chemistry, 2016, 81, 2399-2404
4036590 CIFC174 H252 B18 N18 O3P -317.377; 17.377; 17.411
90; 90; 120
4553.1Wakabayashi, Shigeharu; Hori, Yuka; Komeda, Seiji; Shimizu, Yuki; Ohki, Yasuhiro; Horiuchi, Misaki; Itoh, Takahito; Sugihara, Yoshikazu; Tatsumi, Kazuyuki
Self-Assembly of 4-(Diethylboryl)pyridine: Crystal Structures of the Cyclic Pentamer and Hexamer and Their Solvent-Dependent Selective Crystallization.
The Journal of organic chemistry, 2016, 81, 2399-2404
4036591 CIFC57 H82 B5 N5P -110.85; 11.342; 24.34
93.698; 95.893; 111.738
2750.5Wakabayashi, Shigeharu; Hori, Yuka; Komeda, Seiji; Shimizu, Yuki; Ohki, Yasuhiro; Horiuchi, Misaki; Itoh, Takahito; Sugihara, Yoshikazu; Tatsumi, Kazuyuki
Self-Assembly of 4-(Diethylboryl)pyridine: Crystal Structures of the Cyclic Pentamer and Hexamer and Their Solvent-Dependent Selective Crystallization.
The Journal of organic chemistry, 2016, 81, 2399-2404
4036592 CIFC58 H84 B6 N6 OP -19.356; 11.498; 14.192
99.422; 93.603; 108.495
1417.5Wakabayashi, Shigeharu; Hori, Yuka; Komeda, Seiji; Shimizu, Yuki; Ohki, Yasuhiro; Horiuchi, Misaki; Itoh, Takahito; Sugihara, Yoshikazu; Tatsumi, Kazuyuki
Self-Assembly of 4-(Diethylboryl)pyridine: Crystal Structures of the Cyclic Pentamer and Hexamer and Their Solvent-Dependent Selective Crystallization.
The Journal of organic chemistry, 2016, 81, 2399-2404
4036593 CIFC139 H188 N8 O43P 21 21 219.8195; 22.8286; 7.8633
90; 90; 90
3557.8Smith, Aaron C.; Cabral, Shawn; Kung, Daniel W.; Rose, Colin R.; Southers, James A.; García-Irizarry, Carmen N; Damon, David B.; Bagley, Scott W.; Griffith, David A.
The Synthesis of Methyl-Substituted Spirocyclic Piperidine-Azetidine (2,7-Diazaspiro[3.5]nonane) and Spirocyclic Piperidine-Pyrrolidine (2,8-Diazaspiro[4.5]decane) Ring Systems.
The Journal of organic chemistry, 2016, 81, 3509-3519
4036594 CIFC19 H21 N2 O2P 1 21/n 111.2708; 10.4765; 13.4089
90; 99.4274; 90
1561.92Tabata, Hidetsugu; Yoneda, Tetsuya; Tasaka, Tomohiko; Ito, Shigekazu; Oshitari, Tetsuta; Takahashi, Hideyo; Natsugari, Hideaki
Stereochemistry of N-Benzoyl-5-substituted-1-benzazepines Revisited: Synthesis of the Conformationally Biased Derivatives and Revision of the Reported Structure.
The Journal of organic chemistry, 2016, 81, 3136-3148
4036595 CIFC18 H18 Cl N OP -19.43615; 9.54443; 17.4522
84.4167; 89.6078; 78.8942
1534.93Tabata, Hidetsugu; Yoneda, Tetsuya; Tasaka, Tomohiko; Ito, Shigekazu; Oshitari, Tetsuta; Takahashi, Hideyo; Natsugari, Hideaki
Stereochemistry of N-Benzoyl-5-substituted-1-benzazepines Revisited: Synthesis of the Conformationally Biased Derivatives and Revision of the Reported Structure.
The Journal of organic chemistry, 2016, 81, 3136-3148
4036596 CIFC20 H24 N2 OP -19.25139; 9.3547; 10.33663
78.3301; 82.1889; 75.906
846.17Tabata, Hidetsugu; Yoneda, Tetsuya; Tasaka, Tomohiko; Ito, Shigekazu; Oshitari, Tetsuta; Takahashi, Hideyo; Natsugari, Hideaki
Stereochemistry of N-Benzoyl-5-substituted-1-benzazepines Revisited: Synthesis of the Conformationally Biased Derivatives and Revision of the Reported Structure.
The Journal of organic chemistry, 2016, 81, 3136-3148
4036597 CIFC19 H21 N OP 1 21 17.7089; 11.7832; 17.474
90; 100.653; 90
1559.9Tabata, Hidetsugu; Yoneda, Tetsuya; Tasaka, Tomohiko; Ito, Shigekazu; Oshitari, Tetsuta; Takahashi, Hideyo; Natsugari, Hideaki
Stereochemistry of N-Benzoyl-5-substituted-1-benzazepines Revisited: Synthesis of the Conformationally Biased Derivatives and Revision of the Reported Structure.
The Journal of organic chemistry, 2016, 81, 3136-3148
4036598 CIFC25 H26 Cl N O5 SP 1 21/c 117.706; 14.323; 9.7
90; 104.923; 90
2377Kranthikumar, Ramagonolla; Chegondi, Rambabu; Chandrasekhar, Srivari
Insertion of N-Tosylacetimidates/Acetimidamides onto Arynes via [2 + 2] Cycloaddition.
The Journal of organic chemistry, 2016, 81, 2451-2459
4036599 CIFC30 H26 N2 O2 SP -110.172; 10.462; 12.878
68.824; 83.945; 83.791
1267.17Kranthikumar, Ramagonolla; Chegondi, Rambabu; Chandrasekhar, Srivari
Insertion of N-Tosylacetimidates/Acetimidamides onto Arynes via [2 + 2] Cycloaddition.
The Journal of organic chemistry, 2016, 81, 2451-2459
4036600 CIFC19 H17 N O2P -18.6313; 11.567; 15.818
76.11; 88.94; 85.25
1527.8Jiang, Huanfeng; Yang, Jidan; Tang, Xiaodong; Wu, Wanqing
Divergent Syntheses of Isoquinolines and Indolo[1,2-a]quinazolines by Copper-Catalyzed Cascade Annulation from 2-Haloaryloxime Acetates with Active Methylene Compounds and Indoles.
The Journal of organic chemistry, 2016, 81, 2053-2061
4036601 CIFC24 H21 F N O5P 1 21/n 110.593; 11.1116; 17.5737
90; 95.862; 90
2057.7Peng, Hui; Li, Jiuyi; Wang, Furong; Liu, Bo; Yin, Biaolin
Synthesis of Spiro-lactams and Polysubstituted Pyrroles via Ceric Ammonium Nitrate-Mediated Oxidative Cyclization of N-Furan-2-ylmethyl-β-Enaminones.
The Journal of organic chemistry, 2016, 81, 4939-4946
4036602 CIFC24 H17 N O2 SP 1 21/c 19.4196; 20.2974; 10.6385
90; 114.597; 90
1849.44Bakthadoss, Manickam; Selvakumar, Raman
One-Pot Synthesis of Benzothiazole-Tethered Chromanones/Coumarins via Claisen Rearrangement Using the Solid State Melt Reaction.
The Journal of organic chemistry, 2016, 81, 3391-3399
4036603 CIFC25 H19 Cl N O2 SP -19.5557; 10.296; 11.4909
96.003; 104.156; 91.371
1088.76Bakthadoss, Manickam; Selvakumar, Raman
One-Pot Synthesis of Benzothiazole-Tethered Chromanones/Coumarins via Claisen Rearrangement Using the Solid State Melt Reaction.
The Journal of organic chemistry, 2016, 81, 3391-3399
4036604 CIFC26 H21 N O2 SP -18.7107; 10.3413; 11.8345
95.821; 97.715; 93.79
1047.51Bakthadoss, Manickam; Selvakumar, Raman
One-Pot Synthesis of Benzothiazole-Tethered Chromanones/Coumarins via Claisen Rearrangement Using the Solid State Melt Reaction.
The Journal of organic chemistry, 2016, 81, 3391-3399
4036605 CIFC27 H20 Br2 O3P 18.1158; 8.6369; 9.1898
95.53; 104.286; 108.675
580.48Madhusudhan Reddy, G.; Ko, Chi-Ting; Hsieh, Kai-Hong; Lee, Chia-Jui; Das, Utpal; Lin, Wenwei
Expanding the Scope of Primary Amine Catalysis: Stereoselective Synthesis of Indanedione-Fused 2,6-Disubstituted trans-Spirocyclohexanones.
The Journal of organic chemistry, 2016, 81, 2420-2431
4036606 CIFC29 H25 Br O4P 18.444; 11.055; 13.733
98.62; 107.12; 93
1204.98Madhusudhan Reddy, G.; Ko, Chi-Ting; Hsieh, Kai-Hong; Lee, Chia-Jui; Das, Utpal; Lin, Wenwei
Expanding the Scope of Primary Amine Catalysis: Stereoselective Synthesis of Indanedione-Fused 2,6-Disubstituted trans-Spirocyclohexanones.
The Journal of organic chemistry, 2016, 81, 2420-2431
4036607 CIFC26 H19 Br O3P 21 21 219.121; 10.294; 45.103
90; 90; 90
4235Madhusudhan Reddy, G.; Ko, Chi-Ting; Hsieh, Kai-Hong; Lee, Chia-Jui; Das, Utpal; Lin, Wenwei
Expanding the Scope of Primary Amine Catalysis: Stereoselective Synthesis of Indanedione-Fused 2,6-Disubstituted trans-Spirocyclohexanones.
The Journal of organic chemistry, 2016, 81, 2420-2431
4036608 CIFC28 H23 Br O4P 1 21 110.1259; 21.6147; 11.8647
90; 112.394; 90
2400.97Madhusudhan Reddy, G.; Ko, Chi-Ting; Hsieh, Kai-Hong; Lee, Chia-Jui; Das, Utpal; Lin, Wenwei
Expanding the Scope of Primary Amine Catalysis: Stereoselective Synthesis of Indanedione-Fused 2,6-Disubstituted trans-Spirocyclohexanones.
The Journal of organic chemistry, 2016, 81, 2420-2431
4036609 CIFC21 H15 Br O2P 1 21/c 116.7257; 8.6177; 12.0468
90; 104.961; 90
1677.5He, Xinwei; Tao, Jiajia; Hu, Xiaoqian; Wang, Hui; Shang, Yongjia
FeCl3-Mediated One-Pot Domino Reactions for the Synthesis of 9-Aryl/9-Arylethynyl-2,3,4,9-tetrahydro-1H-xanthen-1-ones from Propargylic Amines/Diaryl Amines and 1,3-Cyclohexanediones.
The Journal of organic chemistry, 2016, 81, 2062-2069
4036610 CIFC20 H18 O3P 1 21/c 15.6299; 18.125; 15.3048
90; 94.98; 90
1555.8He, Xinwei; Tao, Jiajia; Hu, Xiaoqian; Wang, Hui; Shang, Yongjia
FeCl3-Mediated One-Pot Domino Reactions for the Synthesis of 9-Aryl/9-Arylethynyl-2,3,4,9-tetrahydro-1H-xanthen-1-ones from Propargylic Amines/Diaryl Amines and 1,3-Cyclohexanediones.
The Journal of organic chemistry, 2016, 81, 2062-2069
4036611 CIFC16 H22 I N OP -16.3333; 12.763; 19.654
78.988; 88.769; 89.774
1559.1Song, Liyan; Fang, Xinqiang; Wang, Zijia; Liu, Kun; Li, Chaozhong
Stereoselectivity of 6-Exo Cyclization of α-Carbamoyl Radicals.
The Journal of organic chemistry, 2016, 81, 2442-2450
4036612 CIFC37 H29 N O SP 1 21/n 111.605; 20.355; 12.058
90; 92.968; 90
2845Fukuzumi, Keita; Unoh, Yuto; Nishii, Yuji; Satoh, Tetsuya; Hirano, Koji; Miura, Masahiro
Synthesis of Benzo[c]thiophenes by Rhodium(III)-Catalyzed Dehydrogenative Annulation.
The Journal of organic chemistry, 2016, 81, 2474-2481
4036613 CIFC16 H19 F2 N OP -15.7679; 9.859; 13.531
73.54; 85.59; 81.51
729.3Chen, Qiao; Wang, Chao; Zhou, Jiawei; Wang, Yanan; Xu, Zhaoqing; Wang, Rui
CuSO4-Mediated Decarboxylative Difluoroacetamidation of α,β-Unsaturated Carboxylic Acids.
The Journal of organic chemistry, 2016, 81, 2639-2645
4036614 CIFC28 H40 O4P 1 21 16.5903; 27.7886; 13.8017
90; 101.747; 90
2474.64Chang, Ee Ling; Bolte, Benoit; Lan, Ping; Willis, Anthony C.; Banwell, Martin G.
Chemoenzymatic Total Syntheses of the Enantiomers of the Protoilludanes 8-Deoxydihydrotsugicoline and Radudiol.
The Journal of organic chemistry, 2016, 81, 2078-2086
4036615 CIFC15 H26 O2C 1 2 133.1997; 9.6115; 13.8952
90; 99.7857; 90
4369.43Chang, Ee Ling; Bolte, Benoit; Lan, Ping; Willis, Anthony C.; Banwell, Martin G.
Chemoenzymatic Total Syntheses of the Enantiomers of the Protoilludanes 8-Deoxydihydrotsugicoline and Radudiol.
The Journal of organic chemistry, 2016, 81, 2078-2086
4036616 CIFC14 H20 O2P 21 21 215.8991; 12.6249; 16.8455
90; 90; 90
1254.58Chang, Ee Ling; Bolte, Benoit; Lan, Ping; Willis, Anthony C.; Banwell, Martin G.
Chemoenzymatic Total Syntheses of the Enantiomers of the Protoilludanes 8-Deoxydihydrotsugicoline and Radudiol.
The Journal of organic chemistry, 2016, 81, 2078-2086
4036617 CIFC14 H20 O2P 21 21 217.0022; 12.5744; 14.0683
90; 90; 90
1238.69Chang, Ee Ling; Bolte, Benoit; Lan, Ping; Willis, Anthony C.; Banwell, Martin G.
Chemoenzymatic Total Syntheses of the Enantiomers of the Protoilludanes 8-Deoxydihydrotsugicoline and Radudiol.
The Journal of organic chemistry, 2016, 81, 2078-2086
4036618 CIFC15 H26 O2P 6521.353; 21.353; 5.8048
90; 90; 120
2292.1Chang, Ee Ling; Bolte, Benoit; Lan, Ping; Willis, Anthony C.; Banwell, Martin G.
Chemoenzymatic Total Syntheses of the Enantiomers of the Protoilludanes 8-Deoxydihydrotsugicoline and Radudiol.
The Journal of organic chemistry, 2016, 81, 2078-2086
4036619 CIFC14 H20 O2P 21 21 218.3922; 8.6217; 17.1215
90; 90; 90
1238.83Chang, Ee Ling; Bolte, Benoit; Lan, Ping; Willis, Anthony C.; Banwell, Martin G.
Chemoenzymatic Total Syntheses of the Enantiomers of the Protoilludanes 8-Deoxydihydrotsugicoline and Radudiol.
The Journal of organic chemistry, 2016, 81, 2078-2086
4036620 CIFC19 H28 O3 S2P 21 21 216.2794; 13.2695; 23.5284
90; 90; 90
1960.49Chang, Ee Ling; Bolte, Benoit; Lan, Ping; Willis, Anthony C.; Banwell, Martin G.
Chemoenzymatic Total Syntheses of the Enantiomers of the Protoilludanes 8-Deoxydihydrotsugicoline and Radudiol.
The Journal of organic chemistry, 2016, 81, 2078-2086
4036621 CIFC15 H24 O3P 1 21 18.5891; 16.7819; 9.8613
90; 95.8337; 90
1414.06Chang, Ee Ling; Bolte, Benoit; Lan, Ping; Willis, Anthony C.; Banwell, Martin G.
Chemoenzymatic Total Syntheses of the Enantiomers of the Protoilludanes 8-Deoxydihydrotsugicoline and Radudiol.
The Journal of organic chemistry, 2016, 81, 2078-2086
4036622 CIFC22 H33 N4 O PP 21 21 2112.8626; 17.9115; 20.6589
90; 90; 90
4759.6Yang, Bing; Shen, Minxing; Ji, Xiaozhou; Xu, Ziyan; Sun, Hao; Jiang, Bo; Li, Guigen
Chiral N-Phosphonyl Imines for an Aza-Morita-Baylis-Hillman Reaction via Group-Assisted Purification (GAP) Chemistry.
The Journal of organic chemistry, 2016, 81, 2488-2493
4036623 CIFC19 H24 F N O4 SP 1 21 110.695; 6.585; 14.025
90; 111.141; 90
921.3Zhang, Lumin; Zhu, Lili; Yang, Jun; Luo, Jisheng; Hong, Ran
Stereoselective α-Hydroxylation of Amides Using Oppolzer's Sultam as Chiral Auxiliary.
The Journal of organic chemistry, 2016, 81, 3890-3900
4036624 CIFC20 H27 N O5 SP 1 21 111.5968; 8.2171; 21.456
90; 104.481; 90
1979.6Zhang, Lumin; Zhu, Lili; Yang, Jun; Luo, Jisheng; Hong, Ran
Stereoselective α-Hydroxylation of Amides Using Oppolzer's Sultam as Chiral Auxiliary.
The Journal of organic chemistry, 2016, 81, 3890-3900
4036625 CIFC22 H14 F5 N O4P 1 21/c 19.0667; 11.32; 19.536
90; 100.124; 90
1973.9Wang, Huai-Wei; Cui, Pei-Pei; Lu, Yi; Sun, Wei-Yin; Yu, Jin-Quan
Ligand-Promoted Rh(III)-Catalyzed Coupling of Aryl C-H Bonds with Arylboron Reagents.
The Journal of organic chemistry, 2016, 81, 3416-3422
4036626 CIFC20 H18 F3 N O3 SP 1 21 19.87; 10.0817; 10.2033
90; 111.452; 90
944.96Zhang, Sheng; Cha, Lide; Li, Lijun; Hu, Yanbin; Li, Yanan; Zha, Zhenggen; Wang, Zhiyong
Asymmetric Formal Aza-Diels-Alder Reaction of Trifluoromethyl Hemiaminals with Enones Catalyzed by Primary Amines.
The Journal of organic chemistry, 2016, 81, 3177-3187
4036627 CIFC42 H50 S4C 1 2/c 137.458; 5.4399; 17.8501
90; 106.94; 90
3479.5Chen, Yung-Lung; Hsu, Jhih-Yang; Lin, Fang-Yu; Lai, Yu-Ying; Chou, Hsiao-Chieh; Cheng, Yen-Ju
Synthesis and Isomeric Effects of Ladder-Type Alkylated Terbenzodithiophene Derivatives.
The Journal of organic chemistry, 2016, 81, 2534-2542
4036628 CIFC93 H135 S6P -112.1896; 18.8338; 19.3
75.146; 77.385; 80.428
4150.7Chen, Yung-Lung; Hsu, Jhih-Yang; Lin, Fang-Yu; Lai, Yu-Ying; Chou, Hsiao-Chieh; Cheng, Yen-Ju
Synthesis and Isomeric Effects of Ladder-Type Alkylated Terbenzodithiophene Derivatives.
The Journal of organic chemistry, 2016, 81, 2534-2542
4036629 CIFC42 H50 S4P -15.3269; 18.171; 21.724
99.222; 93.005; 95.081
2062.7Chen, Yung-Lung; Hsu, Jhih-Yang; Lin, Fang-Yu; Lai, Yu-Ying; Chou, Hsiao-Chieh; Cheng, Yen-Ju
Synthesis and Isomeric Effects of Ladder-Type Alkylated Terbenzodithiophene Derivatives.
The Journal of organic chemistry, 2016, 81, 2534-2542
4036630 CIFC21 H20 O2P -18.6924; 12.8173; 15.9368
105.053; 101.173; 91.003
1677.8Parmar, Bhagyashri D.; Sutariya, Tushar R.; Brahmbhatt, Gaurangkumar C.; Parmar, Narsidas J.; Kant, Rajni; Gupta, Vivek K.
A Base-Catalyzed, Domino Aldol/hetero-Diels-Alder Synthesis of Tricyclic Pyrano[3,4-c]chromenes in Glycerol.
The Journal of organic chemistry, 2016, 81, 4955-4964
4036631 CIFC24 H22 O2P 1 21/c 111.7252; 12.2681; 12.3225
90; 97.388; 90
1757.83Parmar, Bhagyashri D.; Sutariya, Tushar R.; Brahmbhatt, Gaurangkumar C.; Parmar, Narsidas J.; Kant, Rajni; Gupta, Vivek K.
A Base-Catalyzed, Domino Aldol/hetero-Diels-Alder Synthesis of Tricyclic Pyrano[3,4-c]chromenes in Glycerol.
The Journal of organic chemistry, 2016, 81, 4955-4964
4036632 CIFC25 H26 Cl N O4P 1 21/n 111.5568; 16.7624; 12.9551
90; 116.227; 90
2251.29Smith, Robert J.; Mills, Daniel A.; Nhu, Duong; Tan, Eng Wui; Lucas, Nigel T.; Hawkins, Bill C.
The Synthesis of Multifunctionalized 1,3-Oxazin-4-ones from Donor-Acceptor Cyclopropanes.
The Journal of organic chemistry, 2016, 81, 2099-2105
4036633 CIFC15 H11 N O S2P -15.6221; 9.6836; 12.619
87.223; 88.919; 85.132
683.6Dar, Ajaz A.; Shadab, M.; Khan, Suman; Ali, Nahid; Khan, Abu T.
One-Pot Synthesis and Evaluation of Antileishmanial Activities of Functionalized S-Alkyl/Aryl Benzothiazole-2-carbothioate Scaffold.
The Journal of organic chemistry, 2016, 81, 3149-3160
4036634 CIFC15 H10 Cl N O S2P -18.125; 8.2239; 10.6956
90.93; 96.487; 93.239
708.78Dar, Ajaz A.; Shadab, M.; Khan, Suman; Ali, Nahid; Khan, Abu T.
One-Pot Synthesis and Evaluation of Antileishmanial Activities of Functionalized S-Alkyl/Aryl Benzothiazole-2-carbothioate Scaffold.
The Journal of organic chemistry, 2016, 81, 3149-3160
4036635 CIFC18 H8 S4P 1 21/n 15.24926; 14.3321; 18.3411
90; 90.107; 90
1379.85Yamamoto, Atsushi; Matsui, Yasunori; Asada, Toshio; Kumeda, Motoki; Takagi, Kenichiro; Suenaga, Yu; Nagae, Kunihiko; Ohta, Eisuke; Sato, Hiroyasu; Koseki, Shiro; Naito, Hiroyoshi; Ikeda, Hiroshi
Amorphous Solid Simulation and Trial Fabrication of the Organic Field-Effect Transistor of Tetrathienonaphthalenes Prepared by Using Microflow Photochemical Reactions: A Theoretical Calculation-Inspired Investigation.
The Journal of organic chemistry, 2016, 81, 3168-3176
4036636 CIFC25 H27 N3 O5 SP -110.4968; 11.6056; 12.325
76.616; 70.06; 65.542
1277.61Zeng, Xue-Mei; Xie, Jian-Wu
Enantioselective Synthesis of Ring-Fused Spiroannulated 1,2,3-Thiadiazole Derivatives.
The Journal of organic chemistry, 2016, 81, 3553-3559
4036637 CIFC25 H29 N3 O5 SP 1 21 18.6809; 14.1972; 10.4181
90; 100.521; 90
1262.39Zeng, Xue-Mei; Xie, Jian-Wu
Enantioselective Synthesis of Ring-Fused Spiroannulated 1,2,3-Thiadiazole Derivatives.
The Journal of organic chemistry, 2016, 81, 3553-3559
4036638 CIFC24 H23 N3 O6 SP 21 21 2110.872; 12.354; 17.965
90; 90; 90
2412.9Zeng, Xue-Mei; Xie, Jian-Wu
Enantioselective Synthesis of Ring-Fused Spiroannulated 1,2,3-Thiadiazole Derivatives.
The Journal of organic chemistry, 2016, 81, 3553-3559
4036639 CIFC15 H10 N2 O2P 1 21/n 15.4955; 8.697; 24.108
90; 91.925; 90
1151.6Zhang, Ju; Zhang, Xinying; Fan, Xuesen
Synthesis of Indeno[1',2':4,5]imidazo[1,2-a]pyridin-11-ones and Chromeno[4',3':4,5]imidazo[1,2-a]pyridin-6-ones through Palladium-Catalyzed Cascade Reactions of 2-(2-Bromophenyl)imidazo[1,2-a]pyridines.
The Journal of organic chemistry, 2016, 81, 3206-3213
4036640 CIFC8 H7 O Te2P n a 2111.4121; 16.6843; 4.8996
90; 90; 90
932.9Prasad, Poonam Rajesh; Selvakumar, Karuthapandi; Singh, Harkesh B.; Butcher, Ray J.
Synthesis, Structure, and Bonding of 1-Oxa-6,6aλ(4)- chalcogenopentalenes and Related Derivatives; The Role of Intramolecular Coordination.
The Journal of organic chemistry, 2016, 81, 3214-3226
4036641 CIFC8 H8 O Se2C 1 2/m 114.8825; 7.0999; 8.2818
90; 95.735; 90
870.71Prasad, Poonam Rajesh; Selvakumar, Karuthapandi; Singh, Harkesh B.; Butcher, Ray J.
Synthesis, Structure, and Bonding of 1-Oxa-6,6aλ(4)- chalcogenopentalenes and Related Derivatives; The Role of Intramolecular Coordination.
The Journal of organic chemistry, 2016, 81, 3214-3226
4036642 CIFC14 H14 O2 TeP 1 21/c 19.2886; 14.636; 9.5487
90; 103.428; 90
1262.64Prasad, Poonam Rajesh; Selvakumar, Karuthapandi; Singh, Harkesh B.; Butcher, Ray J.
Synthesis, Structure, and Bonding of 1-Oxa-6,6aλ(4)- chalcogenopentalenes and Related Derivatives; The Role of Intramolecular Coordination.
The Journal of organic chemistry, 2016, 81, 3214-3226
4036643 CIFC8 H8 O2 TeP 21 21 215.0396; 6.4746; 23.7857
90; 90; 90
776.11Prasad, Poonam Rajesh; Selvakumar, Karuthapandi; Singh, Harkesh B.; Butcher, Ray J.
Synthesis, Structure, and Bonding of 1-Oxa-6,6aλ(4)- chalcogenopentalenes and Related Derivatives; The Role of Intramolecular Coordination.
The Journal of organic chemistry, 2016, 81, 3214-3226
4036644 CIFC8 H8 O2 SeP -17.8765; 8.1219; 13.0249
74.478; 76.975; 89.917
780.65Prasad, Poonam Rajesh; Selvakumar, Karuthapandi; Singh, Harkesh B.; Butcher, Ray J.
Synthesis, Structure, and Bonding of 1-Oxa-6,6aλ(4)- chalcogenopentalenes and Related Derivatives; The Role of Intramolecular Coordination.
The Journal of organic chemistry, 2016, 81, 3214-3226
4036645 CIFC8 H8 O S2P -16.8851; 7.9251; 8.1801
85.683; 89.92; 64.419
401.21Prasad, Poonam Rajesh; Selvakumar, Karuthapandi; Singh, Harkesh B.; Butcher, Ray J.
Synthesis, Structure, and Bonding of 1-Oxa-6,6aλ(4)- chalcogenopentalenes and Related Derivatives; The Role of Intramolecular Coordination.
The Journal of organic chemistry, 2016, 81, 3214-3226
4036646 CIFC18 H28 O3 SP 1 21/c 112.593; 12.991; 10.908
90; 98.5; 90
1765Wang, Yinli; Oriez, Raphaël; Kuwano, Satoru; Yamaoka, Yousuke; Takasu, Kiyosei; Yamada, Ken-ichi
Oxa- and Azacycle Formation via Migrative Cyclization of Sulfonylalkynol and Sulfonylalkynamide with N-Heterocyclic Carbene.
The Journal of organic chemistry, 2016, 81, 2652-2664
4036647 CIFC18 H27 N O4 SC 1 2/c 123.169; 7.2093; 21.235
90; 92.196; 90
3544.3Wang, Yinli; Oriez, Raphaël; Kuwano, Satoru; Yamaoka, Yousuke; Takasu, Kiyosei; Yamada, Ken-ichi
Oxa- and Azacycle Formation via Migrative Cyclization of Sulfonylalkynol and Sulfonylalkynamide with N-Heterocyclic Carbene.
The Journal of organic chemistry, 2016, 81, 2652-2664
4036648 CIFC17 H16 I N3P 1 21/c 116.715; 5.5827; 17.44
90; 97.706; 90
1612.7Zhu, Li-Li; Xu, Xiao-Qi; Shi, Jin-Wei; Chen, Bai-Ling; Chen, Zili
N(2)-Selective Iodofunctionalization of Olefins with NH-1,2,3-Triazoles to provide N(2)-Alkyl-Substituted 1,2,3-Triazoles.
The Journal of organic chemistry, 2016, 81, 3568-3575
4036649 CIFC8 H10 N2P -14.1693; 8.687; 10.729
95.442; 90.247; 95.864
384.78Kerisit, Nicolas; Rouxel, Cédric; Colombel-Rouen, Sophie; Toupet, Loïc; Guillemin, Jean-Claude; Trolez, Yann
Synthesis, Chemistry, and Photochemistry of Methylcyanobutadiyne in the Context of Space Science.
The Journal of organic chemistry, 2016, 81, 3560-3567
4036650 CIFC10 H12 N2 OP 21 21 214.3708; 13.7544; 15.5815
90; 90; 90
936.72Kerisit, Nicolas; Rouxel, Cédric; Colombel-Rouen, Sophie; Toupet, Loïc; Guillemin, Jean-Claude; Trolez, Yann
Synthesis, Chemistry, and Photochemistry of Methylcyanobutadiyne in the Context of Space Science.
The Journal of organic chemistry, 2016, 81, 3560-3567
4036651 CIFC198 H192 N22 O11P -115.7178; 24.0271; 24.33
69.559; 77.422; 75.919
8261.4Servalli, Marco; Trapp, Nils; Wörle, Michael; Klärner, Frank-Gerrit
Anthraphane: An Anthracene-Based, Propeller-Shaped D(3h)-Symmetric Hydrocarbon Cyclophane and Its Layered Single Crystal Structures.
The Journal of organic chemistry, 2016, 81, 2572-2580
4036652 CIFC84 H42 Cl6P -115.231; 15.402; 18.805
92.352; 110.492; 118.971
3493.8Servalli, Marco; Trapp, Nils; Wörle, Michael; Klärner, Frank-Gerrit
Anthraphane: An Anthracene-Based, Propeller-Shaped D(3h)-Symmetric Hydrocarbon Cyclophane and Its Layered Single Crystal Structures.
The Journal of organic chemistry, 2016, 81, 2572-2580
4036653 CIFC72 H35 N O2P -113.25; 14.375; 14.817
91.436; 101.907; 115.796
2465.1Servalli, Marco; Trapp, Nils; Wörle, Michael; Klärner, Frank-Gerrit
Anthraphane: An Anthracene-Based, Propeller-Shaped D(3h)-Symmetric Hydrocarbon Cyclophane and Its Layered Single Crystal Structures.
The Journal of organic chemistry, 2016, 81, 2572-2580
4036654 CIFC75 H37 NP -113.2486; 14.4507; 14.8798
91.989; 102.018; 115.489
2490.1Servalli, Marco; Trapp, Nils; Wörle, Michael; Klärner, Frank-Gerrit
Anthraphane: An Anthracene-Based, Propeller-Shaped D(3h)-Symmetric Hydrocarbon Cyclophane and Its Layered Single Crystal Structures.
The Journal of organic chemistry, 2016, 81, 2572-2580
4036655 CIFC96 H84 N6 O6R -3 c :H16.4148; 16.4148; 50.878
90; 90; 120
11872.2Servalli, Marco; Trapp, Nils; Wörle, Michael; Klärner, Frank-Gerrit
Anthraphane: An Anthracene-Based, Propeller-Shaped D(3h)-Symmetric Hydrocarbon Cyclophane and Its Layered Single Crystal Structures.
The Journal of organic chemistry, 2016, 81, 2572-2580
4036656 CIFC73 H38 OP -113.25; 14.51; 14.908
91.851; 101.701; 115.336
2513.6Servalli, Marco; Trapp, Nils; Wörle, Michael; Klärner, Frank-Gerrit
Anthraphane: An Anthracene-Based, Propeller-Shaped D(3h)-Symmetric Hydrocarbon Cyclophane and Its Layered Single Crystal Structures.
The Journal of organic chemistry, 2016, 81, 2572-2580
4036657 CIFC96 H58 O2P -115.1984; 15.6148; 17.8003
75.887; 67.008; 61.703
3415.1Servalli, Marco; Trapp, Nils; Wörle, Michael; Klärner, Frank-Gerrit
Anthraphane: An Anthracene-Based, Propeller-Shaped D(3h)-Symmetric Hydrocarbon Cyclophane and Its Layered Single Crystal Structures.
The Journal of organic chemistry, 2016, 81, 2572-2580
4036658 CIFC59 H29 Cl4 F9 O9 S3P -113.642; 14.778; 15.643
108.404; 110.867; 98.818
2667.5Servalli, Marco; Trapp, Nils; Wörle, Michael; Klärner, Frank-Gerrit
Anthraphane: An Anthracene-Based, Propeller-Shaped D(3h)-Symmetric Hydrocarbon Cyclophane and Its Layered Single Crystal Structures.
The Journal of organic chemistry, 2016, 81, 2572-2580
4036659 CIFC90 H50 O2P 1 21/c 116.5811; 15.2702; 24.5373
90; 100.308; 90
6112.5Servalli, Marco; Trapp, Nils; Wörle, Michael; Klärner, Frank-Gerrit
Anthraphane: An Anthracene-Based, Propeller-Shaped D(3h)-Symmetric Hydrocarbon Cyclophane and Its Layered Single Crystal Structures.
The Journal of organic chemistry, 2016, 81, 2572-2580
4036660 CIFC6 H6 N O5 PP -17.462; 7.805; 8.031
68.53; 63.42; 88.31
384.2Dziuganowska, Zofia A.; Ślepokura, Katarzyna; Volle, Jean-Noël; Virieux, David; Pirat, Jean-Luc; Kafarski, Paweł
Structural Analogues of Selfotel.
The Journal of organic chemistry, 2016, 81, 4947-4954
4036661 CIFC6 H6 N O5 PP 1 21/c 15.565; 12.901; 10.161
90; 98.32; 90
721.8Dziuganowska, Zofia A.; Ślepokura, Katarzyna; Volle, Jean-Noël; Virieux, David; Pirat, Jean-Luc; Kafarski, Paweł
Structural Analogues of Selfotel.
The Journal of organic chemistry, 2016, 81, 4947-4954
4036662 CIFC6 H6 N O5 PP 1 21/c 18.864; 9.92; 9.5
90; 115.8; 90
752.1Dziuganowska, Zofia A.; Ślepokura, Katarzyna; Volle, Jean-Noël; Virieux, David; Pirat, Jean-Luc; Kafarski, Paweł
Structural Analogues of Selfotel.
The Journal of organic chemistry, 2016, 81, 4947-4954
4036663 CIFC6 H8 N O6 PP -19.349; 9.59; 10.611
69.88; 72; 74.94
836.9Dziuganowska, Zofia A.; Ślepokura, Katarzyna; Volle, Jean-Noël; Virieux, David; Pirat, Jean-Luc; Kafarski, Paweł
Structural Analogues of Selfotel.
The Journal of organic chemistry, 2016, 81, 4947-4954
4036664 CIFC6 H8 N O6 PP b c a7.497; 9.928; 23.123
90; 90; 90
1721Dziuganowska, Zofia A.; Ślepokura, Katarzyna; Volle, Jean-Noël; Virieux, David; Pirat, Jean-Luc; Kafarski, Paweł
Structural Analogues of Selfotel.
The Journal of organic chemistry, 2016, 81, 4947-4954
4036665 CIFC5 H7 N O6 P2P 21 21 214.948; 12.937; 13.024
90; 90; 90
833.7Dziuganowska, Zofia A.; Ślepokura, Katarzyna; Volle, Jean-Noël; Virieux, David; Pirat, Jean-Luc; Kafarski, Paweł
Structural Analogues of Selfotel.
The Journal of organic chemistry, 2016, 81, 4947-4954
4036666 CIFC6 H9 N O6 P2P 1 21/c 113.41; 8.969; 17.268
90; 110.48; 90
1945.6Dziuganowska, Zofia A.; Ślepokura, Katarzyna; Volle, Jean-Noël; Virieux, David; Pirat, Jean-Luc; Kafarski, Paweł
Structural Analogues of Selfotel.
The Journal of organic chemistry, 2016, 81, 4947-4954
4036667 CIFC6 H12 N O5 PP 1 21/n 15.93; 13.177; 11.05
90; 95.51; 90
859.5Dziuganowska, Zofia A.; Ślepokura, Katarzyna; Volle, Jean-Noël; Virieux, David; Pirat, Jean-Luc; Kafarski, Paweł
Structural Analogues of Selfotel.
The Journal of organic chemistry, 2016, 81, 4947-4954
4036668 CIFC6 H14 N O6 PP 1 21/n 17.586; 6.943; 18.472
90; 99.37; 90
959.9Dziuganowska, Zofia A.; Ślepokura, Katarzyna; Volle, Jean-Noël; Virieux, David; Pirat, Jean-Luc; Kafarski, Paweł
Structural Analogues of Selfotel.
The Journal of organic chemistry, 2016, 81, 4947-4954
4036669 CIFC18 H12 Cl N O3 SP c c n18.0157; 24.8696; 7.5007
90; 90; 90
3360.6Bharathiraja, Ganesan; Sathishkannan, Gopal; Punniyamurthy, Tharmalingam
Domino Synthesis of Tetrasubstituted Thiophenes from 1,3-Enynes with Mercaptoacetaldehyde.
The Journal of organic chemistry, 2016, 81, 2670-2674
4036670 CIFC31 H37 Au N4 O4C 1 2/c 117.7379; 9.4418; 18.8452
90; 106.138; 90
3031.78Mir, Roya; Dudding, Travis
A Au(I)-Precatalyst with a Cyclopropenium Counterion: An Unusual Ion Pair.
The Journal of organic chemistry, 2016, 81, 2675-2679
4036671 CIFC11 H11 N O2P 1 21/n 14.7994; 13.7192; 13.8234
90; 95.721; 90
905.65Li, Xing Guang; Sun, Min; Jin, Qiao; Liu, Kai; Liu, Pei Nian
Access to Isoquinolines and Isoquinolin-3-ols via Rh(III)-Catalyzed Coupling/Cyclization Cascade Reaction of Arylimidates and Diazo Compounds.
The Journal of organic chemistry, 2016, 81, 3901-3910
4036672 CIFC24 H21 N O3P 1 21/c 111.414; 22.478; 7.5849
90; 105.181; 90
1878.1Li, Xing Guang; Sun, Min; Jin, Qiao; Liu, Kai; Liu, Pei Nian
Access to Isoquinolines and Isoquinolin-3-ols via Rh(III)-Catalyzed Coupling/Cyclization Cascade Reaction of Arylimidates and Diazo Compounds.
The Journal of organic chemistry, 2016, 81, 3901-3910
4036673 CIFC35 H36 B N3P b c a12.742; 14.71; 29.88
90; 90; 90
5601Más-Montoya, Miriam; Usea, Laura; Espinosa Ferao, Arturo; Montenegro, María F; Ramírez de Arellano, Carmen; Tárraga, Alberto; Rodríguez-López, José N; Curiel, David
Single Heteroatom Fine-Tuning of the Emissive Properties in Organoboron Complexes with 7-(Azaheteroaryl)indole Systems.
The Journal of organic chemistry, 2016, 81, 3296-3302

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