Crystallography Open Database

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1513124 CIFC30 H33 Cl N2 O3 SC 1 2 137.404; 6.7314; 10.8232
90; 90.249; 90
2725.1Xu, Qing-Long; Zhuo, Chun-Xiang; Dai, Li-Xin; You, Shu-Li
Highly Enantioselective Synthesis of TetrahydrocarbolinesviaIridium-Catalyzed Intramolecular Friedel‒Crafts Type Allylic Alkylation Reactions
Organic Letters, 2013, 15, 5909
1513125 CIFC31 H35 Br N2 O3P 21 21 219.9583; 11.9802; 22.9491
90; 90; 90
2737.9Ryabchuk, Pavel; Edwards, Andrew; Gerasimchuk, Nikolay; Rubina, Marina; Rubin, Michael
Dual Control of the Selectivity in the Formal Nucleophilic Substitution of Bromocyclopropanes en Route to Densely Functionalized, Chirally Rich Cyclopropyl Derivatives
Organic Letters, 2013, 15, 6010
1513126 CIFC23 H29 N O2P 21 21 219.6721; 19.6189; 21.5843
90; 90; 90
4095.7Ryabchuk, Pavel; Edwards, Andrew; Gerasimchuk, Nikolay; Rubina, Marina; Rubin, Michael
Dual Control of the Selectivity in the Formal Nucleophilic Substitution of Bromocyclopropanes en Route to Densely Functionalized, Chirally Rich Cyclopropyl Derivatives
Organic Letters, 2013, 15, 6010
1513127 CIFC17 H16 O2P -15.3111; 11.4886; 11.49
104.545; 103.338; 93.62
654.83Cui, Chun-Xiao; Li, Hui; Yang, Xian-Jin; Yang, Jun; Li, Xiao-Qiang
One-Pot Synthesis of Functionalized 2,5-Dihydrofurans via an Amine-Promoted Petasis Borono‒Mannich Reaction
Organic Letters, 2013, 15, 5944
1513128 CIFC28 H25 Br O6 S2P b c a17.494; 10.8153; 27.104
90; 90; 90
5128.2Zheng, Jie; Huang, You; Li, Zhengming
Phosphine-Catalyzed Domino Reaction: An Efficient Method for the Synthesis of Bicyclo[3.2.0]heptenes Skeleton.
Organic letters, 2013, 15, 5758-5761
1513129 CIFC17 H20 N2P m m n :214.1243; 6.7924; 7.1322
90; 90; 90
684.25Chen, Lei; Mahmoud, Sufian M.; Yin, Xiaodong; Lalancette, Roger A.; Pietrangelo, Agostino
Decreasing Aromaticity in π-Conjugated Materials: Efficient Synthesis and Electronic Structure Identification of Cyclopentadiene-Containing Systems
Organic Letters, 2013, 15, 5970
1513130 CIFC15 H14 O2P n a 2116.7078; 7.0015; 20.3649
90; 90; 90
2382.3Chen, Lei; Mahmoud, Sufian M.; Yin, Xiaodong; Lalancette, Roger A.; Pietrangelo, Agostino
Decreasing Aromaticity in π-Conjugated Materials: Efficient Synthesis and Electronic Structure Identification of Cyclopentadiene-Containing Systems
Organic Letters, 2013, 15, 5970
1513131 CIFC19 H32 B2 O4F d d 234.026; 18.078; 6.8131
90; 90; 90
4190.9Chen, Lei; Mahmoud, Sufian M.; Yin, Xiaodong; Lalancette, Roger A.; Pietrangelo, Agostino
Decreasing Aromaticity in π-Conjugated Materials: Efficient Synthesis and Electronic Structure Identification of Cyclopentadiene-Containing Systems
Organic Letters, 2013, 15, 5970
1513132 CIFC19 H18P n a 2115.9505; 14.6663; 5.851
90; 90; 90
1368.75Chen, Lei; Mahmoud, Sufian M.; Yin, Xiaodong; Lalancette, Roger A.; Pietrangelo, Agostino
Decreasing Aromaticity in π-Conjugated Materials: Efficient Synthesis and Electronic Structure Identification of Cyclopentadiene-Containing Systems
Organic Letters, 2013, 15, 5970
1513133 CIFC15 H14 S2P c a 217.5615; 21.1348; 16.2978
90; 90; 90
2604.56Chen, Lei; Mahmoud, Sufian M.; Yin, Xiaodong; Lalancette, Roger A.; Pietrangelo, Agostino
Decreasing Aromaticity in π-Conjugated Materials: Efficient Synthesis and Electronic Structure Identification of Cyclopentadiene-Containing Systems
Organic Letters, 2013, 15, 5970
1513134 CIFC29 H27 Cl N4 O3 SP 1 21/c 111.8463; 13.189; 17.3532
90; 91.8; 90
2709.9Zhou, Fenguo; Liu, Xu; Zhang, Ning; Liang, Yongjiu; Zhang, Rui; Xin, Xiaoqing; Dong, Dewen
Copper-Catalyzed Three-Component Reaction: Solvent-Controlled Regioselective Synthesis of 4-Amino- and 6-Amino-2-iminopyridines.
Organic letters, 2013, 15, 5786-5789
1513135 CIFC32 H34 N4 O2 TiC 1 2/c 116.2081; 13.8771; 25.5319
90; 97.52; 90
5693.3Chong, Eugene; Schafer, Laurel L.
2-Pyridonate Titanium Complexes for Chemoselectivity. Accessing Intramolecular Hydroaminoalkylation over Hydroamination
Organic Letters, 2013, 15, 6002
1513136 CIFC17 H19 N O2 SP 1 21/c 19.737; 23.103; 7.481
90; 110.674; 90
1574.5Chong, Eugene; Schafer, Laurel L.
2-Pyridonate Titanium Complexes for Chemoselectivity. Accessing Intramolecular Hydroaminoalkylation over Hydroamination
Organic Letters, 2013, 15, 6002
1513137 CIFC31 H39 N O2 SP -110.6913; 11.55; 12.416
73.755; 72.091; 66.422
1315.33Chong, Eugene; Schafer, Laurel L.
2-Pyridonate Titanium Complexes for Chemoselectivity. Accessing Intramolecular Hydroaminoalkylation over Hydroamination
Organic Letters, 2013, 15, 6002
1513138 CIFC17 H25 N O2 SP 1 21/n 110.852; 11.501; 12.86
90; 94.93; 90
1599.1Chong, Eugene; Schafer, Laurel L.
2-Pyridonate Titanium Complexes for Chemoselectivity. Accessing Intramolecular Hydroaminoalkylation over Hydroamination
Organic Letters, 2013, 15, 6002
1513139 CIFC24 H34 I N O3 SiP 1 21 112.4043; 11.4302; 17.7674
90; 92.4761; 90
2516.77Schwarzwalder, Gregg M.; Steinhardt, Sarah E.; Pham, Hung V.; Houk, K. N.; Vanderwal, Christopher D.
Synthesis of the Tetracyclic Core of Exiguaquinol
Organic Letters, 2013, 15, 6014
1513140 CIFC17 H17 N O4P 1 21/n 16.486; 7.921; 27.059
90; 90.113; 90
1390.2Schwarzwalder, Gregg M.; Steinhardt, Sarah E.; Pham, Hung V.; Houk, K. N.; Vanderwal, Christopher D.
Synthesis of the Tetracyclic Core of Exiguaquinol
Organic Letters, 2013, 15, 6014
1513141 CIFC16 H23 N O3P 21 21 218.6643; 16.9926; 19.039
90; 90; 90
2803.1Zeng, Chen; Zheng, Changwu; Zhao, Jingyun; Zhao, Gang
Divergent Total Syntheses of (−)-Lycopladine D, (+)-Fawcettidine, and (+)-Lycoposerramine Q
Organic Letters, 2013, 15, 5846
1513142 CIFC8 H16 O5P 1 21 15.775; 8.1191; 10.0943
90; 93.44; 90
472.45Schmalisch, Sebastian; Mahrwald, Rainer
Organocatalyzed direct glycosylation of unprotected and unactivated carbohydrates.
Organic letters, 2013, 15, 5854-5857
1513143 CIFC16 H16 O3P 1 21/c 113.699; 6.316; 15.3815
90; 108.356; 90
1263.14Ngatimin, Marsewi; Frey, Raphael; Levens, Alison; Nakano, Yuji; Kowalczyk, Marcin; Konstas, Kristina; Hutt, Oliver E.; Lupton, David W.
Iodobenzene-Catalyzed Oxabicyclo[3.2.1]octane and [4.2.1]Nonane Synthesis via Cascade C‒O/C‒C Formation
Organic Letters, 2013, 15, 5858
1513144 CIFC17 H16 O4P 1 21/c 114.2105; 12.8932; 7.697
90; 102.363; 90
1377.53Ngatimin, Marsewi; Frey, Raphael; Levens, Alison; Nakano, Yuji; Kowalczyk, Marcin; Konstas, Kristina; Hutt, Oliver E.; Lupton, David W.
Iodobenzene-Catalyzed Oxabicyclo[3.2.1]octane and [4.2.1]Nonane Synthesis via Cascade C‒O/C‒C Formation
Organic Letters, 2013, 15, 5858
1513145 CIFC24 H18 OP 21 21 217.9684; 11.671; 18.419
90; 90; 90
1713Yin, Hui-Ying; Liu, Meng-Yuan; Shao, Li-Xiong
Two-Component, Three-Molecule Reactions between 2,3-Dihydroinden-1-ones and Aryl Chlorides Catalyzed by anN-Heterocyclic Carbene‒Palladium(II)‒1-Methylimidazole Complex
Organic Letters, 2013, 15, 6042
1513146 CIFC13 H11 N O2 SP 1 21/c 111.173; 8.197; 14.575
90; 112.89; 90
1230Singh, Neetu; Singh, Rahul; Raghuvanshi, Dushyant S.; Singh, Krishna Nand
Convenient MW-Assisted Synthesis of Unsymmetrical Sulfides Using Sulfonyl Hydrazides as Aryl Thiol Surrogate
Organic Letters, 2013, 15, 5874
1513147 CIFC18 H15 N3 SP 1 21/c 17.3509; 13.236; 17.3774
90; 96.212; 90
1680.83Das, Paramita; Ray, Suman; Mukhopadhyay, Chhanda
Exploitation of Dual Character of CN Moiety in the Synthesis of Uniquely Decorated 3H-Pyrroles: A Rare Observation.
Organic letters, 2013, 15, 5622-5625
1513148 CIFC18 H14 Cl N3 SP -110.3005; 13.8761; 14.074
109.27; 103.328; 106.93
1693.6Das, Paramita; Ray, Suman; Mukhopadhyay, Chhanda
Exploitation of Dual Character of CN Moiety in the Synthesis of Uniquely Decorated 3H-Pyrroles: A Rare Observation.
Organic letters, 2013, 15, 5622-5625
1513149 CIFC18 H13 Cl2 N3 SP 1 21/n 110.441; 12.297; 14.244
90; 92.363; 90
1827.3Das, Paramita; Ray, Suman; Mukhopadhyay, Chhanda
Exploitation of Dual Character of CN Moiety in the Synthesis of Uniquely Decorated 3H-Pyrroles: A Rare Observation.
Organic letters, 2013, 15, 5622-5625
1513150 CIFC24 H19 N3 SP 1 21/c 18.837; 15.942; 14.955
90; 107.099; 90
2013.7Das, Paramita; Ray, Suman; Mukhopadhyay, Chhanda
Exploitation of Dual Character of CN Moiety in the Synthesis of Uniquely Decorated 3H-Pyrroles: A Rare Observation.
Organic letters, 2013, 15, 5622-5625
1513151 CIFC18 H11 Cl N2 SP -17.4883; 9.0691; 11.6776
90.666; 103.398; 100.053
758.5Das, Paramita; Ray, Suman; Mukhopadhyay, Chhanda
Exploitation of Dual Character of CN Moiety in the Synthesis of Uniquely Decorated 3H-Pyrroles: A Rare Observation.
Organic letters, 2013, 15, 5622-5625
1513152 CIFC26 H30 O7P 21 21 2112.0469; 12.5034; 15.3775
90; 90; 90
2316.3Yuan, Yafei; Feng, Yu; Ren, Fengxia; Niu, Shubin; Liu, Xingzhong; Che, Yongsheng
A Botryane Metabolite with a New Hexacyclic Skeleton from an Entomogenous FungusHypocreasp.
Organic Letters, 2013, 15, 6050
1513153 CIFC17 H21 N O4 SP 1 21 19.255; 8.8201; 10.2868
90; 107.491; 90
800.89Liu, Yong; Kang, Tai-Ran; Liu, Quan-Zhong; Chen, Lian-Mei; Wang, Ya-Chuan; Liu, Jie; Xie, Yong-Mei; Yang, Jin-Liang; He, Long
Enantioselective [4 + 2] Cycloaddition of CyclicN-Sulfimines and Acyclic Enones or Ynones: A Concise Route to Sulfamidate-Fused 2,6-Disubstituted Piperidin-4-ones
Organic Letters, 2013, 15, 6090
1513154 CIFC19 H17 Br O2P -18.684; 9.003; 10.901
88.522; 81.148; 76.868
820.1Li, Xiao-Hui; Zheng, Bao-Hui; Ding, Chang-Hua; Hou, Xue-Long
Enantioselective Synthesis of 2,3-Disubstituted Indanones via Pd-Catalyzed Intramolecular Asymmetric Allylic Alkylation of Ketones
Organic Letters, 2013, 15, 6086
1513155 CIFC8 H11 N O5P 1 21/c 17.8071; 17.361; 6.722
90; 93.918; 90
909Schmidt, Christian D.; Kaschel, Johannes; Schneider, Tobias F.; Kratzert, Daniel; Stalke, Dietmar; Werz, Daniel B.
Donor-Substituted Nitrocyclopropanes: Immediate Ring-Enlargement to Cyclic Nitronates
Organic Letters, 2013, 15, 6098
1513156 CIFC10 H14 N2 O5P 1 21/c 112.4044; 10.3305; 9.007
90; 102.544; 90
1126.64Schmidt, Christian D.; Kaschel, Johannes; Schneider, Tobias F.; Kratzert, Daniel; Stalke, Dietmar; Werz, Daniel B.
Donor-Substituted Nitrocyclopropanes: Immediate Ring-Enlargement to Cyclic Nitronates
Organic Letters, 2013, 15, 6098
1513157 CIFC13 H15 N O5P b c a10.6801; 8.9717; 26.3836
90; 90; 90
2528.04Schmidt, Christian D.; Kaschel, Johannes; Schneider, Tobias F.; Kratzert, Daniel; Stalke, Dietmar; Werz, Daniel B.
Donor-Substituted Nitrocyclopropanes: Immediate Ring-Enlargement to Cyclic Nitronates
Organic Letters, 2013, 15, 6098
1513158 CIFC18 H17 N O4 SP 1 21/c 114.9906; 7.8091; 14.0672
90; 92.142; 90
1645.6Sun, Lang; Zhu, Yuanxun; Lu, Ping; Wang, Yanguang
Cu-Catalyzed 1,2-Dihydroisoquinolines Synthesis fromo-Ethynyl Benzacetals and Sulfonyl Azides
Organic Letters, 2013, 15, 5894
1513159 CIFC17 H15 Cl2 N O4 SP 1 21/c 111.6058; 7.0455; 21.6906
90; 95.904; 90
1764.2Sun, Lang; Zhu, Yuanxun; Lu, Ping; Wang, Yanguang
Cu-Catalyzed 1,2-Dihydroisoquinolines Synthesis fromo-Ethynyl Benzacetals and Sulfonyl Azides
Organic Letters, 2013, 15, 5894
1513160 CIFC34 H34 N4 O13 S2P 1 21/n 19.9318; 12.1574; 15.0926
90; 104.533; 90
1764Sun, Lang; Zhu, Yuanxun; Lu, Ping; Wang, Yanguang
Cu-Catalyzed 1,2-Dihydroisoquinolines Synthesis fromo-Ethynyl Benzacetals and Sulfonyl Azides
Organic Letters, 2013, 15, 5894
1513161 CIFC17 H25 N3 O2P 1 21/a 111.62; 8.989; 15.81
90; 96.74; 90
1640Mercalli, Valentina; Meneghetti, Fiorella; Tron, Gian Cesare
Isocyanide-Mediated Multicomponent Synthesis of C-Oximinoamidines
Organic Letters, 2013, 15, 5902
1513162 CIFC9 H18 O2F d d 215.3408; 44.262; 5.177
90; 90; 90
3515.3Tong, Benny Meng Kiat; Chen, Hui; Chong, Sin Yee; Heng, Yi Li; Chiba, Shunsuke
Formal [4 + 1]- and [5 + 1]-Annulation by an SN2‒Conjugate Addition Sequence: Stereoselective Synthesis of Highly Substituted Carbocyles
Organic Letters, 2013, 15, 6111
1513230 CIFC33 H33 N O2 SiP 1 21 17.9327; 11.455; 14.741
90; 91.991; 90
1338.7Clark, Robert W.; Deaton, T. Maxwell; Zhang, Yan; Moore, Maggie I.; Wiskur, Sheryl L.
Silylation-Based Kinetic Resolution of α-Hydroxy Lactones and Lactams.
Organic letters, 2013, 15, 6132-6135
1513231 CIFC29 H30 Br N O5P 1 21/n 110.1046; 10.2534; 27.1451
90; 98.586; 90
2780.9Ma, Chaoqun; Xing, Dong; Zhai, Changwei; Che, Jiuwei; Liu, Shunying; Wang, Jue; Hu, Wenhao
Iron Porphyrin-Catalyzed Three-Component Reaction of Ethyl Diazoacetate with Aliphatic Amines and β,γ-Unsaturated α-Keto Esters.
Organic letters, 2013, 15, 6140-6143
1513232 CIFC13 H10 I N O3C 1 2 120.2766; 11.0112; 13.5295
90; 123.314; 90
2524.3Murata, Yusuke; Takahashi, Masaki; Yagishita, Fumitoshi; Sakamoto, Masami; Sengoku, Tetsuya; Yoda, Hidemi
Construction of Spiro-Fused 2-Oxindole/α-Methylene- γ-Butyrolactone Systems with Extremely High Enantioselectivity via Indium-Catalyzed Amide Allylation of N-Methyl Isatin.
Organic letters, 2013, 15, 6182-6185
1513233 CIFC13 H10 N2 O3P 1 21/n 14.5247; 28.9366; 9.1022
90; 99.297; 90
1176.09Haas, Diana; Mosrin, Marc; Knochel, Paul
Regioselective Functionalization of the Oxazole Scaffold Using TMP-Bases of Mg and Zn.
Organic letters, 2013, 15, 6162-6165
1513234 CIFC28 H25 N O3 SP 1 21 111.138; 7.0903; 14.392
90; 95.354; 90
1131.6Ma, Chao; Gu, Jing; Teng, Bin; Zhou, Qing-Qing; Li, Rui; Chen, Ying-Chun
1-azadienes as regio- and chemoselective dienophiles in aminocatalytic asymmetric diels-alder reaction.
Organic letters, 2013, 15, 6206-6209
1513235 CIFC21 H26 F3 N O11P 1 21 17.3343; 20.6369; 7.8664
90; 104.127; 90
1154.63Malik, Michał; Witkowski, Grzegorz; Ceborska, Magdalena; Jarosz, Sławomir
Synthesis of Polyhydroxylated Quinolizidines and Azaspiro[4.5]decanes from d-Xylose.
Organic letters, 2013, 15, 6214-6217
1513236 CIFC16 H12 F3 N O2 SP 1 21/c 18.891; 16.505; 10.648
90; 101.244; 90
1532.6Sun, Xiaoqian; Lyu, Youran; Zhang-Negrerie, Daisy; Du, Yunfei; Zhao, Kang
Formation of Functionalized 2H-Azirines through PhIO-Mediated Trifluoroethoxylation and Azirination of Enamines.
Organic letters, 2013, 15, 6222-6225
1513237 CIFC29 H26P -16.2651; 11.9132; 14.2495
92.588; 94.143; 97.956
1048.92Sinu, C. R.; Suresh, Eringathodi; Nair, Vijay
N-heterocyclic carbene catalyzed reaction of cinnamils leading to the formation of 2,3,8-triaryl vinyl fulvenes: an uncommon transformation.
Organic letters, 2013, 15, 6230-6233
1513238 CIFC26 H17 Cl3P -111.5918; 11.6391; 16.613
98.401; 104.892; 91.752
2137.4Sinu, C. R.; Suresh, Eringathodi; Nair, Vijay
N-heterocyclic carbene catalyzed reaction of cinnamils leading to the formation of 2,3,8-triaryl vinyl fulvenes: an uncommon transformation.
Organic letters, 2013, 15, 6230-6233
1513239 CIFC54 H46 B2 SP 1 21 114.544; 26.44; 25.33
90; 93.68; 90
9720Shuto, Ayumi; Kushida, Tomokatsu; Fukushima, Tatsuya; Kaji, Hironori; Yamaguchi, Shigehiro
π-Extended Planarized Triphenylboranes with Thiophene Spacers.
Organic letters, 2013, 15, 6234-6237
1513240 CIFC58 H48 B2 S2P 1 21/c 115.74; 8.443; 16.49
90; 101.67; 90
2146Shuto, Ayumi; Kushida, Tomokatsu; Fukushima, Tatsuya; Kaji, Hironori; Yamaguchi, Shigehiro
π-Extended Planarized Triphenylboranes with Thiophene Spacers.
Organic letters, 2013, 15, 6234-6237

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