Crystallography Open Database

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1515898 CIFC24 H20 Br2 O2P 1 21/n 112.0856; 7.4117; 23.495
90; 90.629; 90
2104.4Huang, Changfeng; Huang, Yiwei; Akhmedov, Novruz G.; Popp, Brian V.; Petersen, Jeffrey L.; Wang, Kung K.
Functionalized Carbon Nanohoops: Synthesis and Structure of a [9]Cycloparaphenylene Bearing Three 5,8-Dimethoxynaphth-1,4-diyl Units.
Organic letters, 2014, 16, 2672-2675
1515899 CIFC51 H47 O4P 1 21/n 115.9298; 30.8837; 23.5589
90; 90.976; 90
11588.6Huang, Changfeng; Huang, Yiwei; Akhmedov, Novruz G.; Popp, Brian V.; Petersen, Jeffrey L.; Wang, Kung K.
Functionalized Carbon Nanohoops: Synthesis and Structure of a [9]Cycloparaphenylene Bearing Three 5,8-Dimethoxynaphth-1,4-diyl Units.
Organic letters, 2014, 16, 2672-2675
1515900 CIFC22 H16 Br2 O2P 1 21/c 112.845; 6.7365; 22.24
90; 101.173; 90
1888Huang, Changfeng; Huang, Yiwei; Akhmedov, Novruz G.; Popp, Brian V.; Petersen, Jeffrey L.; Wang, Kung K.
Functionalized Carbon Nanohoops: Synthesis and Structure of a [9]Cycloparaphenylene Bearing Three 5,8-Dimethoxynaphth-1,4-diyl Units.
Organic letters, 2014, 16, 2672-2675
1515901 CIFC14 H22 OP 21 21 215.8497; 8.507; 24.476
90; 90; 90
1218Terada, Takuma; Kurahashi, Takuya; Matsubara, Seijiro
Diastereoselective Construction of Trans-Fused Octalone Framework via Ruthenium-Porphyrin-Catalyzed Cycloaddition.
Organic letters, 2014, 16, 2594-2597
1515902 CIFC16 H17 Cl OP -15.4255; 9.6517; 12.7498
91.736; 93.937; 94.455
663.63Terada, Takuma; Kurahashi, Takuya; Matsubara, Seijiro
Diastereoselective Construction of Trans-Fused Octalone Framework via Ruthenium-Porphyrin-Catalyzed Cycloaddition.
Organic letters, 2014, 16, 2594-2597
1515903 CIFC12 H18 OP 1 21/c 119.218; 5.8015; 9.748
90; 101.087; 90
1066.6Terada, Takuma; Kurahashi, Takuya; Matsubara, Seijiro
Diastereoselective Construction of Trans-Fused Octalone Framework via Ruthenium-Porphyrin-Catalyzed Cycloaddition.
Organic letters, 2014, 16, 2594-2597
1515942 CIFC20.5 H21 Cl N2 O2P 1 21/c 111.233; 22.492; 7.1548
90; 99.452; 90
1783.1Min, Chang; Sanchawala, Abbas; Seidel, Daniel
Dual C-H Functionalization of N-Aryl Amines: Synthesis of Polycyclic Amines via an Oxidative Povarov Approach.
Organic letters, 2014, 16, 2756-2759
1515947 CIFC28 H37 N O5 SiP 21 21 215.368; 55.574; 6.2795
90; 90; 90
5363.1Trost, Barry M.; Ehmke, Veronika
An approach for rapid increase in molecular complexity: atom economic routes to fused polycyclic ring systems.
Organic letters, 2014, 16, 2708-2711
1515976 CIFC21 H32 O4P 1 21 16.0539; 11.5542; 13.5149
90; 102.108; 90
924.31Kumar, Chebolu Naga Sesha Sai Pavan; Chein, Rong-Jie
Synthesis of labdane diterpenes galanal a and B from (+)-sclareolide.
Organic letters, 2014, 16, 2990-2992
1515977 CIFC18 H23 N O5P 21 21 218.9976; 10.8156; 16.5526
90; 90; 90
1610.81Jhuo, Dai-Huei; Hong, Bor-Cherng; Chang, Chun-Wei; Lee, Gene-Hsiang
One-pot organocatalytic enantioselective Michael-Michael-aldol-Henry reaction cascade. A facile entry to the steroid system with six contiguous stereogenic centers.
Organic letters, 2014, 16, 2724-2727
1515978 CIFC18 H22 Br N O5P 21 21 218.9352; 29.3697; 6.2956
90; 90; 90
3501.1Jhuo, Dai-Huei; Hong, Bor-Cherng; Chang, Chun-Wei; Lee, Gene-Hsiang
One-pot organocatalytic enantioselective Michael-Michael-aldol-Henry reaction cascade. A facile entry to the steroid system with six contiguous stereogenic centers.
Organic letters, 2014, 16, 2724-2727
1515979 CIFC14 H19 N O4P 21 21 217.3853; 10.1226; 17.8638
90; 90; 90
1335.47Jhuo, Dai-Huei; Hong, Bor-Cherng; Chang, Chun-Wei; Lee, Gene-Hsiang
One-pot organocatalytic enantioselective Michael-Michael-aldol-Henry reaction cascade. A facile entry to the steroid system with six contiguous stereogenic centers.
Organic letters, 2014, 16, 2724-2727
1515980 CIFC36 H44 N4 O4P c a 2125.739; 9.667; 12.857
90; 90; 90
3199Dethe, Dattatraya H.; Erande, Rohan D.; Dherange, Balu D.
Remarkable switch of regioselectivity in diels-alder reaction: divergent total synthesis of borreverine, caulindoles, and flinderoles.
Organic letters, 2014, 16, 2764-2767
1515981 CIFC44 H42 N2 O8 S2P -112.114; 12.234; 14.573
107.079; 98.454; 105.459
1929.4Dethe, Dattatraya H.; Erande, Rohan D.; Dherange, Balu D.
Remarkable switch of regioselectivity in diels-alder reaction: divergent total synthesis of borreverine, caulindoles, and flinderoles.
Organic letters, 2014, 16, 2764-2767
1515982 CIFC44 H45 N3 O6 S2P 1 21/c 113.658; 11.024; 26.112
90; 100.241; 90
3869Dethe, Dattatraya H.; Erande, Rohan D.; Dherange, Balu D.
Remarkable switch of regioselectivity in diels-alder reaction: divergent total synthesis of borreverine, caulindoles, and flinderoles.
Organic letters, 2014, 16, 2764-2767
1515983 CIFC36 H44 N4 O4P b c a12.802; 19.593; 25.555
90; 90; 90
6410Dethe, Dattatraya H.; Erande, Rohan D.; Dherange, Balu D.
Remarkable switch of regioselectivity in diels-alder reaction: divergent total synthesis of borreverine, caulindoles, and flinderoles.
Organic letters, 2014, 16, 2764-2767
1515984 CIFC40 H46 N2 O8 S2P b c a29.124; 8.811; 29.171
90; 90; 90
7486Dethe, Dattatraya H.; Erande, Rohan D.; Dherange, Balu D.
Remarkable switch of regioselectivity in diels-alder reaction: divergent total synthesis of borreverine, caulindoles, and flinderoles.
Organic letters, 2014, 16, 2764-2767
1515985 CIFC43 H40 N2 O8 S2P 1 21/c 113.109; 14.562; 19.787
90; 98.818; 90
3733Dethe, Dattatraya H.; Erande, Rohan D.; Dherange, Balu D.
Remarkable switch of regioselectivity in diels-alder reaction: divergent total synthesis of borreverine, caulindoles, and flinderoles.
Organic letters, 2014, 16, 2764-2767
1515986 CIFC48 H52 N4 O8 S2P 1 21/c 19.393; 29.532; 15.825
90; 99.223; 90
4333Dethe, Dattatraya H.; Erande, Rohan D.; Dherange, Balu D.
Remarkable switch of regioselectivity in diels-alder reaction: divergent total synthesis of borreverine, caulindoles, and flinderoles.
Organic letters, 2014, 16, 2764-2767
1515987 CIFC44 H49 N2 O7 S2P -110.515; 13.39; 15.724
84.427; 72.768; 67.283
1950.1Dethe, Dattatraya H.; Erande, Rohan D.; Dherange, Balu D.
Remarkable switch of regioselectivity in diels-alder reaction: divergent total synthesis of borreverine, caulindoles, and flinderoles.
Organic letters, 2014, 16, 2764-2767
1515988 CIFC36 H36 N4 O4P b c a10.915; 10.002; 27.209
90; 90; 90
2970.5Culf, Adrian S.; Cuperlović-Culf, Miroslava; Léger, Daniel A; Decken, Andreas
Small Head-to-Tail Macrocyclic α-Peptoids.
Organic letters, 2014, 16, 2780-2783
1515989 CIFC36 H36 N4 O4P 1 21/c 117.232; 5.508; 17.915
90; 114.836; 90
1543.1Culf, Adrian S.; Cuperlović-Culf, Miroslava; Léger, Daniel A; Decken, Andreas
Small Head-to-Tail Macrocyclic α-Peptoids.
Organic letters, 2014, 16, 2780-2783
1515990 CIFC27 H27 N3 O3P c a 2117.384; 9.096; 28.177
90; 90; 90
4455Culf, Adrian S.; Cuperlović-Culf, Miroslava; Léger, Daniel A; Decken, Andreas
Small Head-to-Tail Macrocyclic α-Peptoids.
Organic letters, 2014, 16, 2780-2783
1515991 CIFC45.5 H45.5 Cl1.5 N5 O5C 1 2/c 124.448; 13.284; 27.047
90; 102.463; 90
8577Culf, Adrian S.; Cuperlović-Culf, Miroslava; Léger, Daniel A; Decken, Andreas
Small Head-to-Tail Macrocyclic α-Peptoids.
Organic letters, 2014, 16, 2780-2783
1515992 CIFC46 H52 N4 O18P 6419.5118; 19.5118; 12.0531
90; 90; 120
3973.97Zhang, Juanli; Qian, Zhengyi; Wu, Xingkang; Ding, Yanjiao; Li, Jianfang; Lu, Chunhua; Shen, Yuemao
Juanlimycins A and B, Ansamycin Macrodilactams from Streptomyces sp.
Organic letters, 2014, 16, 2752-2755
1515994 CIFC17 H16 N2 O3 S2P 1 21/n 110.7362; 14.1883; 12.3716
90; 108.855; 90
1783.42Li, Yiming; Pu, Jiahua; Jiang, Xuefeng
A highly efficient cu-catalyzed s-transfer reaction: from amine to sulfide.
Organic letters, 2014, 16, 2692-2695
1516025 CIFC63 H54 B2 Cl3 F4 N6P -112.421; 14.0537; 17.9628
66.48; 79.82; 80.77
2815.8Yokoi, Hiroki; Hiroto, Satoru; Shinokubo, Hiroshi
Synthesis of Diazo-Bridged BODIPY Dimer and Tetramer by Oxidative Coupling of β-Amino-Substituted BODIPYs.
Organic letters, 2014, 16, 3004-3007
1516043 CIFC53 H64.5 F12 N5.5 O10 P2P -110.9871; 15.0321; 19.4495
67.41; 87.04; 85.923
2957.3Xing, Hao; Wei, Peifa; Yan, Xuzhou
Supramolecular Side-Chain Poly[2]pseudorotaxanes Formed by Orthogonal Coordination-Driven Self-Assembly and Crown-Ether-Based Host-Guest Interactions.
Organic letters, 2014, 16, 2850-2853
1516044 CIFC117 H122 N4 O2 ZnP -114.274; 16.988; 21.032
67.91; 80.65; 86.6
4662.8Ota, Kensuke; Tanaka, Takayuki; Osuka, Atsuhiro
meso-β Dibenzo[a,g]corannulene-Fused Porphyrins.
Organic letters, 2014, 16, 2974-2977
1516045 CIFC96.89 H88.31 N4 O1.72 ZnP -19.353; 21.838; 38.554
103.231; 90.09; 102.288
7480Ota, Kensuke; Tanaka, Takayuki; Osuka, Atsuhiro
meso-β Dibenzo[a,g]corannulene-Fused Porphyrins.
Organic letters, 2014, 16, 2974-2977
1516046 CIFC96 H98 N4 O2 ZnP -19.7687; 15.6035; 26.497
75.421; 83.382; 87.1181
3881.8Ota, Kensuke; Tanaka, Takayuki; Osuka, Atsuhiro
meso-β Dibenzo[a,g]corannulene-Fused Porphyrins.
Organic letters, 2014, 16, 2974-2977
1516047 CIFC23 H18 O2P -19.661; 9.9907; 10.7602
63.28; 80.45; 70.81
875.9Chagarovsky, Alexey O.; Budynina, Ekaterina M.; Ivanova, Olga A.; Villemson, Elena V.; Rybakov, Victor B.; Trushkov, Igor V.; Melnikov, Mikhail Ya
Reaction of Corey Ylide with α,β-Unsaturated Ketones: Tuning of Chemoselectivity toward Dihydrofuran Synthesis.
Organic letters, 2014, 16, 2830-2833
1516048 CIFC23 H23 N O3P 1 21/c 110.0605; 10.1253; 19.2983
90; 91.597; 90
1965.1Chagarovsky, Alexey O.; Budynina, Ekaterina M.; Ivanova, Olga A.; Villemson, Elena V.; Rybakov, Victor B.; Trushkov, Igor V.; Melnikov, Mikhail Ya
Reaction of Corey Ylide with α,β-Unsaturated Ketones: Tuning of Chemoselectivity toward Dihydrofuran Synthesis.
Organic letters, 2014, 16, 2830-2833
1516049 CIFC21 H23 F N2 OP 1 21/c 19.073; 11.096; 19.557
90; 94.205; 90
1963.6Thirupathi, Nuligonda; Hari Babu, Madala; Dwivedi, Vikas; Kant, Ruchir; Sridhar Reddy, Maddi
Palladium-Catalyzed Tandem Intramolecular Oxy/Amino-Palladation/Isocyanide Insertion: Synthesis of α-Benzofuranyl/Indolylacetamides.
Organic letters, 2014, 16, 2908-2911
1516050 CIFC26 H36 N2 O2P 21 21 2110.5434; 11.509; 19.6411
90; 90; 90
2383.3Seo, Min-Seob; Lee, Ansoo; Kim, Hyunwoo
2,2'-dihydroxybenzil: a stereodynamic probe for primary amines controlled by steric strain.
Organic letters, 2014, 16, 2950-2953
1516106 CIFC13 H15 N OC 1 2/c 114.0539; 11.358; 13.4342
90; 101.523; 90
2101.2Li, Xiao-Jing; Qiao, Jin-Bao; Sun, Jian; Li, Xue-Qiang; Gu, Peiming
Intramolecular Schmidt Reaction of Acyl Chlorides with Alkyl Azides: Capture of N-Acyliminium Ion Intermediates with Aromatic rings.
Organic letters, 2014, 16, 2865-2867
1516113 CIFC11 H12 F N O2P 1 21/n 111.272; 5.8049; 16.158
90; 108.477; 90
1002.8Lu, Deng-Fu; Liu, Guan-Sai; Zhu, Cheng-Liang; Yuan, Bo; Xu, Hao
Iron(II)-Catalyzed Intramolecular Olefin Aminofluorination.
Organic letters, 2014, 16, 2912-2915
1516114 CIFC72 H23 N O8P -110.128; 10.497; 20.664
85.27; 77.477; 78.869
2102.4Hashikawa, Yoshifumi; Murata, Michihisa; Wakamiya, Atsushi; Murata, Yasujiro
Synthesis of open-cage ketolactam derivatives of fullerene c60 encapsulating a hydrogen molecule.
Organic letters, 2014, 16, 2970-2973
1516121 CIFC15 H11 N O3P -15.502; 21.052; 21.138
88.513; 82.982; 85.62
2423Wu, Xia; Gao, Qinghe; Liu, Shan; Wu, Anxin
I2-Catalyzed Oxidative Cross-Coupling of Methyl Ketones and Benzamidines Hydrochloride: A Facile Access to α-Ketoimides.
Organic letters, 2014, 16, 2888-2891
1516122 CIFC58 H36 O4P -112.469; 14.085; 14.436
114.938; 101.497; 98.755
2171.7Wackerly, Jay Wm; Zhang, Mengfei; Nodder, Stephen T.; Carlin, Stephen M.; Katz, Jeffrey L.
Single Step Synthesis of Acetylene-Substituted Oxacalix[4]arenes.
Organic letters, 2014, 16, 2920-2922
1516129 CIFC37 H34 N2 O6 S2P 1 21/c 117.511; 10.814; 23.711
90; 130.536; 90
3412.4Nayak, Sanatan; Ghosh, Nayan; Sahoo, Akhila K.
Access to Cyclobutene-Fused Azepines through Au-Catalyzed Cycloisomerization of Stable Alkyne Tethered Ketene N,N-Acetals.
Organic letters, 2014, 16, 2996-2999
1516130 CIFC39 H32 N4 O6 S2A b a 215.0516; 28.646; 18.0316
90; 90; 90
7774.7Nayak, Sanatan; Ghosh, Nayan; Sahoo, Akhila K.
Access to Cyclobutene-Fused Azepines through Au-Catalyzed Cycloisomerization of Stable Alkyne Tethered Ketene N,N-Acetals.
Organic letters, 2014, 16, 2996-2999
1516131 CIFC39 H38 N2 O8 S2P -18.7849; 12.6893; 16.278
85.618; 79.626; 82.116
1765.6Nayak, Sanatan; Ghosh, Nayan; Sahoo, Akhila K.
Access to Cyclobutene-Fused Azepines through Au-Catalyzed Cycloisomerization of Stable Alkyne Tethered Ketene N,N-Acetals.
Organic letters, 2014, 16, 2996-2999
1516132 CIFC19 H14 Br N2 O0.5 SC 1 2/c 111.406; 14.522; 20.97
90; 104.457; 90
3363.4Ravi, Chitrakar; Chandra Mohan, Darapaneni; Adimurthy, Subbarayappa
N-chlorosuccinimide-promoted regioselective sulfenylation of imidazoheterocycles at room temperature.
Organic letters, 2014, 16, 2978-2981
1516133 CIFC20 H4 Br4 Cl4P c a 217.4442; 27.2175; 19.194
90; 90; 90
3888.9Zagranyarski, Yulian; Chen, Long; Jänsch, Daniel; Gessner, Thomas; Li, Chen; Müllen, Klaus
Toward perylene dyes by the hundsdiecker reaction.
Organic letters, 2014, 16, 2814-2817
1516134 CIFC19 H27 N O2 S SiP 1 21 19.154; 16.606; 13.184
90; 91.919; 90
2003Mita, Tsuyoshi; Sugawara, Masumi; Saito, Keisuke; Sato, Yoshihiro
Catalytic Enantioselective Silylation of N-Sulfonylimines: Asymmetric Synthesis of α-Amino Acids from CO2 via Stereospecific Carboxylation of α-Amino Silanes.
Organic letters, 2014, 16, 3028-3031
1516135 CIFC14 H25 N O2 S SnP 1 21 111.1188; 10.5531; 15.6491
90; 110.738; 90
1717.26Mita, Tsuyoshi; Sugawara, Masumi; Saito, Keisuke; Sato, Yoshihiro
Catalytic Enantioselective Silylation of N-Sulfonylimines: Asymmetric Synthesis of α-Amino Acids from CO2 via Stereospecific Carboxylation of α-Amino Silanes.
Organic letters, 2014, 16, 3028-3031
1516147 CIFC7 H9 Br O2P 3217.8119; 17.8119; 6.2589
90; 90; 120
1719.7Zipfel, Hannes F.; Carreira, Erick M.
An efficient synthesis strategy to the core structure of 6-5-6-5-6-membered epipolythiodiketopiperazines.
Organic letters, 2014, 16, 2854-2857
1516148 CIFC21 H24 N2 O4 SP 1 21 111.639; 5.5765; 15.5447
90; 106.278; 90
968.48Zipfel, Hannes F.; Carreira, Erick M.
An efficient synthesis strategy to the core structure of 6-5-6-5-6-membered epipolythiodiketopiperazines.
Organic letters, 2014, 16, 2854-2857
1516149 CIFC32.5 H31 Cl N2 O6C 1 2 143.265; 15.0547; 10.2366
90; 93.976; 90
6651.5Zipfel, Hannes F.; Carreira, Erick M.
An efficient synthesis strategy to the core structure of 6-5-6-5-6-membered epipolythiodiketopiperazines.
Organic letters, 2014, 16, 2854-2857

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