Crystallography Open Database

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7152202 CIFC32.33 H42.33 I N2 O2P 6121.382; 21.382; 10.7536
90; 90; 120
4257.8Levy, Jean-Noël; Latham, Christopher M.; Roisin, Loïc; Kandziora, Nadine; Di Fruscia, Paolo; White, Andrew J. P.; Woodward, Simon; Fuchter, Matthew J.
The design and synthesis of novel IBiox N-heterocyclic carbene ligands derived from substituted amino-indanols.
Organic & biomolecular chemistry, 2012, 10, 512-515
7152203 CIFC34 H25 F3 N2 O5 SP 1 21 18.31659; 20.0565; 17.4123
90; 95.0536; 90
2893.11Levy, Jean-Noël; Latham, Christopher M.; Roisin, Loïc; Kandziora, Nadine; Di Fruscia, Paolo; White, Andrew J. P.; Woodward, Simon; Fuchter, Matthew J.
The design and synthesis of novel IBiox N-heterocyclic carbene ligands derived from substituted amino-indanols.
Organic & biomolecular chemistry, 2012, 10, 512-515
7152204 CIFC72 H128.5 N20 O50.25 S8C 1 c 120.657; 18.786; 26.624
90; 97.992; 90
10231Guo, Dong-Sheng; Zhang, Hong-Qing; Ding, Fei; Liu, Yu
Thermodynamic origins of selective binding affinity between p-sulfonatocalix[4,5]arenes with biguanidiniums.
Organic & biomolecular chemistry, 2012, 10, 1527-1536
7152205 CIFC48 H71 N10 O24.5 S4P 1 21/n 115.129; 12.14; 33.206
90; 100.51; 90
5996Guo, Dong-Sheng; Zhang, Hong-Qing; Ding, Fei; Liu, Yu
Thermodynamic origins of selective binding affinity between p-sulfonatocalix[4,5]arenes with biguanidiniums.
Organic & biomolecular chemistry, 2012, 10, 1527-1536
7152206 CIFC45 H81.5 N12.5 O32 S5P 1 21/c 114.299; 20.408; 22.893
90; 107.014; 90
6388.1Guo, Dong-Sheng; Zhang, Hong-Qing; Ding, Fei; Liu, Yu
Thermodynamic origins of selective binding affinity between p-sulfonatocalix[4,5]arenes with biguanidiniums.
Organic & biomolecular chemistry, 2012, 10, 1527-1536
7152207 CIFC37 H39 N3 O6P 15.7098; 9.5517; 14.904
87.425; 89.606; 82.942
805.9Kodama, Koichi; Kanno, Ayaka; Sekine, Eriko; Hirose, Takuji
Enantioseparation of 1-arylethanols via a supramolecular chiral host consisting of N-(2-naphthoyl)-l-aspartic acid and an achiral diamine.
Organic & biomolecular chemistry, 2012, 10, 1877-1882
7152208 CIFC38 H41 N3 O6P 15.66; 9.583; 15.456
94.113; 92.683; 96.361
829.8Kodama, Koichi; Kanno, Ayaka; Sekine, Eriko; Hirose, Takuji
Enantioseparation of 1-arylethanols via a supramolecular chiral host consisting of N-(2-naphthoyl)-l-aspartic acid and an achiral diamine.
Organic & biomolecular chemistry, 2012, 10, 1877-1882
7152209 CIFC10 H11 N O5P 21 21 216.4826; 6.8123; 9.0139
90; 90; 90
1012.12Gharpure, Santosh J.; Vijayasree, U.; Reddy, S. Raja Bhushan
Stereoselective synthesis and applications of nitrogen substituted donor-acceptor cyclopropanes (N-DACs) in the divergent synthesis of azacycles.
Organic & biomolecular chemistry, 2012, 10, 1735-1738
7152210 CIFC29 H29 N O8 S2P 17.9762; 8.4759; 11.3641
83.948; 80.632; 73.019
723.61Gharpure, Santosh J.; Vijayasree, U.; Reddy, S. Raja Bhushan
Stereoselective synthesis and applications of nitrogen substituted donor-acceptor cyclopropanes (N-DACs) in the divergent synthesis of azacycles.
Organic & biomolecular chemistry, 2012, 10, 1735-1738
7152211 CIFC22 H30.25 N4 O4.125 S2P -19.648; 14.822; 16.441
104.68; 103.17; 91.75
2204.8Ruff, Bettina M.; Zhong, Sabilla; Nieger, Martin; Bräse, Stefan
Thiolation of symmetrical and unsymmetrical diketopiperazines.
Organic & biomolecular chemistry, 2012, 10, 935-940
7152212 CIFC18 H26 N2 O2P 21 21 216.43; 11.207; 21.269
90; 90; 90
1532.7Ruff, Bettina M.; Zhong, Sabilla; Nieger, Martin; Bräse, Stefan
Thiolation of symmetrical and unsymmetrical diketopiperazines.
Organic & biomolecular chemistry, 2012, 10, 935-940
7152213 CIFC18 H24 N2 O2 S2P 21 21 216.4416; 10.8045; 24.627
90; 90; 90
1714Ruff, Bettina M.; Zhong, Sabilla; Nieger, Martin; Bräse, Stefan
Thiolation of symmetrical and unsymmetrical diketopiperazines.
Organic & biomolecular chemistry, 2012, 10, 935-940
7152214 CIFC20 H30 N2 O2 S2P 19.1262; 9.6454; 11.5103
91.426; 101.32; 91.777
992.52Ruff, Bettina M.; Zhong, Sabilla; Nieger, Martin; Bräse, Stefan
Thiolation of symmetrical and unsymmetrical diketopiperazines.
Organic & biomolecular chemistry, 2012, 10, 935-940
7152215 CIFC12 H18 N2 O2 S2P 1 21/c 117.1844; 7.3729; 10.8107
90; 105.732; 90
1318.39Ruff, Bettina M.; Zhong, Sabilla; Nieger, Martin; Bräse, Stefan
Thiolation of symmetrical and unsymmetrical diketopiperazines.
Organic & biomolecular chemistry, 2012, 10, 935-940
7152216 CIFC74 H74 Cl6 N6 O12 S6.31P 1 21 111.4283; 17.1077; 19.3984
90; 92.773; 90
3788.18Ruff, Bettina M.; Zhong, Sabilla; Nieger, Martin; Bräse, Stefan
Thiolation of symmetrical and unsymmetrical diketopiperazines.
Organic & biomolecular chemistry, 2012, 10, 935-940
7152217 CIFC11 H18 N2 O3I 4119.2441; 19.2441; 14.2264
90; 90; 90
5268.5Fedoseyenko, Dmytro; Raghuraman, Arjun; Ko, Eunhwa; Burgess, Kevin
Omegatides: constrained analogs of peptide primary sequence.
Organic & biomolecular chemistry, 2012, 10, 921-924
7152218 CIFC17 H28 N2 O3P 15.6765; 10.5601; 15.2326
80.631; 85.199; 75.014
869.46Fedoseyenko, Dmytro; Raghuraman, Arjun; Ko, Eunhwa; Burgess, Kevin
Omegatides: constrained analogs of peptide primary sequence.
Organic & biomolecular chemistry, 2012, 10, 921-924
7152219 CIFC20 H30 Cl3 N3 O4P 1 21 113.1883; 6.5039; 14.5084
90; 100.899; 90
1222.02Fedoseyenko, Dmytro; Raghuraman, Arjun; Ko, Eunhwa; Burgess, Kevin
Omegatides: constrained analogs of peptide primary sequence.
Organic & biomolecular chemistry, 2012, 10, 921-924
7152220 CIFC16 H29 N3 O8P -19.2865; 10.1783; 12.8619
86.696; 80.581; 63.553
1073.65Ji, Cong-Bin; Liu, Yun-Lin; Zhao, Xiao-Li; Guo, Yin-Long; Wang, Hao-Yang; Zhou, Jian
Direct amination of α-substituted nitroacetates using di-tert-butyl azodicarboxylate catalyzed by Hatakeyama's catalyst β-ICD.
Organic & biomolecular chemistry, 2012, 10, 1158-1161
7152221 CIFC49 H56 O3P -19.466; 15.214; 16.716
64.8; 76.56; 74.57
2080.1Yucel, Baris; Sanli, Bahar; Akbulut, Huseyin; Ozbey, Suheyla; Benniston, Andrew C.
Colour-responsive fluorescent oxy radical sensors.
Organic & biomolecular chemistry, 2012, 10, 1775-1784
7152222 CIFC30 H36 N2P -18.1332; 12.8039; 23.181
86.488; 85.393; 84.635
2392.1Curiel, David; Sánchez, Guzmán; Ramírez de Arellano, Carmen; Tárraga, Alberto; Molina, Pedro
Combined study of anion recognition by a carbazole-based neutral tripodal receptor in a competitive environment.
Organic & biomolecular chemistry, 2012, 10, 1896-1904
7152223 CIFC24 H23 N SiP -19.3619; 10.083; 10.655
87.11; 82.02; 88.24
994.5Liang, Yun; Geng, Weizhi; Wei, Junnian; Ouyang, Kunbing; Xi, Zhenfeng
Palladium-catalyzed silyl C(sp(3))-H bond activation.
Organic & biomolecular chemistry, 2012, 10, 1537-1542
7152224 CIFC23 H21 N SiP 1 21/n 113.268; 10.072; 13.822
90; 91.6; 90
1846.4Liang, Yun; Geng, Weizhi; Wei, Junnian; Ouyang, Kunbing; Xi, Zhenfeng
Palladium-catalyzed silyl C(sp(3))-H bond activation.
Organic & biomolecular chemistry, 2012, 10, 1537-1542
7152225 CIFC31 H22 Cl3 N3 O3P 1 21/n 112.4462; 13.975; 16.7998
90; 110.205; 90
2742.27Yin, Xiao-Gang; Liu, Xin-Yun; Hu, Zhi-Peng; Yan, Ming
Efficient synthesis of multicyclic spirooxindoles via a cascade Michael/Michael/oxa-Michael reaction of curcumins and isatylidene malononitriles.
Organic & biomolecular chemistry, 2012, 10, 1506-1509
7152226 CIFC12 H16 N2 O4P -18.418; 8.861; 9.944
64.89; 88.07; 71.11
630.8Bodipati, Naganjaneyulu; Peddinti, Rama Krishna
Chemical generation of o-quinone monoimines for the rapid construction of 1,4-benzoxazine derivatives.
Organic & biomolecular chemistry, 2012, 10, 1958-1961
7152227 CIFC20 H16 B F2 N3P -18.162; 8.55; 12.743
82.561; 81.071; 72.465
834.4Zhang, Min; Hao, Erhong; Zhou, Jinyuan; Yu, Changjiang; Bai, Guifeng; Wang, Fengyun; Jiao, Lijuan
Synthesis of pyrrolyldipyrrinato BF(2) complexes by oxidative nucleophilic substitution of boron dipyrromethene with pyrrole.
Organic & biomolecular chemistry, 2012, 10, 2139-2145
7152228 CIFC22 H20 B F2 N3P 1 21/c 110.0277; 17.2775; 11.1652
90; 94.161; 90
1929.3Zhang, Min; Hao, Erhong; Zhou, Jinyuan; Yu, Changjiang; Bai, Guifeng; Wang, Fengyun; Jiao, Lijuan
Synthesis of pyrrolyldipyrrinato BF(2) complexes by oxidative nucleophilic substitution of boron dipyrromethene with pyrrole.
Organic & biomolecular chemistry, 2012, 10, 2139-2145
7152229 CIFC23 H20 B F2 N3 OP 1 21/c 136.086; 13.768; 7.995
90; 95.653; 90
3953Zhang, Min; Hao, Erhong; Zhou, Jinyuan; Yu, Changjiang; Bai, Guifeng; Wang, Fengyun; Jiao, Lijuan
Synthesis of pyrrolyldipyrrinato BF(2) complexes by oxidative nucleophilic substitution of boron dipyrromethene with pyrrole.
Organic & biomolecular chemistry, 2012, 10, 2139-2145
7152230 CIFC22 H21 N3P -19.481; 12.32; 17.351
70.679; 80.779; 83.598
1884Zhang, Min; Hao, Erhong; Zhou, Jinyuan; Yu, Changjiang; Bai, Guifeng; Wang, Fengyun; Jiao, Lijuan
Synthesis of pyrrolyldipyrrinato BF(2) complexes by oxidative nucleophilic substitution of boron dipyrromethene with pyrrole.
Organic & biomolecular chemistry, 2012, 10, 2139-2145
7152231 CIFC25 H23 N O4P 1 21/n 111.934; 14.466; 12.536
90; 110.006; 90
2033.6Zhang, Xia; Ji, Jingjing; Zhu, Yingguang; Jing, Changcheng; Li, Ming; Hu, Wenhao
A highly diastereoselective three-component tandem 1,4-conjugated addition-cyclization reaction to multisubstituted pyrrolidines.
Organic & biomolecular chemistry, 2012, 10, 2133-2138
7152232 CIFC49 H41 Cl3 F12 P4P 1 21/c 120.4538; 25.3853; 19.2348
90; 90.229; 90
9987.1Das, Priyadip; Kesharwani, Manoj K.; Mandal, Amal K.; Suresh, Eringathodi; Ganguly, Bishwajit; Das, Amitava
An alternative approach: a highly selective dual responding fluoride sensor having active methylene group as binding site().
Organic & biomolecular chemistry, 2012, 10, 2263-2271
7152233 CIFC65.07 H48.13 Cl0.14 O5P -110.0392; 15.7261; 16.0211
81.667; 82.511; 79.608
2447.5Hu, Jian-Yong; Ni, Xin-Long; Feng, Xing; Era, Masanao; Elsegood, Mark R. J.; Teat, Simon J.; Yamato, Takehiko
Highly emissive hand-shaped π-conjugated alkynylpyrenes: Synthesis, structures, and photophysical properties.
Organic & biomolecular chemistry, 2012, 10, 2255-2262
7152234 CIFC66 H100 Ag2 F12 O16 P2P b c n14.6967; 21.036; 23.8819
90; 90; 90
7383.3Helttunen, Kaisa; Moridi, Negar; Shahgaldian, Patrick; Nissinen, Maija
Resorcinarene bis-crown silver complexes and their application as antibacterial Langmuir-Blodgett films.
Organic & biomolecular chemistry, 2012, 10, 2019-2025
7152235 CIFC98 H148 Ag D12 F6 O16 PP 1 21/n 112.2817; 60.688; 13.4217
90; 97.516; 90
9917.9Helttunen, Kaisa; Moridi, Negar; Shahgaldian, Patrick; Nissinen, Maija
Resorcinarene bis-crown silver complexes and their application as antibacterial Langmuir-Blodgett films.
Organic & biomolecular chemistry, 2012, 10, 2019-2025
7152236 CIFC62 H90 Cl4 N8 O6P -18.8875; 13.7511; 15.0665
64.753; 77.356; 74.412
1592.6Ahmed, Nisar; Suresh, Vangaru; Shirinfar, Bahareh; Geronimo, Inacrist; Bist, Amita; Hwang, In-Chul; Kim, Kwang S.
Fluorogenic sensing of CH(3)CO(2)(-) and H(2)PO(4)(-) by ditopic receptor through conformational change.
Organic & biomolecular chemistry, 2012, 10, 2094-2100
7152237 CIFC58 H86 Cl6 N8 O2P -113.644; 15.163; 16.546
84.368; 78.777; 72.6
3201.1Ahmed, Nisar; Suresh, Vangaru; Shirinfar, Bahareh; Geronimo, Inacrist; Bist, Amita; Hwang, In-Chul; Kim, Kwang S.
Fluorogenic sensing of CH(3)CO(2)(-) and H(2)PO(4)(-) by ditopic receptor through conformational change.
Organic & biomolecular chemistry, 2012, 10, 2094-2100
7152238 CIFC21 H12R 3 c :H16.5754; 16.5754; 7.5796
90; 90; 120
1803.45Mebs, Stefan; Weber, Manuela; Luger, Peter; Schmidt, Bernd M.; Sakurai, Hidehiro; Higashibayashi, Shuhei; Onogi, Satoru; Lentz, Dieter
Experimental electron density of sumanene, a bowl-shaped fullerene fragment; comparison with the related corannulene hydrocarbon.
Organic & biomolecular chemistry, 2012, 10, 2218-2222
7152239 CIFC24 H30 N2P -18.4011; 10.0557; 13.0329
74.541; 78.907; 76.897
1023.28Trinchera, Piera; Musio, Biagia; Degennaro, Leonardo; Moliterni, Anna; Falcicchio, Aurelia; Luisi, Renzo
One-pot preparation of piperazines by regioselective ring-opening of non-activated arylaziridines.
Organic & biomolecular chemistry, 2012, 10, 1962-1965
7152240 CIFC18 H20 Cl2 N2P 1 21/c 19.783; 13.775; 12.7176
90; 90.574; 90
1713.7Trinchera, Piera; Musio, Biagia; Degennaro, Leonardo; Moliterni, Anna; Falcicchio, Aurelia; Luisi, Renzo
One-pot preparation of piperazines by regioselective ring-opening of non-activated arylaziridines.
Organic & biomolecular chemistry, 2012, 10, 1962-1965
7152241 CIFC9 H11 NP 1 21/n 15.804; 21.72; 6.563
90; 113.508; 90
758.7Trinchera, Piera; Musio, Biagia; Degennaro, Leonardo; Moliterni, Anna; Falcicchio, Aurelia; Luisi, Renzo
One-pot preparation of piperazines by regioselective ring-opening of non-activated arylaziridines.
Organic & biomolecular chemistry, 2012, 10, 1962-1965
7152242 CIFC26 H33 Br O SiP -17.0214; 12.5519; 14.2927
93.591; 92.24; 103.988
1217.98Li, Yan; Wheeler, Kraig A.; Dembinski, Roman
Room temperature syntheses of entirely diverse substituted β-fluorofurans.
Organic & biomolecular chemistry, 2012, 10, 2395-2408
7152243 CIFC17 H12 Br F OC 1 2/c 133.7073; 5.632; 14.5599
90; 97.857; 90
2738.1Li, Yan; Wheeler, Kraig A.; Dembinski, Roman
Room temperature syntheses of entirely diverse substituted β-fluorofurans.
Organic & biomolecular chemistry, 2012, 10, 2395-2408
7152244 CIFC25 H17 F OP 1 21/c 113.0824; 5.1563; 26.5341
90; 93.297; 90
1786.94Li, Yan; Wheeler, Kraig A.; Dembinski, Roman
Room temperature syntheses of entirely diverse substituted β-fluorofurans.
Organic & biomolecular chemistry, 2012, 10, 2395-2408
7152245 CIFC47 H64 Cl6 N4 O12P 1 21 110.9716; 18.7546; 13.2194
90; 101.595; 90
2664.62Pyta, Krystian; Przybylski, Piotr; Wicher, Barbara; Gdaniec, Maria; Stefańska, Joanna
Intramolecular proton transfer impact on antibacterial properties of ansamycin antibiotic rifampicin and its new amino analogues.
Organic & biomolecular chemistry, 2012, 10, 2385-2388
7152246 CIFC45 H72 N4 O17P 21 21 2113.8494; 17.4243; 20.0324
90; 90; 90
4834.1Pyta, Krystian; Przybylski, Piotr; Wicher, Barbara; Gdaniec, Maria; Stefańska, Joanna
Intramolecular proton transfer impact on antibacterial properties of ansamycin antibiotic rifampicin and its new amino analogues.
Organic & biomolecular chemistry, 2012, 10, 2385-2388
7152247 CIFC45 H68 Cl2 N2 O15P 1 21 19.2035; 20.0206; 13.8049
90; 103.152; 90
2476.96Pyta, Krystian; Przybylski, Piotr; Wicher, Barbara; Gdaniec, Maria; Stefańska, Joanna
Intramolecular proton transfer impact on antibacterial properties of ansamycin antibiotic rifampicin and its new amino analogues.
Organic & biomolecular chemistry, 2012, 10, 2385-2388
7152248 CIFC76 H34 Br8 F4 N4P 1 c 110.0612; 18.1279; 17.8048
90; 98.285; 90
3213.5Jiang, Xiu-Zhao; Cai, Chen-Xin; Liu, Jin-Tao; Uno, Hidemitsu
Novel syntheses and properties of meso-tetraaryl-octabromo-tetranaphtho[2,3]porphyrins (Ar(4)Br(8)TNPs).
Organic & biomolecular chemistry, 2012, 10, 3110-3115
7152249 CIFC30 H47 O5.5P 65 2 210.913; 10.913; 81.73
90; 90; 120
8429Fabris, Fabrizio; De Lucchi, Ottorino; Nardini, Ilaria; Crisma, Marco; Mazzanti, Andrea; Mason, Sax A.; Lemée-Cailleau, Marie-Hélène; Scaramuzzo, Francesca A.; Zonta, Cristiano
(+)-syn-Benzotriborneol an enantiopure C(3)-symmetric receptor for water.
Organic & biomolecular chemistry, 2012, 10, 2464-2469
7152250 CIFC30 H47 O5.5P 65 2 210.8602; 10.8602; 81.052
90; 90; 120
8278.9Fabris, Fabrizio; De Lucchi, Ottorino; Nardini, Ilaria; Crisma, Marco; Mazzanti, Andrea; Mason, Sax A.; Lemée-Cailleau, Marie-Hélène; Scaramuzzo, Francesca A.; Zonta, Cristiano
(+)-syn-Benzotriborneol an enantiopure C(3)-symmetric receptor for water.
Organic & biomolecular chemistry, 2012, 10, 2464-2469
7152251 CIFC50 H90 N8 O11.5P 1 21 110.516; 27.593; 21.05
90; 97.919; 90
6050Chandrappa, Siddappa; Aravinda, Subrayashastry; Raghothama, Srinivasarao; Sonti, Rajesh; Rai, Rajkishor; Harini, Veldore V.; Shamala, Narayanaswamy; Balaram, Padmanabhan
Helix and hairpin nucleation in short peptides using centrally positioned conformationally constrained dipeptide segments.
Organic & biomolecular chemistry, 2012, 10, 2815-2823

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