Crystallography Open Database

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7152302 CIFC10 H17 N O6P 21 21 218.4697; 10.1103; 13.868
90; 90; 90
1187.53Angelov, Plamen; Chau, Yui Kwan Sonia; Fryer, Paul J.; Moloney, Mark G.; Thompson, Amber L.; Trippier, Paul C.
Biomimetic synthesis, antibacterial activity and structure-activity properties of the pyroglutamate core of oxazolomycin.
Organic & biomolecular chemistry, 2012, 10, 3472-3485
7152303 CIFC18 H23 N O7P 1 21 19.7787; 10.1274; 9.7756
90; 108.505; 90
918.05Angelov, Plamen; Chau, Yui Kwan Sonia; Fryer, Paul J.; Moloney, Mark G.; Thompson, Amber L.; Trippier, Paul C.
Biomimetic synthesis, antibacterial activity and structure-activity properties of the pyroglutamate core of oxazolomycin.
Organic & biomolecular chemistry, 2012, 10, 3472-3485
7152304 CIFC8 H10 O4P b c a7.0008; 9.0561; 24.0388
90; 90; 90
1524.06Naud, Sébastien; Macnaughton, Sarah J.; Dyson, Bryony S.; Woollaston, Daniel J.; Dallimore, Jonathan W. P.; Robertson, Jeremy
Conformational preferences of oxy-substituents in butenolide-tetrahydropyran spiroacetals and butenolide-piperidine spiro-N,O-acetals.
Organic & biomolecular chemistry, 2012, 10, 3506-3518
7152305 CIFC8 H10 O4P 1 21/n 17.5; 6.0089; 17.9334
90; 94.8761; 90
805.28Naud, Sébastien; Macnaughton, Sarah J.; Dyson, Bryony S.; Woollaston, Daniel J.; Dallimore, Jonathan W. P.; Robertson, Jeremy
Conformational preferences of oxy-substituents in butenolide-tetrahydropyran spiroacetals and butenolide-piperidine spiro-N,O-acetals.
Organic & biomolecular chemistry, 2012, 10, 3506-3518
7152306 CIFC34 H40 N2P 1 21/c 110.7984; 14.414; 18.7238
90; 104.773; 90
2817.98Mitkina, Tatiana; Stanglmair, Christoph; Setzer, Wolfgang; Gruber, Michael; Kisch, Horst; König, Burkhard
Visible light mediated homo- and heterocoupling of benzyl alcohols and benzyl amines on polycrystalline cadmium sulfide.
Organic & biomolecular chemistry, 2012, 10, 3556-3561
7152307 CIFC30 H24 O5P 1 21/c 18.3183; 25.3594; 10.8216
90; 90.076; 90
2282.78Zhu, Shugao; Wu, Luling; Huang, Xian
Palladium(0)-catalyzed cyclization of 1,6-diyn-3-yl carbonates with a nucleophilic functionality: efficient synthesis of polycyclic benzo[b]fluorene derivatives via allene intermediates.
Organic & biomolecular chemistry, 2012, 10, 3696-3704
7152308 CIFC26 H22 N2 O6C 1 2/c 115.678; 9.3043; 30.2382
90; 104.663; 90
4267.3Wu, Dong-Dong; He, Ming-Tao; Liu, Qi-Di; Wang, Wei; Zhou, Jie; Wang, Lei; Fun, Hoong-Kun; Xu, Jian-Hua; Zhang, Yan
Photoinduced reactions of bicycloalkylidenes with isatin and isoquinolinetrione.
Organic & biomolecular chemistry, 2012, 10, 3626-3635
7152309 CIFC15 H15 N O3P 1 21 15.1915; 12.1482; 20.353
90; 91.797; 90
1282.98Wu, Dong-Dong; He, Ming-Tao; Liu, Qi-Di; Wang, Wei; Zhou, Jie; Wang, Lei; Fun, Hoong-Kun; Xu, Jian-Hua; Zhang, Yan
Photoinduced reactions of bicycloalkylidenes with isatin and isoquinolinetrione.
Organic & biomolecular chemistry, 2012, 10, 3626-3635
7152310 CIFC16 H15 N O4P 1 21/c 19.2089; 15.1611; 12.0162
90; 124.926; 90
1375.51Wu, Dong-Dong; He, Ming-Tao; Liu, Qi-Di; Wang, Wei; Zhou, Jie; Wang, Lei; Fun, Hoong-Kun; Xu, Jian-Hua; Zhang, Yan
Photoinduced reactions of bicycloalkylidenes with isatin and isoquinolinetrione.
Organic & biomolecular chemistry, 2012, 10, 3626-3635
7152311 CIFC22 H27 N O4P 1 21/c 113.2402; 8.7479; 19.2827
90; 123.821; 90
1855.46Wu, Dong-Dong; He, Ming-Tao; Liu, Qi-Di; Wang, Wei; Zhou, Jie; Wang, Lei; Fun, Hoong-Kun; Xu, Jian-Hua; Zhang, Yan
Photoinduced reactions of bicycloalkylidenes with isatin and isoquinolinetrione.
Organic & biomolecular chemistry, 2012, 10, 3626-3635
7152312 CIFC22 H27 N O3P -19.0404; 9.9839; 10.8814
90.88; 103.859; 111.082
884.12Wu, Dong-Dong; He, Ming-Tao; Liu, Qi-Di; Wang, Wei; Zhou, Jie; Wang, Lei; Fun, Hoong-Kun; Xu, Jian-Hua; Zhang, Yan
Photoinduced reactions of bicycloalkylidenes with isatin and isoquinolinetrione.
Organic & biomolecular chemistry, 2012, 10, 3626-3635
7152313 CIFC27 H37 O4 PP n a 2115.562; 10.686; 15.625
90; 90; 90
2598.4Coetzee, Jacorien; Eastham, Graham R.; Slawin, Alexandra M. Z.; Cole-Hamilton, David J
Phosphorus containing mixed anhydrides-their preparation, labile behaviour and potential routes to their stabilisation.
Organic & biomolecular chemistry, 2012, 10, 3677-3688
7152314 CIFC32 H39 O4 PP 1 21/n 110.82; 16.178; 15.982
90; 98.366; 90
2768Coetzee, Jacorien; Eastham, Graham R.; Slawin, Alexandra M. Z.; Cole-Hamilton, David J
Phosphorus containing mixed anhydrides-their preparation, labile behaviour and potential routes to their stabilisation.
Organic & biomolecular chemistry, 2012, 10, 3677-3688
7152315 CIFC36 H47 O4 PP -110.232; 12.846; 13.644
78.15; 68.93; 86.69
1637.6Coetzee, Jacorien; Eastham, Graham R.; Slawin, Alexandra M. Z.; Cole-Hamilton, David J
Phosphorus containing mixed anhydrides-their preparation, labile behaviour and potential routes to their stabilisation.
Organic & biomolecular chemistry, 2012, 10, 3677-3688
7152316 CIFC25 H21 I O SeP 1 21/n 116.1185; 5.7251; 24.3065
90; 106.365; 90
2152.13Xu, Jianfeng; Zhu, Shugao; Wu, Luling; Huang, Xian
Chemoselective synthesis of highly substituted 1,2-allenyl ketones, furans, and 2-alkynyl ketones from reaction of lithium selenolates with 1-(1-alkynyl)cyclopropyl ketones and electrophiles.
Organic & biomolecular chemistry, 2012, 10, 3705-3714
7152317 CIFC24 H25 N S2P -18.7411; 10.8404; 11.3321
94.6197; 106.901; 91.5749
1022.62Balaji, Ganapathy; Della Pelle, Andrea M.; Popere, Bhooshan C.; Chandrasekaran, A.; Thayumanavan, S.
Synthesis and properties of thienopyrrole based heteroacenes - indolodibenzothienopyrrole and dicarbazolodithienopyrrole.
Organic & biomolecular chemistry, 2012, 10, 3455-3462
7152318 CIFC44 H47 N3 O4 S2P -110.9704; 12.7453; 15.4994
108.851; 97.4139; 100.602
1974.07Balaji, Ganapathy; Della Pelle, Andrea M.; Popere, Bhooshan C.; Chandrasekaran, A.; Thayumanavan, S.
Synthesis and properties of thienopyrrole based heteroacenes - indolodibenzothienopyrrole and dicarbazolodithienopyrrole.
Organic & biomolecular chemistry, 2012, 10, 3455-3462
7152319 CIFC16 H12 O6P 1 21/c 16.8238; 11.0492; 16.3885
90; 100.76; 90
1213.93Scaffidi, Adrian; Waters, Mark T.; Skelton, Brian W.; Bond, Charles S.; Sobolev, Alexandre N.; Bythell-Douglas, Rohan; McKinley, Allan J.; Dixon, Kingsley W.; Ghisalberti, Emilio L.; Smith, Steven M.; Flematti, Gavin R.
Solar irradiation of the seed germination stimulant karrikinolide produces two novel head-to-head cage dimers
Organic & Biomolecular Chemistry, 2012, 10, 4069
7152320 CIFC16 H12 O6P 1 21/c 117.021; 11.994; 13.456
90; 113.283; 90
2523.3Scaffidi, Adrian; Waters, Mark T.; Skelton, Brian W.; Bond, Charles S.; Sobolev, Alexandre N.; Bythell-Douglas, Rohan; McKinley, Allan J.; Dixon, Kingsley W.; Ghisalberti, Emilio L.; Smith, Steven M.; Flematti, Gavin R.
Solar irradiation of the seed germination stimulant karrikinolide produces two novel head-to-head cage dimers
Organic & Biomolecular Chemistry, 2012, 10, 4069
7152321 CIFC17 H15 N O4P 21 21 214.2571; 14.425; 23.481
90; 90; 90
1441.9Sun, Zhong-Xin; Cheng, Ying
N-Heterocyclic carbene-catalyzed cascade annulation reaction of o-vinylarylaldehydes with nitrosoarenes: one-step assembly of functionalized 2,3-benzoxazin-4-ones
Organic & Biomolecular Chemistry, 2012, 10, 4088
7152322 CIFC18 H20 I N OC 1 c 110.3319; 21.2699; 9.3647
90; 120.648; 90
1770.5Huang, Jing-Mei; Ye, Zhi-Jun; Chen, Dong-Song; Zhu, Hong
Iodine mediated/Brønsted acid-catalyzed dimerization of vinylarenes: a tandem reaction through Ritter trapping to produce N-(4-iodo-1,3-diarylbutyl) acetamides.
Organic & biomolecular chemistry, 2012, 10, 3610-3612
7152323 CIFC22 H18 N2 OP c a 2119.7487; 9.7599; 18.467
90; 90; 90
3559.4Bhanuchandra, M.; Kuram, Malleswara Rao; Sahoo, Akhila K.
A convenient approach to β-heteroarylated (C-N bond) ketones from Cs(2)CO(3) promoted reaction between propargyl alcohols and nitrogen-heterocycles.
Organic & biomolecular chemistry, 2012, 10, 3538-3555
7152324 CIFC24 H20 N2 OP 1 21/c 110.9862; 19.4309; 9.9118
90; 115.173; 90
1914.9Bhanuchandra, M.; Kuram, Malleswara Rao; Sahoo, Akhila K.
A convenient approach to β-heteroarylated (C-N bond) ketones from Cs(2)CO(3) promoted reaction between propargyl alcohols and nitrogen-heterocycles.
Organic & biomolecular chemistry, 2012, 10, 3538-3555
7152325 CIFC23 H30 Fe N O2 P SiP 1 21 110; 11.073; 10.832
90; 109.495; 90
1130.7Martins, Nelson; Mateus, Nuno; Vinci, Daniele; Saidi, Ourida; Brigas, Amadeu; Bacsa, John; Xiao, Jianliang
Another side of the oxazaphospholidine oxide chiral ortho-directing group
Organic & Biomolecular Chemistry, 2012, 10, 4036
7152326 CIFC32 H31 Fe N O2 P2P 21 21 2112.0764; 13.3216; 17.3013
90; 90; 90
2783.4Martins, Nelson; Mateus, Nuno; Vinci, Daniele; Saidi, Ourida; Brigas, Amadeu; Bacsa, John; Xiao, Jianliang
Another side of the oxazaphospholidine oxide chiral ortho-directing group
Organic & Biomolecular Chemistry, 2012, 10, 4036
7152327 CIFC20 H22 Fe N O2 PP 21 21 2110.1623; 12.0052; 14.5445
90; 90; 90
1774.4Martins, Nelson; Mateus, Nuno; Vinci, Daniele; Saidi, Ourida; Brigas, Amadeu; Bacsa, John; Xiao, Jianliang
Another side of the oxazaphospholidine oxide chiral ortho-directing group
Organic & Biomolecular Chemistry, 2012, 10, 4036
7152328 CIFC20 H22 Fe N O2 PP 21 21 215.817; 12.8442; 23.6728
90; 90; 90
1768.71Martins, Nelson; Mateus, Nuno; Vinci, Daniele; Saidi, Ourida; Brigas, Amadeu; Bacsa, John; Xiao, Jianliang
Another side of the oxazaphospholidine oxide chiral ortho-directing group
Organic & Biomolecular Chemistry, 2012, 10, 4036
7152329 CIFC18 H20 N2 O6P -17.6377; 7.8225; 32.1299
93.748; 91.221; 109.094
1808.28Bennett, Nicholas J.; Elliott, Mark C.; Hewitt, Natalie L.; Kariuki, Benson M.; Morton, Clare A.; Raw, Steven A.; Tomasi, Simone
Diastereoselective alkylation reactions of 1-methylcyclohexa-2,5-diene-1-carboxylic acid
Organic & Biomolecular Chemistry, 2012, 10, 3859
7152330 CIFC59 H78 Cl2 O10P b c n42.526; 15.758; 16.686
90; 90; 90
11182Shu, Xiaoyan; Fan, Jiazeng; Li, Jian; Wang, Xiaoyang; Chen, Wei; Jia, Xueshun; Li, Chunju
Complexation of neutral 1,4-dihalobutanes with simple pillar[5]arenes that is dominated by dispersion forces.
Organic & biomolecular chemistry, 2012, 10, 3393-3397
7152331 CIFC119 H198 Cl2 O10P 1 21/c 121.897; 21.54; 25.2
90; 98.28; 90
11762Shu, Xiaoyan; Fan, Jiazeng; Li, Jian; Wang, Xiaoyang; Chen, Wei; Jia, Xueshun; Li, Chunju
Complexation of neutral 1,4-dihalobutanes with simple pillar[5]arenes that is dominated by dispersion forces.
Organic & biomolecular chemistry, 2012, 10, 3393-3397
7152332 CIFC79 H118 F2 O10P -112.2219; 14.486; 21.9366
89.672; 89.514; 76.132
3770.4Shu, Xiaoyan; Fan, Jiazeng; Li, Jian; Wang, Xiaoyang; Chen, Wei; Jia, Xueshun; Li, Chunju
Complexation of neutral 1,4-dihalobutanes with simple pillar[5]arenes that is dominated by dispersion forces.
Organic & biomolecular chemistry, 2012, 10, 3393-3397
7152333 CIFC79 H118 I2 O10P -115.136; 24.59; 24.775
61.226; 81.302; 74.159
7773Shu, Xiaoyan; Fan, Jiazeng; Li, Jian; Wang, Xiaoyang; Chen, Wei; Jia, Xueshun; Li, Chunju
Complexation of neutral 1,4-dihalobutanes with simple pillar[5]arenes that is dominated by dispersion forces.
Organic & biomolecular chemistry, 2012, 10, 3393-3397
7152334 CIFC16 H15 Br N2 O4 SP 21 21 217.5614; 11.1691; 20.0521
90; 90; 90
1693.48Chen, Jie; Zhou, Ling; Yeung, Ying-Yeung
A highly enantioselective approach towards 2-substituted 3-bromopyrrolidines
Organic & Biomolecular Chemistry, 2012, 10, 3808
7152335 CIFC14 H13 Br N2 O4 S2P 21 21 217.4711; 11.1765; 19.4619
90; 90; 90
1625.1Chen, Jie; Zhou, Ling; Yeung, Ying-Yeung
A highly enantioselective approach towards 2-substituted 3-bromopyrrolidines
Organic & Biomolecular Chemistry, 2012, 10, 3808
7152336 CIFC14 H15 N O6P 21 21 216.5782; 8.7302; 21.2398
90; 90; 90
1219.78Ahmad, Sajjad; Swift, Michael D.; Farrugia, Louis J.; Senn, Hans Martin; Sutherland, Andrew
Stereoselective synthesis of functionalised carbocyclic amides: construction of the syn-(4aS,10bS)-phenanthridone skeleton
Organic & Biomolecular Chemistry, 2012, 10, 3937
7152337 CIFC36 H20 N4 O6 SP 21 21 219.5048; 18.9754; 19.2401
90; 90; 90
3470.1Leermann, Timo; Broutin, Pierre-Emmanuel; Leroux, Frédéric R.; Colobert, Françoise
Construction of the biaryl-part of vancomycin aglycon via atropo-diastereoselective Suzuki‒Miyaura coupling
Organic & Biomolecular Chemistry, 2012, 10, 4095
7152338 CIFC33 H41 N O9 SP 1 21 110.6718; 11.6816; 14.2167
90; 111.935; 90
1644.01Leermann, Timo; Broutin, Pierre-Emmanuel; Leroux, Frédéric R.; Colobert, Françoise
Construction of the biaryl-part of vancomycin aglycon via atropo-diastereoselective Suzuki‒Miyaura coupling
Organic & Biomolecular Chemistry, 2012, 10, 4095
7152339 CIFC15 H17 N O4 SP 1 21/n 111.7222; 10.3371; 12.2852
90; 98.752; 90
1471.3Guan, Yifu; Zhang, Hongbin; Pan, Chengxue; Wang, Jia; Huang, Rong; Li, Qilin
Flexible synthesis of montanine-like alkaloids: revisiting the structure of montabuphine
Organic & Biomolecular Chemistry, 2012, 10, 3812
7152340 CIFC15 H17 N O4 SP 1 21/c 17.7625; 10.6733; 17.788
90; 97.621; 90
1460.7Guan, Yifu; Zhang, Hongbin; Pan, Chengxue; Wang, Jia; Huang, Rong; Li, Qilin
Flexible synthesis of montanine-like alkaloids: revisiting the structure of montabuphine
Organic & Biomolecular Chemistry, 2012, 10, 3812
7152341 CIFC23 H27 N O7 SP -19.4618; 11.8536; 12.1246
117.873; 91.857; 110.815
1090.7Guan, Yifu; Zhang, Hongbin; Pan, Chengxue; Wang, Jia; Huang, Rong; Li, Qilin
Flexible synthesis of montanine-like alkaloids: revisiting the structure of montabuphine
Organic & Biomolecular Chemistry, 2012, 10, 3812
7152342 CIFC22 H23 N O6 SP 1 21/c 115.273; 14.335; 9.1567
90; 90.0282; 90
2004.8Guan, Yifu; Zhang, Hongbin; Pan, Chengxue; Wang, Jia; Huang, Rong; Li, Qilin
Flexible synthesis of montanine-like alkaloids: revisiting the structure of montabuphine
Organic & Biomolecular Chemistry, 2012, 10, 3812
7152343 CIFC21 H26 O3 SP 21 21 219.1092; 10.189; 20.517
90; 90; 90
1904.3Gao, YuZhe; Wang, Xue; Sun, LiDong; Xie, LongGuan; Xu, XiaoHua
Zinc or indium-mediated Barbier-type allylation of aldehydes with 3-bromomethyl-5H-furan-2-one in aqueous media: an efficient synthesis method for α-methylene-γ-butyrolactone
Organic & Biomolecular Chemistry, 2012, 10, 3991
7152344 CIFC21 H26 O3 SP 1 21/n 19.1436; 19.925; 10.386
90; 100.85; 90
1858.4Gao, YuZhe; Wang, Xue; Sun, LiDong; Xie, LongGuan; Xu, XiaoHua
Zinc or indium-mediated Barbier-type allylation of aldehydes with 3-bromomethyl-5H-furan-2-one in aqueous media: an efficient synthesis method for α-methylene-γ-butyrolactone
Organic & Biomolecular Chemistry, 2012, 10, 3991
7152345 CIFC18 H18 Br N O3 SP 1 21/n 111.486; 7.4766; 20.639
90; 95.97; 90
1762.8Zhang, Di-Han; Du, Kang; Shi, Min
Gold(i)-catalyzed intramolecular hydroamination and ring-opening of sulfonamide-substituted 2-(arylmethylene)cyclopropylcarbinols.
Organic & biomolecular chemistry, 2012, 10, 3763-3766
7152346 CIFC23 H28 N2 O6P 1 21/n 19.7862; 11.6935; 18.199
90; 97.545; 90
2064.57Voskuhl, Jens; Waller, Mark; Bandaru, Sateesh; Tkachenko, Boryslav A.; Fregonese, Carlo; Wibbeling, Birgit; Schreiner, Peter R.; Ravoo, Bart Jan
Nanodiamonds in sugar rings: an experimental and theoretical investigation of cyclodextrin-nanodiamond inclusion complexes.
Organic & biomolecular chemistry, 2012, 10, 4524-4530
7152347 CIFC27 H32 N2 O6P -18.9831; 11.8982; 13.1146
106.512; 109.88; 101.331
1195.17Voskuhl, Jens; Waller, Mark; Bandaru, Sateesh; Tkachenko, Boryslav A.; Fregonese, Carlo; Wibbeling, Birgit; Schreiner, Peter R.; Ravoo, Bart Jan
Nanodiamonds in sugar rings: an experimental and theoretical investigation of cyclodextrin-nanodiamond inclusion complexes.
Organic & biomolecular chemistry, 2012, 10, 4524-4530
7152348 CIFC31 H36 N2 O6P -18.8685; 11.1349; 14.0791
94.026; 96.563; 109.563
1292.7Voskuhl, Jens; Waller, Mark; Bandaru, Sateesh; Tkachenko, Boryslav A.; Fregonese, Carlo; Wibbeling, Birgit; Schreiner, Peter R.; Ravoo, Bart Jan
Nanodiamonds in sugar rings: an experimental and theoretical investigation of cyclodextrin-nanodiamond inclusion complexes.
Organic & biomolecular chemistry, 2012, 10, 4524-4530
7152349 CIFC16 H18 N O3P 21 21 217.3012; 9.1671; 21.9003
90; 90; 90
1465.81Tchabanenko, Kirill; Sloan, Colleen; Bunetel, Yves-Mael; Mullen, Philip
Diastereoselective 1,3-dipolar cycloaddition of pyrylium ylides with chiral enamides.
Organic & biomolecular chemistry, 2012, 10, 4215-4219
7152350 CIFC27 H33 N O2 S SiC 1 2 118.687; 8.149; 18.235
90; 115.58; 90
2504.7Narhe, Bharat D.; Sriramurthy, Vardhineedi; Yadav, Veejendra K.
A smooth rearrangement of N-p-toluenesulfonyl 2-tert-butyldiphenylsilylmethyl-substituted azetidines into N-p-toluenesulfonyl 3-tert-butyldiphenylsilyl-substituted pyrrolidines.
Organic & biomolecular chemistry, 2012, 10, 4390-4399
7152351 CIFC30 H37 N O2 S SiP 21 21 2111.241; 13.09; 19.226
90; 90; 90
2829Narhe, Bharat D.; Sriramurthy, Vardhineedi; Yadav, Veejendra K.
A smooth rearrangement of N-p-toluenesulfonyl 2-tert-butyldiphenylsilylmethyl-substituted azetidines into N-p-toluenesulfonyl 3-tert-butyldiphenylsilyl-substituted pyrrolidines.
Organic & biomolecular chemistry, 2012, 10, 4390-4399

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