Crystallography Open Database

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7151145 CIFC32 H38 N2 O4P 21 21 218.6876; 14.8422; 22.3552
90; 90; 90
2882.55Beddow, James E.; Davies, Stephen G.; Ling, Kenneth B.; Roberts, Paul M.; Russell, Angela J.; Smith, Andrew D.; Thomson, James E.
Asymmetric synthesis of beta2-amino acids: 2-substituted-3-aminopropanoic acids from N-acryloyl SuperQuat derivatives.
Organic & biomolecular chemistry, 2007, 5, 2812-2825
7151146 CIFC29 H40 N2 O4P 21 21 2111.5661; 12.049; 20.5677
90; 90; 90
2866.31Beddow, James E.; Davies, Stephen G.; Ling, Kenneth B.; Roberts, Paul M.; Russell, Angela J.; Smith, Andrew D.; Thomson, James E.
Asymmetric synthesis of beta2-amino acids: 2-substituted-3-aminopropanoic acids from N-acryloyl SuperQuat derivatives.
Organic & biomolecular chemistry, 2007, 5, 2812-2825
7151147 CIFC22 H31 N O6 SP 1 21/a 110.2895; 10.2232; 22.4956
90; 94.284; 90
2359.7Walker, Stephen M.; Williams, Jodi T.; Russell, Alexander G.; Kariuki, Benson M.; Snaith, John S.
Stereoselective synthesis of 3,4-disubstituted and 3,4,5-trisubstituted piperidines by Lewis acid-catalysed ene cyclisation of 4-aza-1,7-dienes.
Organic & biomolecular chemistry, 2007, 5, 2925-2931
7151148 CIFC27 H35 N O10 SP 1 21/c 111.0618; 17.0577; 16.0387
90; 105.509; 90
2916.13Walker, Stephen M.; Williams, Jodi T.; Russell, Alexander G.; Kariuki, Benson M.; Snaith, John S.
Stereoselective synthesis of 3,4-disubstituted and 3,4,5-trisubstituted piperidines by Lewis acid-catalysed ene cyclisation of 4-aza-1,7-dienes.
Organic & biomolecular chemistry, 2007, 5, 2925-2931
7151149 CIFC17 H23 N O4 SP 1 21/a 16.1394; 21.563; 13.0265
90; 102.48; 90
1683.8Walker, Stephen M.; Williams, Jodi T.; Russell, Alexander G.; Kariuki, Benson M.; Snaith, John S.
Stereoselective synthesis of 3,4-disubstituted and 3,4,5-trisubstituted piperidines by Lewis acid-catalysed ene cyclisation of 4-aza-1,7-dienes.
Organic & biomolecular chemistry, 2007, 5, 2925-2931
7151150 CIFC16 H21 N O4 SP 1 21/n 17.6072; 12.0948; 17.8368
90; 96.33; 90
1631.12Walker, Stephen M.; Williams, Jodi T.; Russell, Alexander G.; Kariuki, Benson M.; Snaith, John S.
Stereoselective synthesis of 3,4-disubstituted and 3,4,5-trisubstituted piperidines by Lewis acid-catalysed ene cyclisation of 4-aza-1,7-dienes.
Organic & biomolecular chemistry, 2007, 5, 2925-2931
7151151 CIFC21 H27 Cl3 N2 O5 SP -16.0833; 9.5865; 22.1903
81.993; 86.709; 78.059
1253.19Walker, Stephen M.; Williams, Jodi T.; Russell, Alexander G.; Kariuki, Benson M.; Snaith, John S.
Stereoselective synthesis of 3,4-disubstituted and 3,4,5-trisubstituted piperidines by Lewis acid-catalysed ene cyclisation of 4-aza-1,7-dienes.
Organic & biomolecular chemistry, 2007, 5, 2925-2931
7151152 CIFC25 H24 O4P 1 21/a 113.9345; 8.792; 16.3108
90; 96.0142; 90
1987.27Tripoli, Regis; Cayzer, Tory N.; Willis, Anthony C.; Sherburn, Michael S.; Paddon-Row, Michael N.
Stereocontrol of intramolecular Diels–Alder reactions by an allylic diphenylcyclopropyl group
Organic & Biomolecular Chemistry, 2007, 5, 2606
7151153 CIFC27 H26 O6P b c a15.0402; 15.3235; 19.7863
90; 90; 90
4560.12Tripoli, Regis; Cayzer, Tory N.; Willis, Anthony C.; Sherburn, Michael S.; Paddon-Row, Michael N.
Stereocontrol of intramolecular Diels–Alder reactions by an allylic diphenylcyclopropyl group
Organic & Biomolecular Chemistry, 2007, 5, 2606
7151154 CIFC25 H24 O4P 1 21 111.019; 7.6264; 12.1306
90; 91.3965; 90
1019.1Tripoli, Regis; Cayzer, Tory N.; Willis, Anthony C.; Sherburn, Michael S.; Paddon-Row, Michael N.
Stereocontrol of intramolecular Diels–Alder reactions by an allylic diphenylcyclopropyl group
Organic & Biomolecular Chemistry, 2007, 5, 2606
7151155 CIFC11 H15 Cl2 N O2P 1 21 17.3431; 6.158; 14.2504
90; 90.828; 90
644.32Spiess, Stephanie; Berthold, Carola; Weihofen, Robert; Helmchen, Günter
Synthesis of alpha,beta-unsaturated gamma-lactams via asymmetric iridium-catalysed allylic substitution.
Organic & biomolecular chemistry, 2007, 5, 2357-2360
7151156 CIFC22 H17 Cu N5 O6P 1 21/c 112.996; 9.9631; 17.8565
90; 116.763; 90
2064.4Bertrand, Hélène; Monchaud, David; De Cian, Anne; Guillot, Régis; Mergny, Jean-Louis; Teulade-Fichou, Marie-Paule
The importance of metal geometry in the recognition of G-quadruplex-DNA by metal-terpyridine complexes
Organic & Biomolecular Chemistry, 2007, 5, 2555
7151157 CIFC15 H17 N3 O2P -17.6411; 8.4172; 12.521
71.402; 85.487; 63.189
679.18Kumarn, Sirirat; Oelke, Alexander J.; Shaw, David M.; Longbottom, Deborah A.; Ley, Steven V.
A sequential enantioselective, organocatalytic route to chiral 1,2-oxazines and chiral pyridazines
Organic & Biomolecular Chemistry, 2007, 5, 2678
7151158 CIFC20 H24 Cl3 N O5 SP 1 21/c 110.716; 20.066; 10.835
90; 91.767; 90
2328.7Baylis, Alison M.; Davies, Michael P. H.; Thomas, Eric J.
Synthetic approaches to the polycyclic alkaloid stemofoline.
Organic & biomolecular chemistry, 2007, 5, 3139-3155
7151159 CIFC12 H12 Br N O2 SP b c n16.5525; 10.1393; 14.0826
90; 90; 90
2363.49Harling, John D.; Steel, Patrick G.; Woods, Tom M.; Yufit, Dmitry S.
One-pot synthesis of benzothiazolines and napthathiazolines via cascade ortho-lithiation, cyclisation and elimination of N-arylsulfonyl lactams.
Organic & biomolecular chemistry, 2007, 5, 3472-3476
7151160 CIFC28 H23 N7 O3P 110.79; 10.8; 13.163
96.79; 106; 105.9
1386.6Vrábel, Milan; Pohl, Radek; Klepetárová, Blanka; Votruba, Ivan; Hocek, Michal
Synthesis of 2'-deoxyadenosine nucleosides bearing bipyridine-type ligands and their Ru-complexes in position 8 through cross-coupling reactions.
Organic & biomolecular chemistry, 2007, 5, 2849-2857
7151161 CIFC48 H38 F12 N11 O3 P2 Ru2P 113.291; 13.669; 16.242
89.02; 71.32; 89.82
2794.9Vrábel, Milan; Pohl, Radek; Klepetárová, Blanka; Votruba, Ivan; Hocek, Michal
Synthesis of 2'-deoxyadenosine nucleosides bearing bipyridine-type ligands and their Ru-complexes in position 8 through cross-coupling reactions.
Organic & biomolecular chemistry, 2007, 5, 2849-2857
7151162 CIFC20 H30 O2P 1 21/c 116.9623; 9.9591; 11.0721
90; 96.287; 90
1859.15Hughes, Nicholas J.; Pullin, Robert D. C.; Sanganee, Mahesh J.; Sellars, Jonathan D.; Steel, Patrick G.; Turner, Michael J.
Hosomi-Sakurai reactions of silacyclohexenes.
Organic & biomolecular chemistry, 2007, 5, 2841-2848
7151163 CIFC15 H20 O4 S5P 21 21 219.3614; 10.3321; 20.0889
90; 90; 90
1943.1Brown, R. James; Brooks, Andrew C.; Griffiths, Jon-Paul; Vital, Betrand; Day, Peter; Wallis, John D.
Synthesis of bis(ethylenedithio)tetrathiafulvalene (BEDT-TTF) derivatives functionalised with two, four or eight hydroxyl groups.
Organic & biomolecular chemistry, 2007, 5, 3172-3182
7151164 CIFC12 H13 N O3 SP 1 21 19.243; 5.497; 12.258
90; 95.177; 90
620.3Evans, Lyndsay Ann; Adams, Harry; Barber, Christopher G.; Caggiano, Lorenzo; Jackson, Richard F. W.
Stereoselective synthesis of 2,3-difunctionalised thioesters using nucleophilic epoxidation of 1-arylthio-1-nitroalkenes.
Organic & biomolecular chemistry, 2007, 5, 3156-3163
7151165 CIFC12 H12 O4 SP 21 21 217.5636; 10.4554; 15.375
90; 90; 90
1215.9Evans, Lyndsay Ann; Adams, Harry; Barber, Christopher G.; Caggiano, Lorenzo; Jackson, Richard F. W.
Stereoselective synthesis of 2,3-difunctionalised thioesters using nucleophilic epoxidation of 1-arylthio-1-nitroalkenes.
Organic & biomolecular chemistry, 2007, 5, 3156-3163
7151166 CIFC16 H22 Br N O3 SP 1 21 18.587; 5.2659; 19.647
90; 95.641; 90
884.1Evans, Lyndsay Ann; Adams, Harry; Barber, Christopher G.; Caggiano, Lorenzo; Jackson, Richard F. W.
Stereoselective synthesis of 2,3-difunctionalised thioesters using nucleophilic epoxidation of 1-arylthio-1-nitroalkenes.
Organic & biomolecular chemistry, 2007, 5, 3156-3163
7151167 CIFC12 H13 N O3 SP 1 21 15.249; 5.794; 20.357
90; 94.212; 90
617.4Evans, Lyndsay Ann; Adams, Harry; Barber, Christopher G.; Caggiano, Lorenzo; Jackson, Richard F. W.
Stereoselective synthesis of 2,3-difunctionalised thioesters using nucleophilic epoxidation of 1-arylthio-1-nitroalkenes.
Organic & biomolecular chemistry, 2007, 5, 3156-3163
7151168 CIFC13 H15 I N4 OP 1 21/n 17.4415; 21.445; 8.9163
90; 104.154; 90
1379.7Pérez-Castro, Isabel; Caamaño, Olga; Fernández, Franco; García, Marcos D; López, Carmen; De Clercq, Erik
Synthesis of 4-substituted-1,2,3-triazole carbanucleoside analogues of ribavirin via click chemistry.
Organic & biomolecular chemistry, 2007, 5, 3805-3813
7151169 CIFC44 H56 N8 O8P 1 21/a 111.0274; 8.9869; 21.255
90; 91.304; 90
2105.87Wilson, Jennifer M.; Giordani, Federica; Farrugia, Louis J.; Barrett, Michael P.; Robins, David J.; Sutherland, Andrew
Synthesis, characterisation and anti-protozoal activity of carbamate-derived polyazamacrocycles.
Organic & biomolecular chemistry, 2007, 5, 3651-3656
7151170 CIFC42 H34 Cl2 N2 O6 P2 PtP 21 21 2111.1024; 13.8168; 26.9261
90; 90; 90
4130.5Eberhardt, Luc; Armspach, Dominique; Matt, Dominique; Oswald, Benoît; Toupet, Loic
Efficient asymmetric hydrogenation of olefins with hydrazine-derived diphosphoramidites.
Organic & biomolecular chemistry, 2007, 5, 3340-3346
7151171 CIFC14 H12 Cl N2 O2.5 SeP -17.944; 9.7; 11.001
81.649; 74.131; 67.241
751.2Kuzma, Dusan; Parvez, Masood; Back, Thomas George
Formation of a spirodiazaselenurane and its corresponding azaselenonium derivatives from the oxidation of 2,2'-selenobis(benzamide). Structure, properties and glutathione peroxidase activity.
Organic & biomolecular chemistry, 2007, 5, 3213-3217
7151172 CIFC14 H18 N2 O6 SeP 1 21 14.554; 18.386; 9.912
90; 102.57; 90
810Kuzma, Dusan; Parvez, Masood; Back, Thomas George
Formation of a spirodiazaselenurane and its corresponding azaselenonium derivatives from the oxidation of 2,2'-selenobis(benzamide). Structure, properties and glutathione peroxidase activity.
Organic & biomolecular chemistry, 2007, 5, 3213-3217
7151173 CIFC21 H24 N2 OP 1 21 112.3636; 5.2242; 13.3704
90; 97.482; 90
856.24Mikata, Yuji; Aida, Shiho; Inaba, Yoko; Yano, Shigenobu
Consideration of molecular arrangements in regio- and enantioselective reduction of an NAD model compound controlled by carbonyl oxygen orientation.
Organic & biomolecular chemistry, 2007, 5, 3834-3841
7151174 CIFC21 H24 N2 OP 21 21 215.3478; 13.519; 23.99
90; 90; 90
1734.4Mikata, Yuji; Aida, Shiho; Inaba, Yoko; Yano, Shigenobu
Consideration of molecular arrangements in regio- and enantioselective reduction of an NAD model compound controlled by carbonyl oxygen orientation.
Organic & biomolecular chemistry, 2007, 5, 3834-3841
7151175 CIFC10 H11 Fe N O4P b c a11.3721; 9.835; 20.671
90; 90; 90
2311.9Williams, Iwan; Reeves, Keith; Kariuki, Benson M.; Cox, Liam R.
Stereoselective synthesis of 2-dienyl-substituted piperidines using an eta4-dienetricarbonyliron complex as the stereocontrolling element in a double reductive amination cascade.
Organic & biomolecular chemistry, 2007, 5, 3325-3329
7151176 CIFC17 H22 Br Fe N O3P -17.6829; 10.9941; 12.0958
69.757; 78.689; 89.592
937.92Williams, Iwan; Reeves, Keith; Kariuki, Benson M.; Cox, Liam R.
Stereoselective synthesis of 2-dienyl-substituted piperidines using an eta4-dienetricarbonyliron complex as the stereocontrolling element in a double reductive amination cascade.
Organic & biomolecular chemistry, 2007, 5, 3325-3329
7151177 CIFC15 H22 F3 N O6 S2P 41 21 29.905; 9.905; 39.488
90; 90; 90
3874.1Chen, Yue-Lei; Redlich, Hartmut; Bergander, Klaus; Fröhlich, Roland
D-glucosamine trimethylene dithioacetal derivatives: formation of six- and seven-membered ring amino carbasugars. Synthesis of (-)-calystegine B3.
Organic & biomolecular chemistry, 2007, 5, 3330-3339
7151178 CIFC10 H14 O3P 21 c n7.119; 10.6793; 12.0216
90; 90; 90
913.95Davies, Stephen G.; Russell, Angela J.; Sheppard, Ruth L.; Smith, Andrew D.; Thomson, James E.
Evaluating beta-amino acids as enantioselective organocatalysts of the Hajos-Parrish-Eder-Sauer-Wiechert reaction.
Organic & biomolecular chemistry, 2007, 5, 3190-3200
7151179 CIFC11 H16 O3P 1 21/c 16.9811; 7.5933; 19.5994
90; 94.874; 90
1035.2Davies, Stephen G.; Russell, Angela J.; Sheppard, Ruth L.; Smith, Andrew D.; Thomson, James E.
Evaluating beta-amino acids as enantioselective organocatalysts of the Hajos-Parrish-Eder-Sauer-Wiechert reaction.
Organic & biomolecular chemistry, 2007, 5, 3190-3200
7151180 CIFC6 H9 Br O5P 1 21/c 111.412; 5.887; 12.379
90; 93.337; 90
830.24Pirinççioğlu, Necmettin; Robinson, James J.; Mahon, Mary F.; Buchanan, J. Grant; Williams, Ian H.
Experimental and computational evidence for alpha-lactone intermediates in the addition of aqueous bromine to disodium dimethyl-maleate and -fumarate.
Organic & biomolecular chemistry, 2007, 5, 4001-4009
7151181 CIFC6 H10 Br O6P -16.239; 7.228; 11.171
85.342; 82.801; 69.105
466.56Pirinççioğlu, Necmettin; Robinson, James J.; Mahon, Mary F.; Buchanan, J. Grant; Williams, Ian H.
Experimental and computational evidence for alpha-lactone intermediates in the addition of aqueous bromine to disodium dimethyl-maleate and -fumarate.
Organic & biomolecular chemistry, 2007, 5, 4001-4009
7151182 CIFC13 H16 N2 O5 SP 21 21 217.7577; 17.7377; 20.872
90; 90; 90
2872.1Curtis, Kim L.; Evinson, Emma L.; Handa, Sandeep; Singh, Kuldip
Asymmetric synthesis of 3-amino-4-hydroxy-2-(hydroxymethyl)pyrrolidines as potential glycosidase inhibitors.
Organic & biomolecular chemistry, 2007, 5, 3544-3553
7151183 CIFC13 H16 N2 O5 SP 1 21 111.501; 6.2268; 19.785
90; 91.192; 90
1416.6Curtis, Kim L.; Evinson, Emma L.; Handa, Sandeep; Singh, Kuldip
Asymmetric synthesis of 3-amino-4-hydroxy-2-(hydroxymethyl)pyrrolidines as potential glycosidase inhibitors.
Organic & biomolecular chemistry, 2007, 5, 3544-3553
7151184 CIFC12 H16 Br N O4 SP 21 21 217.5443; 10.6588; 17.4366
90; 90; 90
1402.1Curtis, Kim L.; Evinson, Emma L.; Handa, Sandeep; Singh, Kuldip
Asymmetric synthesis of 3-amino-4-hydroxy-2-(hydroxymethyl)pyrrolidines as potential glycosidase inhibitors.
Organic & biomolecular chemistry, 2007, 5, 3544-3553
7151185 CIFC12 H16 N4 O4 SP 1 21 17.539; 17.643; 11.223
90; 100.446; 90
1468Curtis, Kim L.; Evinson, Emma L.; Handa, Sandeep; Singh, Kuldip
Asymmetric synthesis of 3-amino-4-hydroxy-2-(hydroxymethyl)pyrrolidines as potential glycosidase inhibitors.
Organic & biomolecular chemistry, 2007, 5, 3544-3553
7151186 CIFC13 H15 N2 O5 SP 21 21 215.6923; 15.7807; 33.089
90; 90; 90
2972.3Curtis, Kim L.; Evinson, Emma L.; Handa, Sandeep; Singh, Kuldip
Asymmetric synthesis of 3-amino-4-hydroxy-2-(hydroxymethyl)pyrrolidines as potential glycosidase inhibitors.
Organic & biomolecular chemistry, 2007, 5, 3544-3553
7151187 CIFC14 H14 O6 S2P 1 21/c 15.098; 14.076; 20.831
90; 92.82; 90
1493Hergué, Noémie; Frère, Pierre
Synthesis of 3,4-alkoxythieno[2,3-b]thiophene derivatives. The first block copolymer associating the 3,4-ethylenedioxythieno[2,3-b]thiophene (EDOThT) unit with 3,4-ethylenedioxythiophene (EDOT) moieties.
Organic & biomolecular chemistry, 2007, 5, 3442-3449
7151188 CIFC24 H31 N O2P 1 21 17.7573; 6.5351; 20.5605
90; 93.341; 90
1040.54Hermet, Jean-Paul R; Viterisi, Aurélien; Wright, Jonathan M.; McGrath, Matthew J.; O'Brien, Peter; Whitwood, Adrian C.; Gilday, John
Stereocontrolled synthesis and alkylation of cyclic beta-amino esters: asymmetric synthesis of a (-)-sparteine surrogate.
Organic & biomolecular chemistry, 2007, 5, 3614-3622
7151189 CIFC36 H28 B Cl3 N6 O4P -18.8675; 12.5714; 16.873
77.372; 85.404; 69.451
1718.7Xu, Hu; Jiang, Xiong-Jie; Chan, Elaine Y. M.; Fong, Wing-Ping; Ng, Dennis K. P.
Synthesis, photophysical properties and in vitro photodynamic activity of axially substituted subphthalocyanines.
Organic & biomolecular chemistry, 2007, 5, 3987-3992
7151190 CIFC36 H51 N O3 SiP 111.4449; 11.8; 14.6478
71.901; 67.6483; 76.207
1722.68Cailleau, Thaïs; Cooke, Jason W. B.; Davies, Stephen G.; Ling, Kenneth B.; Naylor, Alan; Nicholson, Rebecca L.; Price, Paul D.; Roberts, Paul M.; Russell, Angela J.; Smith, Andrew D.; Thomson, James E.
Asymmetric synthesis of beta-amino-gamma-substituted-gamma-butyrolactones: double diastereoselective conjugate addition of homochiral lithium amides to homochiral alpha,beta-unsaturated esters.
Organic & biomolecular chemistry, 2007, 5, 3922-3931
7151191 CIFC27 H28 Br N2 O3 ReP 19.593; 10.5494; 13.618
76.415; 85.266; 81.798
1324.2Yeung, Chi-Tung; Teng, Pang-Fei; Yeung, Ho-Lun; Wong, Wing-Tak; Kwong, Hoi-Lun
Catalytic and asymmetric cyclopropanation of alkenes catalysed by rhenium(I) bipyridine and terpyridine tricarbonyl complexes.
Organic & biomolecular chemistry, 2007, 5, 3859-3864
7151192 CIFC34 H35 Br N3 O3 ReP 21 21 217.893; 14.212; 28.551
90; 90; 90
3202.7Yeung, Chi-Tung; Teng, Pang-Fei; Yeung, Ho-Lun; Wong, Wing-Tak; Kwong, Hoi-Lun
Catalytic and asymmetric cyclopropanation of alkenes catalysed by rhenium(I) bipyridine and terpyridine tricarbonyl complexes.
Organic & biomolecular chemistry, 2007, 5, 3859-3864
7151193 CIFC16 H21 Cl O10P -19.516; 16.66; 6.226
98.72; 105.35; 98.72
921.6Yamada, Takeshi; Iritani, Masashi; Ohishi, Hirohumi; Tanaka, Kayo; Minoura, Katsuhiko; Doi, Mitsunobu; Numata, Atsushi
Pericosines, antitumour metabolites from the sea hare-derived fungus Periconia byssoides. Structures and biological activities.
Organic & biomolecular chemistry, 2007, 5, 3979-3986
7151194 CIFC26 H17 N3 O3P b c a11.3871; 18.131; 19.855
90; 90; 90
4099.3Manpadi, Madhuri; Uglinskii, Pavel Y.; Rastogi, Shiva K.; Cotter, Karen M.; Wong, Yin-Shan C; Anderson, Lisa A.; Ortega, Amber J.; Van Slambrouck, Severine; Steelant, Wim F. A.; Rogelj, Snezna; Tongwa, Paul; Antipin, Mikhail Yu; Magedov, Igor V.; Kornienko, Alexander
Three-component synthesis and anticancer evaluation of polycyclic indenopyridines lead to the discovery of a novel indenoheterocycle with potent apoptosis inducing properties.
Organic & biomolecular chemistry, 2007, 5, 3865-3872
7151195 CIFC30 H30 N2 O4P -18.401; 10.368; 15.647
95.41; 95.198; 102.676
1315Anas, S.; John, Jubi; Sajisha, V. S.; John, Joshni; Rajan, Rani; Suresh, E.; Radhakrishnan, K. V.
Iodine assisted palladium catalyzed ring opening of bicyclic hydrazines with organoboronic acids: stereoselective synthesis of functionalized cyclopentenes and alkylidene cyclopentenes.
Organic & biomolecular chemistry, 2007, 5, 4010-4019
7151196 CIFC18 H26 Cl6 D6 N6C 1 2/c 118.3557; 10.5375; 13.167
90; 103.55; 90
2475.91Coles, Martyn P.; Lee, Steven F.; Oakley, Sarah H.; Estiu, Guillermina; Hitchcock, Peter B.
Nucleophilic activity of a linked bis{guanidine} leading to formation of a dicationic C4N4-heterocycle.
Organic & biomolecular chemistry, 2007, 5, 3909-3911
7151197 CIFC64 H68 B2 N6P 1 21/c 111.1882; 14.384; 16.3407
90; 104.766; 90
2542.88Coles, Martyn P.; Lee, Steven F.; Oakley, Sarah H.; Estiu, Guillermina; Hitchcock, Peter B.
Nucleophilic activity of a linked bis{guanidine} leading to formation of a dicationic C4N4-heterocycle.
Organic & biomolecular chemistry, 2007, 5, 3909-3911
7151198 CIFC77 H80 B2 N6C 1 c 118.824; 13.0677; 26.2401
90; 105.854; 90
6209.2Coles, Martyn P.; Lee, Steven F.; Oakley, Sarah H.; Estiu, Guillermina; Hitchcock, Peter B.
Nucleophilic activity of a linked bis{guanidine} leading to formation of a dicationic C4N4-heterocycle.
Organic & biomolecular chemistry, 2007, 5, 3909-3911
7151199 CIFC15 H26 N6P 31 2 18.689; 8.689; 17.1794
90; 90; 120
1123.25Coles, Martyn P.; Lee, Steven F.; Oakley, Sarah H.; Estiu, Guillermina; Hitchcock, Peter B.
Nucleophilic activity of a linked bis{guanidine} leading to formation of a dicationic C4N4-heterocycle.
Organic & biomolecular chemistry, 2007, 5, 3909-3911
7203851 CIFC20 H30 Au2 S6 W2P 1 21/a 117.123; 9.373; 18.019
90; 107.43; 90
2759.2Lang, Jian-Ping; Yu, Hong; Ji, Shun-Jun; Sun, Zhen-Rong
Synthesis, crystal structure and third-order nonlinear optical (NLO) properties of a novel tetranuclear organometallic cluster [(?5?C5Me5)WS3Au]2
Physical Chemistry Chemical Physics, 2003, 5, 5127
7204509 CIFC9 H17 N7 O4 SP 1 21/c 17.202; 11.18; 18.192
90; 100.48; 90
1440.4Grossel, Martin C.; Merckel, Daniel A. S.; Hutchings, Michael G.
The effect of preorganisation on the solid state behaviour of simple 'aromatic-cored' bis(guanidinium) sulfatesElectronic supplementary information (ESI) available: full details of crystallographic data collection for compounds 2·H2SO4 and 3·H2SO4·2H2O. See http://www.rsc.org/suppdata/ce/b2/b207803a/
CrystEngComm, 2003, 5, 77
7204510 CIFC10 H18 N6 O8 SC 1 2/c 19.4365; 23.7247; 7.0598
90; 93.656; 90
1577.32Grossel, Martin C.; Merckel, Daniel A. S.; Hutchings, Michael G.
The effect of preorganisation on the solid state behaviour of simple 'aromatic-cored' bis(guanidinium) sulfatesElectronic supplementary information (ESI) available: full details of crystallographic data collection for compounds 2·H2SO4 and 3·H2SO4·2H2O. See http://www.rsc.org/suppdata/ce/b2/b207803a/
CrystEngComm, 2003, 5, 77
7204546 CIFC22 H36 Cl2 Cu N8 O4P 1 21/c 18.5807; 14.25; 12.114
90; 109.853; 90
1393.2Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire
Complementarity of halide-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids using bis(N-alkylamidino-O-alkylurea)copper(ii) halides
CrystEngComm, 2003, 5, 10
7204547 CIFC10 H24 Br2 Cu N8 O2P -19.036; 12.689; 16.37
94.62; 97.051; 91.02
1856Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire
Complementarity of halide-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids using bis(N-alkylamidino-O-alkylurea)copper(ii) halides
CrystEngComm, 2003, 5, 10
7204548 CIFC12 H30 Cl2 Cu N8 O3P 1 21/c 110.859; 24.988; 7.662
90; 96.259; 90
2066.7Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire
Complementarity of halide-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids using bis(N-alkylamidino-O-alkylurea)copper(ii) halides
CrystEngComm, 2003, 5, 10
7204549 CIFC13 H32 Br2 Cu N8 O3P -17.6304; 12.062; 12.964
71.233; 78.914; 80.827
1102.5Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire
Complementarity of halide-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids using bis(N-alkylamidino-O-alkylurea)copper(ii) halides
CrystEngComm, 2003, 5, 10
7204550 CIFC10 H28 Br2 Cu N8 O4P 1 21/c 15.223; 16.539; 11.802
90; 102.806; 90
994.1Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire
Complementarity of halide-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids using bis(N-alkylamidino-O-alkylurea)copper(ii) halides
CrystEngComm, 2003, 5, 10
7204551 CIFC8 H20 Cl2 Cu N8 O2P 1 21/c 15.2682; 13.403; 11.065
90; 94.56; 90
778.8Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire
Complementarity of halide-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids using bis(N-alkylamidino-O-alkylurea)copper(ii) halides
CrystEngComm, 2003, 5, 10
7204552 CIFC16 H13 N O4P 1 21 16.983; 16.174; 12.36
90; 99.31; 90
1377.6Smith, Graham; Wermuth, Urs D.; White, Jonathan M.
Facile solid-state molecular assembly: the crystal structure of the unique 2∶2 proton-transfer oxine-salicylic acid compound
CrystEngComm, 2003, 5, 58
7204555 CIFC32 H40 N2 O3P c a 2117.17; 14.26; 24.02
90; 90; 90
5881Fan, Ailong; Valiyaveettil, Suresh; Vittal, Jagadese J.
Monohelical self-assembly of 5-alkoxyisophthalamides
CrystEngComm, 2003, 5, 38
7204559 CIFC12 H28 Cu N10 O8P 1 21/n 15.383; 15.581; 12.685
90; 101.746; 90
1041.6Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire
Complementarity of anion-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids by bis(N-alkylamidino-O-alkylurea)copper(ii) nitrates and tetrafluoroborates
CrystEngComm, 2003, 5, 23
7204560 CIFC12 H28 B2 Cu F8 N8 O2P 1 21 15.2725; 15.204; 13.9432
90; 99.532; 90
1102.3Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire
Complementarity of anion-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids by bis(N-alkylamidino-O-alkylurea)copper(ii) nitrates and tetrafluoroborates
CrystEngComm, 2003, 5, 23
7204561 CIFC22.5 H35 Cu N10 O9P -111.1621; 16.1935; 17.328
83.861; 74.106; 81.143
2969.5Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire
Complementarity of anion-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids by bis(N-alkylamidino-O-alkylurea)copper(ii) nitrates and tetrafluoroborates
CrystEngComm, 2003, 5, 23
7204562 CIFC10 H24 Cu N10 O8P 1 21/n 15.03; 15.4696; 12.3914
90; 95.916; 90
959.07Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire
Complementarity of anion-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids by bis(N-alkylamidino-O-alkylurea)copper(ii) nitrates and tetrafluoroborates
CrystEngComm, 2003, 5, 23
7204563 CIFC10 H24 B2 Cu F8 N8 O2P 1 21/n 15.118; 14.676; 13.913
90; 99.989; 90
1029.2Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Parker, David J.; Teat, Simon J.; Wilson, Claire
Complementarity of anion-mediated hydrogen-bonding and alkyl substitution in the construction of two-dimensional rhombic (4,4) grids by bis(N-alkylamidino-O-alkylurea)copper(ii) nitrates and tetrafluoroborates
CrystEngComm, 2003, 5, 23
7204564 CIFC5 H11 Co N O6P 21 21 217.149; 10.468; 11.295
90; 90; 90
845.3Zhang, Yugen; Saha, Manas K.; Bernal, Ivan
[Cobalt(ii)l-glutamate(H2O)·H2O]∞: a new 3D chiral metal‒organic interlocking network with channels
CrystEngComm, 2003, 5, 34
7204565 CIFC54 H36 Cl2 N16P -18.135; 12.011; 12.048
79.86; 89.486; 78.146
1133.7Akutagawa, Tomoyuki; Hasegawa, Tatsuo; Nakamura, Takayoshi; Saito, Gunzi
Hydrogen-bonded supramolecular (2,2'-bi-1H-benzimidazole)(2-(2-1H-benzimidazolyl)-1H-benzimidazolium+)2(Cl–) as an electron donor in a TCNQ complex
CrystEngComm, 2003, 5, 54
7204566 CIFC16 H36 Ag3 N S8 W2P 21 21 2111.689; 14.482; 18.587
90; 90; 90
3146.4Zhou, Jian-Liang; Wang, Yu-Xiao; Wang, Yan; Song, Ying-Lin; Zheng, He-Gen; Li, Yi-Zhi; Yang, Lan-Ping; Xin, Xin-Quan
Synthesis, crystal structure and non-linear optical properties of the heterobimetallic polymeric compound {[n-Bu4N][W2Ag3S8]}n
CrystEngComm, 2003, 5, 62
7204570 CIFC27 H18 Cl N3 O2C m c 2145.207; 6.465; 7.416
90; 90; 90
2167.4Báthori, Nikoletta; Bihátsi, László; Bombicz, Petra; Czugler, Mátyás
Extremely short intermolecular N(sp2)⋯Cl contact in the bis-2,4-(biphenyl-4-yloxy)-6-chloro-[1,3,5]triazine crystal
CrystEngComm, 2003, 5, 42
7204571 CIFC21 H23 Cl N4 O5P 1 21/n 16.545; 28.28; 11.633
90; 103.37; 90
2095Baskar Raj, S.; Muthiah, P. T.; Rychlewska, U.; Warzajtis, B.
Pseudo-polymorphism and crystal engineering: hydrogen-bonded supramolecular networks in trimethoprim m-chlorobenzoate and trimethoprim m-chlorobenzoate dihydrate
CrystEngComm, 2003, 5, 48
7204572 CIFC21 H25.4 Cl N4 O6.2P -17.271; 9.144; 16.674
86.93; 80.92; 85.43
1090.3Baskar Raj, S.; Muthiah, P. T.; Rychlewska, U.; Warzajtis, B.
Pseudo-polymorphism and crystal engineering: hydrogen-bonded supramolecular networks in trimethoprim m-chlorobenzoate and trimethoprim m-chlorobenzoate dihydrate
CrystEngComm, 2003, 5, 48
7204573 CIFC70 H56 O5P -112.9719; 15.119; 16.799
100.572; 104.897; 113.581
2761.4Guo, Fang; Guo, Wen Sheng; Toda, Fumio
Supramolecular stereoisomer – the conformational isomer of 1,1,6,6-tetraphenylhexa-2,4-diyne-1,6-diol in the different inclusion compounds
CrystEngComm, 2003, 5, 45
7204574 CIFC25 H37.5 N O2P 1 21/c 113.22; 10.568; 15.517
90; 105.954; 90
2084.4Guo, Fang; Guo, Wen Sheng; Toda, Fumio
Supramolecular stereoisomer ‒ the conformational isomer of 1,1,6,6-tetraphenylhexa-2,4-diyne-1,6-diol in the different inclusion compounds
CrystEngComm, 2003, 5, 45
7204575 CIFC4 H6 N2 O4P -15.5028; 7.0583; 8.2718
70.112; 85.814; 74.095
290.48Lewis, T. C.; Tocher, D. A.; Day, G. M.; Price, S. L.
A computational and experimental search for polymorphs of parabanic acid ‒ a salutary tale leading to the crystal structure of oxo-ureido-acetic acid methyl esterElectronic supplementary information (ESI) available: crystal structures of the 16 lattice energy minima in Table 2, in the space group setting used in the minimisation. See http://www.rsc.org/suppdata/ce/b2/b211784c/
CrystEngComm, 2003, 5, 3
7204576 CIFC14 H10 Cl N O2P 1 21/c 13.8364; 12.916; 12.221
90; 93.91; 90
604.2Kluge, S.; Dohnke, I.; Budde, F.; Hulliger, J.
Polarity formation in solid solutions: (4,4'-dinitrostilbene)1 ‒ x(4-chloro-4'-nitrostilbene)x, 1 > x > 0
CrystEngComm, 2003, 5, 67
7204577 CIFC14 H10 N2 O4P 1 21/c 13.818; 13.0067; 12.478
90; 94.371; 90
617.85Kluge, S.; Dohnke, I.; Budde, F.; Hulliger, J.
Polarity formation in solid solutions: (4,4'-dinitrostilbene)1 – x(4-chloro-4'-nitrostilbene)x, 1 > x > 0
CrystEngComm, 2003, 5, 67
7204584 CIFC16 H14 N4P b c a8.5187; 9.8623; 14.8684
90; 90; 90
1249.2Dudd, Lucinda M.; Venardou, Eleni; Garcia-Verdugo, Eduardo; Licence, Peter; Blake, Alexander J.; Wilson, Claire; Poliakoff, Martyn
Synthesis of benzimidazoles in high-temperature waterThis work was presented at the Green Solvents for Catalysis Meeting held in Bruchsal, Germany, 13‒16th October 2002.Electronic supplementary information (ESI) available: analytical data for compounds 3a‒f and 5g‒j. See http://www.rsc.org/suppdata/gc/b2/b212394k/
Green Chemistry, 2003, 5, 187
7204585 CIFC20 H14 N4P 1 21/c 17.5866; 10.366; 9.7278
90; 107.895; 90
728Dudd, Lucinda M.; Venardou, Eleni; Garcia-Verdugo, Eduardo; Licence, Peter; Blake, Alexander J.; Wilson, Claire; Poliakoff, Martyn
Synthesis of benzimidazoles in high-temperature waterThis work was presented at the Green Solvents for Catalysis Meeting held in Bruchsal, Germany, 13‒16th October 2002.Electronic supplementary information (ESI) available: analytical data for compounds 3a‒f and 5g‒j. See http://www.rsc.org/suppdata/gc/b2/b212394k/
Green Chemistry, 2003, 5, 187
7204586 CIFC20 H14 N4P b c n17.712; 8.7976; 9.7375
90; 90; 90
1517.3Dudd, Lucinda M.; Venardou, Eleni; Garcia-Verdugo, Eduardo; Licence, Peter; Blake, Alexander J.; Wilson, Claire; Poliakoff, Martyn
Synthesis of benzimidazoles in high-temperature waterThis work was presented at the Green Solvents for Catalysis Meeting held in Bruchsal, Germany, 13‒16th October 2002.Electronic supplementary information (ESI) available: analytical data for compounds 3a‒f and 5g‒j. See http://www.rsc.org/suppdata/gc/b2/b212394k/
Green Chemistry, 2003, 5, 187
7204591 CIFC43 H40 N O P3 PtR -3 :H25.6343; 25.6343; 31.3646
90; 90; 120
17849Rashidi, Mehdi; Jennings, Michael C.; Puddephatt, Richard J.
An organoplatinum molecular hexagon that crystallizes in a hexagonal array
CrystEngComm, 2003, 5, 65
7204594 CIFC21 H26 N4 O6 SP 1 21/n 113.407; 10.039; 17.115
90; 90.6; 90
2303.4Baskar Raj, S.; Sethuraman, V.; Francis, S.; Hemamalini, M.; Muthiah, P. Thomas; Bocelli, G.; Cantoni, A.; Rychlewska, U.; Warzajtis, B.
Supramolecular organisation via hydrogen bonding in trimethoprim sulfonate salts
CrystEngComm, 2003, 5, 70
7204595 CIFC20 H27 N5 O7 SP 1 21/c 117.855; 6.136; 21.349
90; 109.08; 90
2210Baskar Raj, S.; Sethuraman, V.; Francis, S.; Hemamalini, M.; Muthiah, P. Thomas; Bocelli, G.; Cantoni, A.; Rychlewska, U.; Warzajtis, B.
Supramolecular organisation via hydrogen bonding in trimethoprim sulfonate salts
CrystEngComm, 2003, 5, 70
7204596 CIFC20 H26 N4 O7 SP 1 21/c 117.507; 6.323; 21.35
90; 107.8; 90
2250.2Baskar Raj, S.; Sethuraman, V.; Francis, S.; Hemamalini, M.; Muthiah, P. Thomas; Bocelli, G.; Cantoni, A.; Rychlewska, U.; Warzajtis, B.
Supramolecular organisation via hydrogen bonding in trimethoprim sulfonate salts
CrystEngComm, 2003, 5, 70
7204597 CIFC21 H28 N4 O11 SP 1 21/c 111.442; 18.769; 12.783
90; 114.18; 90
2504.4Baskar Raj, S.; Sethuraman, V.; Francis, S.; Hemamalini, M.; Muthiah, P. Thomas; Bocelli, G.; Cantoni, A.; Rychlewska, U.; Warzajtis, B.
Supramolecular organisation via hydrogen bonding in trimethoprim sulfonate salts
CrystEngComm, 2003, 5, 70
7204602 CIFC14 H24 F12 N4 O2 P2P 1 21/c 111.761; 16.685; 11.864
90; 90.504; 90
2328Holbrey, John D.; Visser, Ann E.; Spear, Scott K.; Reichert, W. Matthew; Swatloski, Richard P.; Broker, Grant A.; Rogers, Robin D.
Mercury(ii) partitioning from aqueous solutions with a new, hydrophobic ethylene-glycol functionalized bis-imidazolium ionic liquidThis work was presented at the Green Solvents for Catalysis Meeting held in Bruchsal, Germany, 13–16th October 2002.
Green Chemistry, 2003, 5, 129
7204603 CIFC18 H32 F12 N4 P2P 1 21/c 16.4611; 16.5436; 12.1828
90; 99.445; 90
1284.56Holbrey, John D.; Visser, Ann E.; Spear, Scott K.; Reichert, W. Matthew; Swatloski, Richard P.; Broker, Grant A.; Rogers, Robin D.
Mercury(ii) partitioning from aqueous solutions with a new, hydrophobic ethylene-glycol functionalized bis-imidazolium ionic liquidThis work was presented at the Green Solvents for Catalysis Meeting held in Bruchsal, Germany, 13–16th October 2002.
Green Chemistry, 2003, 5, 129
7204604 CIFC30 H44 Hg N4 O11 S2P -110.086; 12.459; 15.204
83.209; 84.16; 67.666
1751.5Holbrey, John D.; Visser, Ann E.; Spear, Scott K.; Reichert, W. Matthew; Swatloski, Richard P.; Broker, Grant A.; Rogers, Robin D.
Mercury(ii) partitioning from aqueous solutions with a new, hydrophobic ethylene-glycol functionalized bis-imidazolium ionic liquidThis work was presented at the Green Solvents for Catalysis Meeting held in Bruchsal, Germany, 13‒16th October 2002.
Green Chemistry, 2003, 5, 129
7204607 CIFC23 H30 O5P -16.2565; 10.8094; 17.2183
106.78; 93.498; 102.78
1077.49Urbanczyk-Lipkowska, Zofia; Yoshizawa, Kazuhiro; Toyota, Shinji; Toda, Fumio
Easy isolation of the enol form of acetylacetone as an inclusion complex with host compounds
CrystEngComm, 2003, 5, 114-116
7204608 CIFC36 H38 O6P 1 21 19.8539; 9.2288; 33.0868
90; 92.658; 90
3005.67Urbanczyk-Lipkowska, Zofia; Yoshizawa, Kazuhiro; Toyota, Shinji; Toda, Fumio
Easy isolation of the enol form of acetylacetone as an inclusion complex with host compounds
CrystEngComm, 2003, 5, 114-116
7204610 CIFC14 H11 Co F2 O6P n m a12.588; 11.726; 8.987
90; 90; 90
1326.5Braga, Dario; Maini, Lucia; Mazzotti, Michele; Rubini, Katia; Grepioni, Fabrizia
Reversible gas?solid reactions between the organometallic zwitterion [CoIII(?5-C5H4COOH)(?5-C5H4COO)] and vapours of difluoro- and chloro-acetic acids
CrystEngComm, 2003, 5, 154
7204611 CIFC14 H12 Co F O6P 1 21/n 17.833; 11.696; 14.435
90; 100.13; 90
1301.8Braga, Dario; Maini, Lucia; Mazzotti, Michele; Rubini, Katia; Grepioni, Fabrizia
Reversible gas?solid reactions between the organometallic zwitterion [CoIII(?5-C5H4COOH)(?5-C5H4COO)] and vapours of difluoro- and chloro-acetic acids
CrystEngComm, 2003, 5, 154
7204612 CIFC14 H12 Cl Co O6P 1 21/n 17.452; 12.949; 14.886
90; 102.36; 90
1403.1Braga, Dario; Maini, Lucia; Mazzotti, Michele; Rubini, Katia; Grepioni, Fabrizia
Reversible gas?solid reactions between the organometallic zwitterion [CoIII(?5-C5H4COOH)(?5-C5H4COO)] and vapours of difluoro- and chloro-acetic acids
CrystEngComm, 2003, 5, 154
7204616 CIFC12 H8 N6P 1 21/c 15.0842; 5.4202; 18.831
90; 94.126; 90
517.59Oxtoby, Neil S.; Blake, Alexander J.; Champness, Neil R.; Wilson, Claire
The role of 1,2,4,5-tetrazine rings in π–π stacking interactions
CrystEngComm, 2003, 5, 82
7204617 CIFC12 H8 N6P 1 21/c 15.0029; 5.4035; 18.788
90; 92.776; 90
507.3Oxtoby, Neil S.; Blake, Alexander J.; Champness, Neil R.; Wilson, Claire
The role of 1,2,4,5-tetrazine rings in π–π stacking interactions
CrystEngComm, 2003, 5, 82

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