Crystallography Open Database

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1573989 CIFC18 H15 Br Fe O2P 17.613; 8.5829; 12.8193
80.36; 73.628; 82.082		788.68Hang, Nan-Nan; Tong, En-Guang; Qi, Ting; Sun, Chao; Ming, Jialin
Asymmetric synthesis of metallocenes with planar and central chirality by rhodium-catalyzed desymmetrization reactions.
Chemical science, 2025, 16, 5880-5886
1574039 CIFC20 H17 Cl N2 O3P 15.872; 7.735; 20.137
98.57; 97.62; 91.31		895.6Tian, Jiabao; Ling, Jiahao; Wang, Yanan; Zhou, Lei
Blue light-induced diazo cross-coupling: synthesis of allyldiazo compounds through reshuffling of functionalities.
Chemical science, 2025, 16, 5701-5706
1574060 CIFC14 H17 O7 PP 16.35385; 7.76034; 16.0686
92.9757; 90.6187; 101.846		774.2Platt, Ffion M.; Wang, Yihong; Cordes, David B.; McKay, Aidan P.; Slawin, Alexandra M. Z.; Panchal, Heena; Smith, Andrew D.
Isothiourea-catalysed enantioselective synthesis of phosphonate-functionalised β-lactones
Chemical Science, 2025, 16, 6828-6836
1574136 CIFC22 H21 I N2 O SeP 19.3735; 11.1993; 11.3482
63.903; 80.905; 86.542		1056.34Li, Yuanyuan; Tao, Chenyu; Duan, Longhui; Gu, Zhenhua
Observation of the solvent enantio-isotope effect in asymmetric ring-opening of cyclic diaryliodoniums with selenocyanate
Chemical Science, 2025, 16, 6488-6494
1574158 CIFC12 H12 Br F2 N O SP 19.5072; 11.2492; 13.1335
92.018; 92.253; 106.884		1341.42Baldon, Simone; Paut, Julien; Anselmi, Elsa; Dagousset, Guillaume; Tuccio, Béatrice; Pelosi, Giorgio; Cuadros, Sara; Magnier, Emmanuel; Dell’Amico, Luca
Radical photochemical difluorosulfoximination of alkenes and propellanes
Chemical Science, 2025, 16, 6957-6964
1574181 CIFC26.25 H23.5 Br Cl0.5 N O2 PP 110.6028; 14.0739; 18.2273
79.307; 73.787; 73.152		2483.4Luo, Shihui; Yuan, Xinzhu; Cheng, Jiangtao; Yang, Zhiping; Huang, Zhongxing; Wang, Jun (Joelle)
Enantioselective Zn-catalyzed hydrophosphinylation of nitrones: an efficient approach for constructing chiral α-hydroxyamino-phosphine oxides
Chemical Science, 2025, 16, 7051-7056
1574357 CIFC3 H I O S2P 14.09358; 5.63601; 6.64675
103.946; 91.017; 91.983		148.687Shukla, Rahul; Aubert, Emmanuel; Brezgunova, Mariya; Lebègue, Sébastien; Fourmigué, Marc; Espinosa, Enrique
The origin of synthons and supramolecular motifs: beyond atoms and functional groups.
IUCrJ, 2025, 12
1574428 CIFCl In14 K5 Se23P 19.0671; 12.1162; 12.1238
93.193; 94.436; 98.838		1309.06Pei, Shao-Min; Wu, Fan; Zhang, Ming-Shu; Chen, Wen-Fa; Jiang, Xiao-Ming; Liu, Bin-Wen; Guo, Guo-Cong
Non-centrosymmetric structures designed rationally <i>via</i> a "dimensionality addition" strategy toward the promising nonlinear optical family [A-X][In-Se] (A = K/Ba and Rb/Ba; X = Cl and Br).
Materials horizons, 2025, 12, 5204-5210
1574433 CIFCl In14 Rb5 Se23P 19.1426; 12.176; 12.2109
93.231; 94.496; 98.854		1335.76Pei, Shao-Min; Wu, Fan; Zhang, Ming-Shu; Chen, Wen-Fa; Jiang, Xiao-Ming; Liu, Bin-Wen; Guo, Guo-Cong
Non-centrosymmetric structures designed rationally <i>via</i> a "dimensionality addition" strategy toward the promising nonlinear optical family [A-X][In-Se] (A = K/Ba and Rb/Ba; X = Cl and Br).
Materials horizons, 2025, 12, 5204-5210
1574589 CIFC59 H54 Cl2 N6 Pd2P 112.4062; 12.6181; 19.276
102.182; 95.522; 118.581		2520.9Xue, Minying; To, Wai-Pong; Cheng, Gang; Zhang, Yuzhen; Tang, Zhou; Du, Lili; Low, Kam-Hung; Wan, Qingyun; Che, Chi-Ming
3MMLCT excited states of luminescent binuclear PdII complexes: excited state inner-sphere electron-transfer reactions and application
Chemical Science, 2025, 16, 10701-10713
1574664 CIFC21 H34 O2 SiP 17.43; 10.0076; 14.9814
96.641; 101.339; 99.843		1063.22Pereira, Joan; Casaretto, Nicolas; Frison, Gilles; Nay, Bastien
Bio-inspired total synthesis of daphnepapytone A
Chemical Science, 2025, 16, 11375-11380
1574820 CIFI8 K8P 111.81505482; 12.23692562; 7.10002691
90.0019; 90; 90		1026.52Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574821 CIFI4 Na4P 17.08010283; 7.09791712; 7.290053
90.014; 90.0073; 89.9994		366.354Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574822 CIFBr2 Cl8 K2P 15.52777127; 8.40563451; 9.50743605
89.9266; 92.1043; 90.0854		441.459Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574823 CIFCl3 I6 K9P 18.17554987; 8.17545312; 12.92405996
89.9997; 90.0004; 119.998		748.115Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574824 CIFBr8 Cl8 Li16P 17.5745859; 7.47783339; 10.64749269
90; 90; 89.9999		603.09Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574825 CIFBr4 I4 Li8P 16.89761845; 6.89761779; 9.07397362
89.9998; 89.9997; 89.9993		431.714Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574826 CIFCl10 Li2 Na4P 17.44595166; 6.64557407; 8.11584563
90.219; 90.6102; 89.7363		401.563Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574827 CIFBr3 K3P 14.57088421; 4.57088314; 12.56050046
90; 90; 120		227.268Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574828 CIFBr2 I4 Na6P 14.41377149; 11.42127601; 8.84758514
90.0609; 90; 89.9976		446.014Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574829 CIFBr8 Na12 O2P 111.0085188; 11.00851965; 4.54767139
90.0001; 89.9999; 90		551.121Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574830 CIFCl I3 K4P 17.04072003; 7.04072003; 7.04072017
90; 90; 90		349.021Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574831 CIFI12 Li9 Na3P 19.56782617; 9.56667027; 10.86714246
90.0184; 89.9857; 120.033		861.14Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574832 CIFCl4 Li4P 13.60563605; 6.18271013; 6.06886486
90; 90.5097; 90		135.285Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574833 CIFBr4 Na12 O8P 18.62374043; 6.86641651; 7.53508646
89.6433; 90.1447; 90.0822		446.174Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574834 CIFCl8 Li8P 16.96677839; 6.1954674; 7.80744572
89.9993; 90.0064; 90.0002		336.988Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574835 CIFBr2 I2 Na4P 17.27854968; 4.4636847; 7.52581834
90; 89.9997; 90		244.507Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574836 CIFI4 K4P 110.63927541; 5.88914438; 7.11982419
90; 90; 90		446.101Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574837 CIFBr2 I2 Na4P 14.46487017; 7.6102386; 8.82779691
55.489; 90; 90		247.17Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574838 CIFN4 Na4 O8P 14.53892396; 4.53928693; 10.61694621
89.9943; 90.0079; 89.9951		218.746Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574839 CIFBr8 Cl4 Li12P 16.36230533; 6.6968109; 11.13929413
90; 90; 90		474.614Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574840 CIFBe4 Br12 Li4P 17.36349178; 11.45486469; 6.34158533
89.9953; 89.9228; 90.003		534.898Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574841 CIFI2 Na2 O6P 14.69207514; 5.91256374; 7.44017721
90.295; 90.0371; 106.456		197.949Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574842 CIFBr4 K4P 17.97653216; 4.63198529; 8.22376751
90; 90; 90		303.845Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574843 CIFCl4 I4 Li8P 17.00922312; 8.16071716; 7.52055807
90.0001; 90; 90		430.178Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574844 CIFI6 K6 S20P 110.5550204; 10.54925829; 10.53309387
96.8075; 96.848; 83.1393		1149.64Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574845 CIFC4 Br8 Li12P 17.37088716; 11.27904563; 5.91404848
77.2952; 90.0055; 89.9985		479.636Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574846 CIFCl6 I4 K2P 15.69131825; 7.80534201; 13.60531471
89.8297; 89.9798; 89.9915		604.382Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574847 CIFBr8 Li8P 110.03026185; 10.03027612; 4.23379761
90; 90.0001; 90		425.947Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574848 CIFBr8 Na8P 18.36834834; 7.27874099; 7.22267546
90.0003; 89.9992; 90		439.941Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574849 CIFI6 Na6P 18.9313506; 8.93269682; 7.9621576
90; 90; 120.02		550.016Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574850 CIFI18 Li18P 112.4581865; 12.45766276; 8.72897931
89.9694; 90.0323; 119.998		1173.26Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574851 CIFBr16 Li16P 19.23216381; 11.11977739; 8.92893382
90; 90; 89.9935		916.641Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574852 CIFI8 Li8P 18.59968677; 9.33258631; 7.37288568
90; 90; 90		591.728Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574853 CIFBr18 Li18P 111.54482368; 11.54484693; 7.91932462
90.0074; 89.9921; 120.003		914.072Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574854 CIFBr18 Na18P 112.42857248; 12.42857263; 7.90695563
90.0004; 89.9996; 120.005		1057.7Nguyen, Tri Minh; Tawfik, Sherif Abdulkader; Tran, Truyen; Gupta, Sunil; Rana, Santu; Venkatesh, Svetha
The search for superionic solid-state electrolytes using a physics-informed generative model.
Materials horizons, 2025, 12, 6945-6955
1574868 CIFC24 H24 F N O2 SiP 110.6067; 10.8407; 10.999
61.01; 70.064; 89.897		1019.2Chang, Yun-Pu; Blanco-Herrero, Kevin; Alturaifi, Turki M.; Fettinger, James C.; Liu, Peng; Franz, Annaliese K.
Multifunctional chiral silanol ligands for enantioselective catalysis.
Chemical science, 2025, 16, 13678-13683
1574869 CIFC80 H84 B F26 N4 Na O5 Si2P 112.8653; 12.9386; 14.2525
76.0784; 80.3071; 65.8644		2094.9Chang, Yun-Pu; Blanco-Herrero, Kevin; Alturaifi, Turki M.; Fettinger, James C.; Liu, Peng; Franz, Annaliese K.
Multifunctional chiral silanol ligands for enantioselective catalysis.
Chemical science, 2025, 16, 13678-13683
1574875 CIFC14 H14 OP 15.5996; 8.103; 23.254
91.263; 91.912; 91.077		1054.1Paira, Soumen; Jain, Nupur; Adhikari, Debarsee; Sunoj, Raghavan B.; Sundararaju, Basker
<i>A priori</i> Design of [Mn(i)-Cinchona] catalyst for Asymmetric Hydrogenation of Ketones and β-Keto carbonyl Derivatives.
Chemical science, 2025, 16, 13826-13837
1574880 CIFC104 H92 N4 O40 P4 Si W12P 113.90582; 15.07813; 15.90307
112.371; 104.294; 100.202		2848.02Yonesato, Kentaro; Watanabe, Yota; Pascual-Borràs, Magda; Errington, R. John; Yamaguchi, Kazuya; Suzuki, Kosuke
Synthesis of a Keggin-type polyoxoselenidotungstate <i>via</i> site-selective oxygen-to-selenium substitution.
Chemical science, 2025, 16, 13183-13188
1574881 CIFC100 H86 N2 O28 P4 Se12 Si W12P 113.76778; 14.64503; 17.18784
68.0094; 68.5531; 89.6202		2956.65Yonesato, Kentaro; Watanabe, Yota; Pascual-Borràs, Magda; Errington, R. John; Yamaguchi, Kazuya; Suzuki, Kosuke
Synthesis of a Keggin-type polyoxoselenidotungstate <i>via</i> site-selective oxygen-to-selenium substitution.
Chemical science, 2025, 16, 13183-13188
1575021 CIFC27 H20 F N O6P 17.7941; 15.0015; 18.7462
95.028; 94.368; 92.216		2174.82Ren, Panlong; Zhao, Qing; Chi, Yonggui Robin; Zhu, Tingshun
Carbene-catalyzed enantioselective construction of a quasi-symmetrical spirocyclic hydroquinone with a minor chiral distinction
Chemical Science, 2025, 16, 8940-8945
1575026 CIFC18 H11 B Br F5 N2 O3 SP 17.948; 8.047; 16.16
92.793; 100.437; 107.826		961.6Ankudinov, Nikita M.; Alexeev, Nikita V.; Podyacheva, Evgeniya S.; Chusov, Denis A.; Lyssenko, Konstantin A.; Perekalin, Dmitry S.
Catalytic insertion of nitrenes into B–H bonds
Chemical Science, 2025, 16, 6298-6306
1575047 CIFC25 H20 N4 O4 S2P 14.6973; 11.16; 11.554
67.35; 82.509; 87.05		554.2Lai, Hui-Juan; Wang, Xu; Wang, Yuan; Wu, Wei-Na; Xu, Zhi-Hong
A Golgi-targeting fluorescent probe for the detection of hydrazine in biological and environmental systems.
Analytical methods : advancing methods and applications, 2025, 17, 6317-6325
1575358 CIFC5 H9 N O3 SP 15.0877; 5.8827; 6.5179
96.464; 103.867; 102.09		182.448Singh, Ashi; Avinash, Kiran; Pradhan, Amit Kumar; Prajapati, Aditya Kumar; Edwards, Alison J.; Thomas, Sajesh P.
Weak yet directional: supramolecular interactions of thiols unravelled by quantum crystallography.
Chemical science, 2025, 16, 16016-16026
1575361 CIFC5 H9 N O3 SP 15.0339; 5.7865; 6.4524
95.908; 103.03; 102.643		176.36Singh, Ashi; Avinash, Kiran; Pradhan, Amit Kumar; Prajapati, Aditya Kumar; Edwards, Alison J.; Thomas, Sajesh P.
Weak yet directional: supramolecular interactions of thiols unravelled by quantum crystallography.
Chemical science, 2025, 16, 16016-16026
1575567 CIFC43 H28 N2 O2P 19.0251; 9.0365; 10.1245
89.256; 74.606; 71.184		751.15Liu, Xiao; Wen, Xue-Liang; Zhou, Yang; Tang, Chao; Tang, Diandong; Wang, Qian; Shi, Yibo; Liu, Lin; Sun, Wei; Feng, Kai; Fang, Wei-Hai; Qiao, Juan; Shen, Lin; Chen, Xuebo
Molecular design of sensitizers for high-efficiency OLEDs: exploration of energy transfer dynamics.
Chemical science, 2025, 16, 17304-17315
1575568 CIFC43 H28 N2 O SP 18.8906; 9.0722; 10.1623
88.798; 76.812; 74.108		766.79Liu, Xiao; Wen, Xue-Liang; Zhou, Yang; Tang, Chao; Tang, Diandong; Wang, Qian; Shi, Yibo; Liu, Lin; Sun, Wei; Feng, Kai; Fang, Wei-Hai; Qiao, Juan; Shen, Lin; Chen, Xuebo
Molecular design of sensitizers for high-efficiency OLEDs: exploration of energy transfer dynamics.
Chemical science, 2025, 16, 17304-17315
1575641 CIFC34.75 H52.25 N7.25 O9P 114.238; 16.076; 18.83
83.96; 73.23; 83.06		4085.2Tsunekawa, Eisuke; Nakama, Takahiro; Fujita, Makoto; Sawada, Tomohisa
Engineering β-sheet morphologies <i>via</i> metal cross-linking and side chain modifications.
Chemical science, 2025, 16, 18832-18837
1575862 CIFC64 H52 N8 O6P 19.4969; 11.5694; 12.2031
93.947; 96.958; 96.723		1317.08He, Jun; Yang, Zun; Lin, Lili; Feng, Xiaoming
Enantioselective synthesis of C-C and C-N axially chiral pyrazole-based heterobiaryls.
Chemical science, 2025, 16, 20021-20029
1575881 CIFC34 H40 P2P 110.8371; 11.6905; 12.3737
105.871; 90.048; 100.228		1481.9Senn, Sebastian; Mörsdorf, Jean-Marc; Bertrams, Maria-Sophie; Kerzig, Christoph; Ballmann, Joachim
π-Extended diphosphonium-bridged ladder stilbenes: water-soluble fluorophores with up to eight annulated rings.
Chemical science, 2025, 16, 20517-20526
1576037 CIFC177 H164 Cl6 N12 O12P 117.3955; 17.9852; 19.2333
68.118; 83.583; 74.293		5374.9An, Tai; Yao, Jiayao; Xiao, Zuo; Yu, Qi; Wang, Yu; Gao, Yueyue; Song, Yixiao; Huang, Zuoxin; Ding, Zheng; Zhang, Xinyue; Xie, Yuanpeng; Lv, Menglan; Zuo, Chuantian; Ding, Junqiao; Ding, Liming
Chiral tether-guided selective synthesis of <i>D</i> <sub><i>n</i></sub> -symmetric chiral conjugated nanorings.
Chemical science, 2025, 16, 21404-21415
1576038 CIFC84 H72 N6 O6P 117.728; 17.892; 19.632
65.98; 81.665; 77.601		5543.6An, Tai; Yao, Jiayao; Xiao, Zuo; Yu, Qi; Wang, Yu; Gao, Yueyue; Song, Yixiao; Huang, Zuoxin; Ding, Zheng; Zhang, Xinyue; Xie, Yuanpeng; Lv, Menglan; Zuo, Chuantian; Ding, Junqiao; Ding, Liming
Chiral tether-guided selective synthesis of <i>D</i> <sub><i>n</i></sub> -symmetric chiral conjugated nanorings.
Chemical science, 2025, 16, 21404-21415
1576105 CIFC47.5 H34 Cl Cu F6 N2 O P2P 110.6436; 19.9659; 20.2453
103.151; 90.526; 90.257		4189.2Karimata, Ayumu; Ilatovskii, Daniil; Fayzullin, Robert R.; Komoto, Shinya; Bruhacs, Andrew; Khaskin, Eugene; Khusnutdinova, Julia R.
Mechanoluminescence from amorphous solids of heteroleptic copper complexes and common luminophores induced by non-destructive mechanical stimuli and fabrication of flexible mechanoluminescent films
Chemical Science, 2025
1576107 CIFC52 H43 Cu F6 N3 O P3P 110.90096; 12.11864; 18.7704
105.703; 95.5373; 105.463		2262.38Karimata, Ayumu; Ilatovskii, Daniil; Fayzullin, Robert R.; Komoto, Shinya; Bruhacs, Andrew; Khaskin, Eugene; Khusnutdinova, Julia R.
Mechanoluminescence from amorphous solids of heteroleptic copper complexes and common luminophores induced by non-destructive mechanical stimuli and fabrication of flexible mechanoluminescent films
Chemical Science, 2025
1576111 CIFC24 H32 B4 HfP 110.1704; 13.3855; 14.4409
97.369; 105.709; 97.202		1850.3Hansen, Hannah M.; Zgrabik, Joshua C.; Zacher, Peter A.; Schuely, Jacob J.; Amano, Emily M.; Yang, Mai Yer; Unruh, Daniel K.; Zuin, Lucia; Keith, Jason M.; Daly, Scott R.
Direct measurement of covalent three-center, two-electron M–H–B bonding in Zr and Hf borohydrides using B K-edge XAS
Chemical Science, 2025
1576115 CIFC24 H32 B4 ZrP 110.1671; 13.3719; 14.4875
97.458; 105.662; 97.063		1854.5Hansen, Hannah M.; Zgrabik, Joshua C.; Zacher, Peter A.; Schuely, Jacob J.; Amano, Emily M.; Yang, Mai Yer; Unruh, Daniel K.; Zuin, Lucia; Keith, Jason M.; Daly, Scott R.
Direct measurement of covalent three-center, two-electron M–H–B bonding in Zr and Hf borohydrides using B K-edge XAS
Chemical Science, 2025
1576165 CIFC29 H35 Cl Co N3 OP 112.19; 12.9109; 16.9559
95.359; 91.044; 92.146		2654.4Zheng, Chenggong; Liu, Jiyong; Wang, Yongtao; Li, Haoran; Wang, Yuwen; Lu, Zhan
The Structural Parameter of Spin States of C 1 -Symmetric Four-Coordinate Cobalt Complexes: D 4
Chemical Science, 2025
1576222 CIFC103 H51 Ag3 Al3 Cl6 F108 Fe Mo6 O24 P8 Sb3P 117.5136; 17.5204; 18.5072
61.798; 61.781; 60.021		4121.44Mondal, Bijan; Riesinger, Christoph; Scheer, Manfred
Two in one: a facile modular approach for the assembly of pnictogen-rich heteroleptic organometallic complexes
Chemical Science, 2025
1576239 CIFC22 H19 Cl N O2 PP 18.2954; 9.0584; 13.3668
73.851; 85.864; 79.04		946.99Hammes, Jasmin; Mañas, Clara; Pedada, Abhilash; Arnold, Marlene; Wahl, Johannes M.
Synthesis of chiral lactams by asymmetric nitrogen insertion
Chemical Science, 2025
2000294 CIF
Paper		C27 H32 N2 O7P 111.076; 11.314; 12.155
104.41; 102.02; 89.37		1441.6Driessen, R. A. J.; Fraanje, J.
Structure of methyl (4a<i>S</i>,5<i>R</i>,7a<i>R</i>,11a<i>R</i>,12a<i>S</i>)-2-benzyl-2,3,4,4a,5,6,7,7a,8,10,11a,12-dodecahydro-7,7-(ethylenedioxy)-1,9-dioxooxazolo[3',4':1,2]pyrrolo[5,4-<i>i</i>]isoquinoline-5-carboxylate toluene (2/1)
Acta Crystallographica Section C, 1991, 47, 1554-1557
2000392 CIF
Paper		C20 H19 O3.5 S3P 112.488; 10.372; 8.335
84.95; 108.74; 98.51		1010.2Dillen, J. L. M.; Roos, H. M.
Structure of tris(5-acetyl-3-thienyl)methane-ethanol (2/1) inclusion compound
Acta Crystallographica Section C, 1992, 48, 2229-2231
2000686 CIF
Paper		C67 H120 O38P 110.673; 15.776; 16.103
122.77; 110.09; 68.13		2080.5Rysanek, N.; Le Bas, G.; Villain, F.; Tsoucaris, G.
Structure of the (1:1:1) complex 2<i>a</i>,2<i>b</i>,2<i>c</i>,2<i>d</i>,2<i>e</i>,2<i>f</i>,3<i>a</i>,3<i>g</i>,6<i>a</i>,6<i>b</i>,6<i>c</i>,6<i>d</i>,6<i>e</i>,6<i>f</i>,6<i>g</i>-pentadeca-<i>O</i>-methyl-β-cyclodextrin-1,7-dioxaspiro[5.5]undecane-methanol
Acta Crystallographica Section C, 1992, 48, 1466-1471
2000855 CIF
Paper		C15 H26 O4 S2P 16.46; 8.917; 15.616
83.6; 83.41; 89.52		888Lynch, V. M.; Lee, W.-C.; Martin, S. F.; Davis, B. E.
Structure of a protected C3-C10 subunit of erythromycin and its C8 epimer
Acta Crystallographica Section C, 1992, 48, 1145-1148
2001143 CIF
Paper		C30 H66 Cl6 Er2 N6 O42P 113.003; 13.639; 9.861
110.26; 100.94; 109.35		1453.5Hu, N.-H.; Wang, Z.-L.; Niu, C.-J.; Ni, J.-Z.
Structure of an erbium complex with <small>L</small>-proline
Acta Crystallographica Section C, 1993, 49, 2086-2089
2001200 CIF
Paper		C38 H33 Fe O2 P2P 18.684; 10.1; 10.109
71.55; 85.42; 73.97		808.3Shawkataly, O. B.; Khalil, H.; Fun, H.-K.; Chinnakali, K.; Teoh, S.-G.; Ito, Y.; Sawamura, M.
Structure of (<i>R</i>)-1-[(<i>S</i>)-1',2-bis(diphenylphosphino)ferrocenyl]ethyl acetate
Acta Crystallographica Section C, 1993, 49, 1898-1900
2001374 CIF
Paper		C21 H27 Cl O4 P2 PdP 18.9982; 9.1024; 16.774
88.285; 74.676; 63.459		1179.19Manojlović-Muir, L.; Cross, R. J.; Hoyle, R. W.
Structure of (η^5^-cyclopentadienyl)bis(dimethylphenylphosphine)palladium(II) perchlorate
Acta Crystallographica Section C, 1993, 49, 1603-1606
2001460 CIF
Paper		C28 H26 O6 SP 110.159; 13.533; 10.016
108.1; 102.92; 96.3		1251.6Kamei, S.; Sakai, Y.; Ohashi, Y.; Adachi, A.; Tanino, K.; Kuwajima, I.
Structure of an optically active anthracycline precursor
Acta Crystallographica Section C, 1993, 49, 1509-1511
2001540 CIF
Paper		C20 H14 Cl Fe N2 O2P 115.106; 13.57; 7.386
101.55; 94.18; 92.49		1476.8Elmali, A.; Elerman, Y.; Svoboda, I.; Fuess, H.
Structure of [<i>N</i>,<i>N</i>'-<i>o</i>-phenylenebis(salicylideneaminato)]iron(III) chloride as a five-coordinate monomer
Acta Crystallographica Section C, 1993, 49, 1365-1367
2002296 CIFAl2 O4 PbP 15.268; 8.458; 5.07
90; 118.78; 90		198Ploetz, K B; Mueller-Buschbaum, Hk
Synthese und Aufbau von Pb Al2 O4 und Pb Ga2 4
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1982, 488, 38-44
2002297 CIFGa2 O4 PbP 15.387; 8.575; 5.22
90; 118.99; 90		210.9Ploetz, K B; Mueller-Buschbaum, Hk
Synthese und Aufbau von Pb Al2 O4 und Pb Ga2 4
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1982, 488, 38-44
2002403 CIFCu2 O4 WP 17.9018; 8.2008; 5.8718
96.506; 94.033; 110.27		352.2Mumm, H C; Mueller-Buschbaum, Hk
Zur Kristallstruktur von Cu2 W O4
Journal of the Less-Common Metals, 1988, 142, 85-90
2002526 CIFCu O8 W2 YP 15.939; 6.042; 5.025
112.3; 92.84; 111.77		151.1Mueller-Buschbaum, Hk; Krueger, T
Ein Beitrag zur Kristallstruktur von Cu Y W2 O8, Cu Ho W2 O8 und Cu Yb W2 O8
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1992, 607, 52-56
2002544 CIFBi Cu O8 W2P 16.074; 6.083; 5.006
112.45; 91.86; 110.28		157.4Krüger, T. F.; Müller-Buschbaum, Hk.
Ein mit β-CuNdW~2~O~8~ und β-LiYbW~2~O~8~ verwandtes Kupfer-Wismut-Oxowolframat: CuBiW~2~O~8~
Journal of Alloys and Compounds, 1992, 190, L1-L3
2002735 CIFFe3 Na O12 V3P 16.757; 8.155; 9.816
106.053; 104.401; 102.093		480.4Martin, F-D; Mueller-Buschbaum, Hk
Eine synthetische Spezies zum Mineral Howardevansit mit Eisen anstelle von Kupfer: Na Fe3 V3 O12
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 1995, 50, 51-55
2003000 CIF
Paper		C19 H18 O4P 18.075; 8.871; 11.606
72.69; 80.07; 71.84		751.3Walker, Martina; Pohl, Ehmke; Herbst-Irmer, Regine; Gerlitz, Martin; Rohr, Jürgen; Sheldrick, George M.
Absolute configurations of Emycin D, E and F; mimicry of centrosymmetric space groups by mixtures of chiral stereoisomers
Acta Crystallographica Section B, 1999, 55, 607-616
2003002 CIF
Paper		C26 H19 Br O5P 18.279; 11.539; 11.962
101.32; 110.25; 92.76		1042.9Walker, Martina; Pohl, Ehmke; Herbst-Irmer, Regine; Gerlitz, Martin; Rohr, Jürgen; Sheldrick, George M.
Absolute configurations of Emycin D, E and F; mimicry of centrosymmetric space groups by mixtures of chiral stereoisomers
Acta Crystallographica Section B, 1999, 55, 607-616
2003056 CIF
Paper		C14 H27 Co N10 O2P 17.635; 8.202; 9.442
109.08; 103.46; 107.03		497.7Steve C.F. Au-Yeung
Crystal structures of [18]aneN~6~H~2~K[Co(CN)~6~].4H~2~O, [16]aneN~4~H~2~K[Co(CN)~6~] and [12]aneN~4~H~3~[Co(CN)~6~].2H~2~O. Insight into the electrostatic and hydrogen-bonding interaction in self-assembling supercomplexes
Acta Crystallographica Section B, 1999, 55, 389-395
2003104 CIF
Paper		C12 H26 N2 O4P 15.1933; 5.4064; 13.6968
91.516; 98.603; 110.376		355.16Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series
Acta Crystallographica Section B, 1999, 55, 424-431
2003168 CIFC48 H38 Cl4 F6 Mn N5 O5 P6P 110.563; 10.603; 12.25
97.68; 99.34; 93.11		1337.6Carriedo, Gabino A.; Fernández, Lucia; Gómez, Paloma; Garcia-Granda, Santiago; Velázquez, Amador Menéndez
cis-trans-[{N~3~P~3~Cl~4~(C~6~H~5~)(PPh~2~)}Mn(CO)~2~(bipy) {P(OPh)~3~}]PF~6~. A Cationic Manganese‒Carbonyl Complex with a Phosphazenylphosphine Ligand
Acta Crystallographica, Section C: Crystal Structure Communications, 1995, 51, 20-23
2003296 CIF
Paper		C22 H23 Cl N2 O3P 16.7639; 8.0105; 9.3111
95.703; 106.774; 92.499		479.254Schollmeyer, D.; Keilhofer, D.; Pindur, U.
Diels–Alder Products of the Alkaloid ({-})-Thebaine with α-Chloroacrylnitrile and 1-Methoxy-1,3-cyclohexadiene with Tetracyanoethene
Acta Crystallographica Section C, 1995, 51, 502-505
2003461 CIF
Paper		C20 H26 O2P 110.568; 10.622; 8.545
106.39; 107.5; 83.38		877.1Fortes, A. G.; Johnstone, R. A. W.; Whittaker, D.; Lewis, N. J.
Fortesyl 2-Phenylpropionate. An Example of a Novel Hydrocarbon Skeleton Containing Three Fused Five-Membered Rings
Acta Crystallographica Section C, 1995, 51, 914-916
2003508 CIF
Paper		C12 H28 O14P 19.4; 11.029; 9.153
96.144; 96.84; 65.235		853.79Linden, A.; Lee, C. K.
α,α-<i>allo</i>-Trehalose Trihydrate
Acta Crystallographica Section C, 1995, 51, 1007-1012
2003516 CIF
Paper		C5 H18 N Na O9P 16.116; 16.656; 6.007
99.29; 100.94; 99.05		581.7Kashiwagi, T.; Sano, C.; Kawakita, T.; Nagashima, N.
Monosodium <small>L</small>-Glutamate Pentahydrate
Acta Crystallographica Section C, 1995, 51, 1053-1056
2003543 CIF
Paper		C18 H29 N O7P 110.232; 14.964; 6.826
93.81; 98.02; 104.37		997Parvez, M.; Benn, M. H.
Senecivernine Dihydrate
Acta Crystallographica Section C, 1995, 51, 1202-1204
2003587 CIF
Paper		C26 H31 F6 N2 O2 P PdP 19.1706; 9.3871; 9.5577
112.988; 113.552; 93.402		671.3Zehnder, M.; Neuburger, M.; von Matt, P.; Pfaltz, A.
(Allyl)palladium(II) Complexes with Chiral Ligands. I. (Allyl)palladium(II) Complexes with Methylenebis(oxazoline) Ligands
Acta Crystallographica Section C, 1995, 51, 1109-1112
2003597 CIF
Paper		C29 H33 F7 O5P 130.912; 7.719; 6.184
95.4; 87.16; 94.85		1462.5Kromm, P.; Allouchi, H.; Bideau, J.-P.; Cotrait, M.; Nguyen, H. T.
A Mesogenic Perfluorinated Compound
Acta Crystallographica Section C, 1995, 51, 1229-1231
2003673 CIF
Paper		C6 H8 O4P 14.558; 4.747; 8.15
76.92; 75.61; 82.17		165.78Fun, H.-K.; Sivakumar, K.; Ang, H.-B.; Sam, T.-W.; Gan, E.-K.
2,3-Dideoxy-<small>D</small>-<i>erythro</i>-hex-2-enono-1,5-lactone and 1,4-Lactone Obtained from Tri-<i>O</i>-acetyl-<small>D</small>-glucal
Acta Crystallographica Section C, 1995, 51, 1330-1333
2003825 CIF
Paper		C15 H16 Cu N4 O7P 17.624; 10.027; 12.001
97.46; 106.79; 108.76		806.2Moreno-Esparza, R.; Molins, E.; Briansó-Penalva, J. L.; Ruiz-Ramírez, L.; Redón, R.
Aqua(1,10-phenanthroline)(<small>L</small>-serinato)copper(II) Nitrate
Acta Crystallographica Section C, 1995, 51, 1505-1508
2003876 CIF
Paper		C22 H25 N O5 SP 15.584; 9.042; 10.902
77.06; 78.75; 87.98		526.1Clegg, W.; Dunbar, J. M.; Elsegood, M. R. J.; Jackson, R. F. W.; Palmer, N. J.
Two Products of Ring Opening Reactions of an Arylthionitrooxirane
Acta Crystallographica Section C, 1995, 51, 1950-1953
2004283 CIF
Paper		C40 H52 Li O6P 112.16; 12.482; 14.755
68.172; 80.307; 61.792		1832Näther, C.; Bock, H.; Bolte, M.
Tris(1,2-dimethoxyethane)lithium 1,1,4,4-Tetraphenyl-1,3-butadiene Radical Anion
Acta Crystallographica Section C, 1995, 51, 2510-2514
2004377 CIFC Li Na O3P 114.265; 14.261; 3.305
88.41; 91.7; 119.95		582.2Yatsenko, Alexandr V.; Zhukov, Sergei G.; D'yakov, Vladimir A.; Schenk, Hendrik.
Triclinic α-LiNaCO~3~
Acta Crystallographica, Section C: Crystal Structure Communications, 1996, 52, 1-3
2004427 CIF
Paper		C39 H54 Cl2 N2 O12P 18.818; 10.875; 12.023
110.45; 92.53; 107.3		1017.2Lahrahar, N.; Marsau, P.; Bouas-Laurent, H.; Desvergne, J.-P.; Fages, F.
Molecular, Crystal Structure and Fluorescence Emission Properties of Diprotonated 7,10,19,22-Tetraoxa-4,13-diaza[16.8^4,13^](9,10)anthracenophane (<i>A</i>~33~.2H^+^)
Acta Crystallographica Section C, 1996, 52, 113-116
2004536 CIF
Paper		C6 H12 N2 O4P 15.222; 8.389; 4.759
93.04; 102.59; 92.57		202.84Swenson, D. C.; Habermann, S. M.; Murphy, K. P.
Cyclo(<small>L</small>-alanyl-<small>L</small>-seryl).H~2~O and Cyclo(glycyl-<small>L</small>-seryl)
Acta Crystallographica Section C, 1996, 52, 383-387
2004670 CIF
Paper		C30 H48 N2 O3 S SiP 110.89; 17.714; 8.94
97.24; 105.824; 93.82		1636.8Bratovanov, S.; Linden, A.; Bienz, S.
Absolute Configuration of (<i>S</i>)-(+)-[(Benzyloxymethyl)(<i>tert</i>-butyl)methylsilyl] Methyl Ketone
Acta Crystallographica Section C, 1996, 52, 1045-1047
2004731 CIF
Paper		C20 H23 Br N2 O4P 19.796; 17.725; 6.042
97.22; 95.7; 104.65		997.5Parvez, M.; Rusiewicz, M.
Absolute Configuration of <small>D</small>-Brompheniramine Maleate
Acta Crystallographica Section C, 1996, 52, 901-904
2004810 CIF
Paper		C17 H22 N2 O2P 14.829; 5.843; 13.61
83.39; 86.16; 82.63		377.78Aakeröy, C. B.; Nieuwenhuyzen, M.
4-Methylbenzylammonium 4-Methylbenzylcarbamate
Acta Crystallographica Section C, 1996, 52, 957-960
2004843 CIF
Paper		C15 H22 O3P 18.5033; 8.8856; 10.773
101.29; 97.7; 118.42		677.24Castañeda-Acosta, J.; Fischer, N. H.; Fronczek, F. R.
The Guaianolide 11β<i>H</i>,13-Dihydromicheliolide
Acta Crystallographica Section C, 1996, 52, 1263-1266
2005071 CIF
Paper		C25 H35 N O4P 17.813; 8.058; 10.212
92.44; 105.51; 106.03		590.7Alonso, I.; López-Solera, I.; Raithby, P. R.
(5<i>R</i>)-5-[(<i>S</i>)-α-Hydroxybenzyl]-5-(<small>L</small>-menthyloxy)-4-(1-pyrrolidinyl)furan-2(5<i>H</i>)-one
Acta Crystallographica Section C, 1996, 52, 1743-1745
2005175 CIF
Paper		C12 H44 Co N8 O16 P3P 110.788; 8.748; 8.966
103.91; 111.14; 103.85		714.7Bacchi, A.; Ferranti, F.; Pelizzi, G.
Conformation and Packing of Cobalt(III) Sepulchrate Dihydrogentriphosphate Hexahydrate
Acta Crystallographica Section C, 1996, 52, 1624-1627
2005192 CIF
Paper		C20 H37 N3 O8P 19.179; 11.104; 12.202
84.08; 83.98; 75.52		1193.7Dalhus, B.; Görbitz, C. H.
Glycyl-<small>L</small>-Leucyl-<small>L</small>-Tyrosine Dihydrate 2-Propanol Solvate
Acta Crystallographica Section C, 1996, 52, 2087-2090
2005231 CIF
Paper		C23 H26 Cl2 N4 O3P 18.814; 10.329; 13.248
74.19; 88.31; 85.65		1157.1Bolte, M.
Nearly Centrosymmetric (<i>S</i>)-7-(2,6-Dichlorobenzyl)-8-(3-oxocyclopentyl)-1,3-dipropyl-7<i>H</i>-purine-2,6-dione
Acta Crystallographica Section C, 1996, 52, 1985-1987
2005258 CIF
Paper		C26 H31 N O3P 17.345; 10.532; 15.129
102; 100.16; 80.99		1118Stankovic, S.; Lazar, D.; Miljkovic, D.; Medic-Mijacevic, L.; Gasi, K.; Kovacevic, R.; Courseille, C.
17α-Benzyl-17β-hydroxy-16-hydroxyimino-3-methoxyestra-1,3,5(10)-triene
Acta Crystallographica Section C, 1996, 52, 2037-2040
2005267 CIF
Paper		C18 H27 O6.5P 18.398; 9.858; 12.781
94.89; 103.94; 113.36		923.2Panneerselvam, K.; Rudiño-Piñera, E.; Soriano-García, M.
β-Zearalenol Sesquihydrate
Acta Crystallographica Section C, 1996, 52, 1995-1997
2005352 CIF
Paper		C12 H16 Cu F12 N2 O3P 19.9019; 12.2972; 8.9716
108.28; 110.66; 86.16		969.4Hynes, R. C.; Willis, C. J.; Payne, N. C.
A Condensed Dialkoxide Complex of Copper(II), [(CH~3~)~2~NCH~2~CH~2~N(CH~3~)~2~]Cu[{OC(CF~3~)~2~}~2~O]
Acta Crystallographica Section C, 1996, 52, 2173-2176
2005413 CIF
Paper		C98.4 H216.6 O97.1P 118.056; 15.446; 15.452
103.159; 112.994; 99.352		3707.8Rontoyianni, A.; Mavridis, I. M.
β-Cyclodextrin Nonanoic Acid 1:1 Complex
Acta Crystallographica Section C, 1996, 52, 2277-2281
2005510 CIF
Paper		C16 H21 Cl5 Co N5 O4P 18.1522; 8.891; 8.9605
82.552; 89.561; 63.421		575Jones, P. G.; Yang, L.; Steinborn, D.
(<i>cis</i>-1,2-Dichlorovinyl)bis(dimethylglyoximato-<i>N</i>,<i>N</i>')(pyridine-<i>N</i>)cobalt(III) Chloroform Solvate, [Co(dmgH)~2~(py)(CCl=CHCl)].CHCl~3~
Acta Crystallographica Section C, 1996, 52, 2399-2402
2005717 CIF
Paper		C12 H18 N2 O5P 15.655; 12.248; 4.736
99.54; 106.34; 96.27		306.19Ojala, W. H.; Gleason, W. B.
Mannose Phenylhydrazone, an Acyclic Monosaccharide Derivative
Acta Crystallographica Section C, 1996, 52, 3188-3190
2005806 CIF
Paper		C10 H16 N4 O6P 15.113; 8.279; 14.86
93.01; 96.27; 99.87		614.4Angelova, O.; Velikova, V.; Kolev, T.; Radomirska, V.
Crystalline Complexes Involving Amino Acids. I. <small>L</small>-Argininium Hydrogen Squarate
Acta Crystallographica Section C, 1996, 52, 3252-3256
2005819 CIF
Paper		C12 H32 Cu Li2 O18P 17.732; 8.879; 9.772
66.92; 85.13; 64.39		553.6Gack, C.; Klüfers, P.
A Homoleptic Cuprate(II) Complex with Deprotonated 1,6-Anhydro-β-<small>D</small>-glucose (Levoglucosan) Ligands
Acta Crystallographica Section C, 1996, 52, 2972-2975
2005873 CIF
Paper		K2 Mg O10 P2 WP 19.141; 9.16; 10.736
90.28; 90.52; 90.11		898.9Peuchert, U.; Bohatý, L.; Schreuer, J.
The Triclinic Room-Temperature Modification of K~2~MgWO~2~(PO~4~)~2~
Acta Crystallographica Section C, 1997, 53, 11-14
2006099 CIF
Paper		C H2 N4P 13.725; 4.773; 4.936
107.03; 107.23; 101.57		76.08Goddard, Richard; Heinemann, Oliver; Krüger, Carl
α-1<i>H</i>-1,2,3,4-Tetrazole
Acta Crystallographica Section C, 1997, 53, 590-592
2006339 CIF
Paper		C13 H28 N2 O13P 14.7378; 7.5284; 13.1036
87.836; 86.108; 77.183		454.56Marilyn M. Olmstead; Ming Hu; Mark J. Kurth; John M. Krochta; You-Lo Hsieh
Lactosylurea Dihydrate
Acta Crystallographica Section C, 1997, 53, 915-916
2006667 CIF
Paper		C9 H12 N2 O6P 15.1318; 6.9156; 14.9166
83.3087; 88.388; 71.835		499.55Hempel, Andrew; Lane, Byron G.; Camerman, Norman
Pseudouridine
Acta Crystallographica Section C, 1997, 53, 1707-1709
2007300 CIF
Paper		C11 H12 N2 O5P 14.851; 6.288; 9.781
99.96; 101.26; 91.04		287.8Mazurek, Jarosław; Lis, Tadeusz; Rusek, Grzegorz; Krajewski, Krzysztof
Nitro Derivatives of 3-Acetamidobenzyl Acetate
Acta Crystallographica Section C, 1998, 54, 863-867
2007392 CIF
Paper		C15 H22 O5P 15.7473; 7.6109; 9.0705
70.19; 85.259; 78.188		365.34Thalji, Reema K.; Pentes, Howard G.; Fischer, Nikolaus H.; Fronczek, Frank R.
8-Desacetoxy-11β<i>H</i>,13-dihydroperoxyferolide, a Sesquiterpene Lactone Hydroperoxide
Acta Crystallographica Section C, 1998, 54, 861-863
2007494 CIF
Paper		C31 H48.67 O3.67P 16.235; 13.137; 25.73
88.05; 86.38; 84.5		2093Ilyin, Sergey G.; Antonov, Alexander S.; Stonik, Valentine A.; Antipin, Michael Yu.; Elyakov, Georgy B.
(20<i>S</i>)-3β-Hydroxyholosta-7,9-diene
Acta Crystallographica Section C, 1998, 54, 1156-1158
2007737 CIF
Paper		C26 H29 N O6P 16.6977; 7.9438; 10.81
72.643; 85.549; 88.011		547.26Lutz, Martin; Spek, Anthony L.
Complex of ({-})-Morphine with β-Phenylhydracrylic Acid
Acta Crystallographica Section C, 1998, 54, 1477-1479
2007843 CIF
Paper		C24 H20 F N O2P 18.341; 9.2516; 13.522
81.329; 84.722; 68.05		956Vassilios Nastopoulos; George Karigiannis; Petros Mamos; Dionissios Papaioannou; Constantin Kavounis
(<i>S</i>)-<i>N</i>-Triphenylmethylpyroglutamyl Fluoride
Acta Crystallographica Section C, 1998, 54, 1718-1720
2007963 CIF
Paper		C15 H40 N3 O16 PP 16.416; 10.109; 10.2
109.8; 103.93; 95.95		591.6Jerzykiewicz, Lucjan B.; Lis, Tadeusz
Tris{[tris(2-hydroxymethyl)methyl]ammonium} <small>D</small>-3-Phosphoglycerate at 150K and Tris(cyclohexylammonium) <small>D</small>-3-Phosphoglycerate Ethanol Solvate at 85K
Acta Crystallographica Section C, 1998, 54, 2015-2019
2007991 CIF
Paper		C36 H50 N10 O14P 19.2032; 14.792; 7.483
101.15; 96.175; 88.701		993.7Mitsunobu Doi; Mariko Tarui; Mihoko Ogata; Akiko Asano; Toshimasa Ishida
A Cytosine and Tryptophan Hybrid Dipeptide: Cytosinyl-<small>L</small>-tryptophan‒Water (2/6)
Acta Crystallographica Section C, 1998, 54, 1941-1943
2008097 CIF
Paper		C27 H37 N3 O4 S3 ZnP 112.146; 12.682; 10.842
115.26; 93.17; 86.49		1506.7Nakai, Hiroshi; Kobayashi, Shinobu; Ozaki, Mamoru; Hayase, Yoshio; Takeda, Reiji
Micacocidin A
Acta Crystallographica Section C, 1999, 55, 54-56
2008143 CIF
HKL
Paper		C30 H48 OP 16.229; 7.3544; 15.137
90.8; 97.34; 113.63		628.5Parvez, Masood; Gul, Waseem; Yousaf, Mohammad; Choudhary, M. Iqbal; Atta-ur-Rahman; Khan, M. Riaz
Taraxerone
Acta Crystallographica Section C, 1999, 55, 213-215
2008546 CIF
Paper		C15 H18 N2 OP 15.2624; 8.8737; 14.518
82.455; 85.847; 89.393		670.3Gallagher, John F.; Fitzsimons, Lavelle M.
Intermolecular N—H···O and C—H···O interactions form a two-dimensional network in (2<i>S</i>,4<i>S</i>,5<i>R</i>)-(–)-3,4-dimethyl-5-phenyl-2-(pyrrol-2-yl)-1,3-oxazolidine
Acta Crystallographica Section C, 1999, 55, 1000-1003
2008640 CIF
HKL
Paper		C20 H17 F5 N2 O2P 15.88; 7.449; 11.197
98.41; 90.13; 91.97		484.86Bolte, Michael; Benecke, Bernd; Egert, Ernst
Bis-lactim ethers of cyclic dipeptides. 2. Benzyl-substituted compounds
Acta Crystallographica Section C, 1999, 55, 968-973
2008853 CIF
Paper		C24 H29 O7 PP 19.556; 11.007; 12.713
111.67; 107.02; 99.25		1132.6Falshaw, Andrew; Gainsford, Graeme J.; Lensink, Cornelis
1-<small>D</small>-1,2:5,6-Di-<i>O</i>-isopropylidene-3-<i>O</i>-(diphenylphosphinoyl)-<i>chiro</i>-inositol, a hydrogen-bonded dimeric structure
Acta Crystallographica Section C, 1999, 55, 1353-1355
2008943 CIF
Paper		C11 H24 N2 O4P 15.1639; 5.4076; 13.1241
91.779; 98.138; 111.823		335.393Dalhus, Bjørn; Görbitz, Carl Henrik
Molecular aggregation in selected crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. III. The <small>L</small>-leucine and <small>L</small>-valine series
Acta Crystallographica Section C, 1999, 55, 1547-1555
2008952 CIF
HKL
Paper		C18.5 H26 O2.5P 17.2989; 9.2859; 12.4017
89.4709; 87.8567; 70.768		793.08Parrish, Damon A.; Pinkerton, A. Alan
Estradiol methanol hemisolvate
Acta Crystallographica Section C, 1999, 55, IUC9900100
2009035 CIF
Paper		C62 H66 N8 O2 SiP 19.608; 10.742; 14.468
107.121; 102.757; 104.349		1311.1Decréau, Richard; Julliard, Michel; Giorgi, Michel
Bis(<i>epi</i>-globulyloxy)(phthalocyaninato)silicon, a new photosensitizer for the photodynamic therapy of cancer
Acta Crystallographica Section C, 1999, 55, 1717-1719
2009178 CIF
Paper		C34 H34 O4P 19.986; 14.823; 9.514
98.24; 91.32; 80.49		1374.6Hamazaki, Hiroshi; Hosomi, Hiroyuki; Ohba, Shigeru
A triclinic polymorph of (<i>R</i>,<i>R</i>)-(–)-<i>trans</i>-1,4-dioxaspiro[4,5]decane-2,3-diylbis(diphenylmethanol)
Acta Crystallographica Section C, 1999, 55, IUC9900132
2009343 CIF
HKL
Paper		C19 H28 O3P 17.869; 10.113; 10.771
76.21; 85.78; 84.6		827.6Andrade, L. C. R.; Paixão, J. A.; de Almeida, M. J.; Tavares da Silva, E. J.; Sá e Melo, M. L.; Campos Neves, A. S.
3α-Hydroxy-5α-androstane-4,17-dione
Acta Crystallographica Section C, 1999, 55, 2149-2151
2009353 CIF
Paper		C17 H17 Cl N4 O2P 18.5705; 13.657; 14.895
84.26; 81.95; 87.11		1716.4Daniel R. Vega; Ricardo Baggio; Silvia Russi
8-Chloro-1-methyl-6-phenyl-4<i>H</i>-1,2,4-triazolo[4,3-<i>a</i>][1,4]benzodiazepine dihydrate
Acta Crystallographica Section C, 1999, 55, 2094-2096
2009436 CIF
Paper		C26 H48 Cl2 P2 PdP 17.3983; 9.433; 10.825
93.231; 107.931; 99.92		703.18Ganguly, S.; Mague, J.T.; Roundhill, D.M.
<i>cis</i>-Dichloro[1,2-bis(dicyclohexylphosphino)ethane]palladium(II)
Acta Crystallographica Section C, 1994, 50, 217-219
2009439 CIF
Paper		C30 H40 O6P 19.6729; 10.5434; 7.3228
99.85; 109.361; 98.229		677.96Evans, Stephen V.; Yee, Vivien C.; Garcia-Garibay, Miguel; Trotter, James
Structure of a mixed crystal of α- and β-pipitzol (1:1), C~15~H~20~O~3~.C~15~H~20~O~3~
Acta Crystallographica Section C, 1994, 50, 278-281
2009571 CIF
Paper		C9 H19 N O7P 16.228; 6.819; 7.494
95.42; 99.48; 108.99		293.07Frydenvang, K.; Hjelvang, G.; Jensen, B.; Martinho Do Rosario, S.M.
Structures of the choline ion in different crystal surroundings
Acta Crystallographica Section C, 1994, 50, 617-623
2009649 CIF
Paper		C44 H48 O23P 110.299; 20.221; 5.696
93.01; 94.46; 81.12		1167.5Ohsawa, Y.; Ohba, S.; Kosemura, S.; Yamamura, S.; Nakagawa, A.; Yoshida, K.; Kondo, T.
Flavocommelin octaacetate
Acta Crystallographica Section C, 1994, 50, 645-648
2009683 CIFB5 Ca2 Cl H2 O10P 16.452; 6.559; 6.286
61.6; 118.72; 105.86		204.9Burns, P.C.; Hawthorne, F.C.
Refinement of the Structure of Hilgardite-1A
Acta Crystallographica Section C, 1994, 50, 653-655
2009709 CIF
Paper		C43 H56 Br Cl3 O6 P2 Rh2P 19.828; 9.922; 13.074
84.9; 69.74; 84.52		1188.4García-Granda, S.; Díaz, M. R.; Gómez-Beltrán, F.; Peris, E.; Lahuerta, P.
Tris(μ-acetato)-μ-[(2-bromophenyl)(<i>o</i>-phenylene)phenylphosphine-<i>C</i>:<i>P</i>]tricyclohexylphosphinedirhodium(II)
Acta Crystallographica Section C, 1994, 50, 691-693
2009881 CIF
Paper		C15 H23 Cl N3 O3.5P 110.23; 9.858; 9.761
108.39; 72.85; 83		867.1Bacchi, Alessia; Pelizzi, Giancarlo; Redenti, Enrico; Delcanale, Maurizio; Amari, Gabriele; Ventura, Paolo
Geneserine hydrochloride
Acta Crystallographica Section C, 1994, 50, 1126-1130
2009900 CIF
Paper		C20 H31 N O2P 16.241; 7.319; 10.505
84.65; 94.83; 100.8		468.2Chiaroni, A.; Riche, C.; Lavergne, J.-P.; Sadoune, M.; Viallefont, P.; Vidal, Y.
[1<i>R</i>,2<i>R</i>,5(1')<i>S</i>,9<i>R</i>,2'<i>R</i>,4'<i>R</i>,5'<i>S</i>]-2,10,10-Triméthyl-3-oxa-6-azatricyclo[7,1,1,0^2,7^]undeca-5-spiro[1'(2',4',5'-triméthylcyclohexane)]-6-ène-4-one
Acta Crystallographica Section C, 1994, 50, 1122-1124
2010070 CIF
Paper		C27 H37 N O6 S2P 19.038; 9.488; 10.443
92.07; 109.45; 120.31		705.7Chiaroni, Angèle; Riche, Claude; Anaya, Josefa; Gateau-Olesker, Alice; Géro, Stephan D.; Hernando, José I.M.
Three 1,3,4-trisubstituted β-lactam antibiotics
Acta Crystallographica Section C, 1994, 50, 1474-1480
2010285 CIF
Paper		C36 H40 N4 O6P 17.17; 8.057; 14.953
84.87; 89.04; 69.85		807.6Barkigia, K.M.; Gottfried, D.S.
A new crystal form of methyl bacteriopheophorbide <i>a</i>
Acta Crystallographica Section C, 1994, 50, 2069-2072
2010543 CIF
HKL
Paper		C6 H16 F2 N4 O2P 15.1813; 9.2173; 10.6278
87.878; 74.948; 86.653		489.18Ramos Silva, M.; Paixão, J. A.; Matos Beja, A.; Alte da Veiga, L.
Very short F—H···F hydrogen bond in <small>L</small>-argininium fluoride hydrogen fluoride
Acta Crystallographica Section C, 2000, 56, 104-106
2010627 CIF
Paper		C21 H20 O8P 17.854; 9.384; 13.23
101.563; 103.699; 90.184		926.8Du Boulay, Douglas; Shaari, Khozirah; Skelton, Brian W.; Waterman, Peter G.; White, Allan H.
2β-Hydroxy-4'-demethyldesoxypodophyllotoxin
Acta Crystallographica Section C, 2000, 56, 199-200
2010686 CIF
Paper		C29 H31 N O3P 15.393; 9.13; 11.963
92.67; 95.02; 100.45		575.9Wang, Qiguang; Xie, Liang; Zhai, Jianjun
Tylophorine B benzene solvate
Acta Crystallographica Section C, 2000, 56, 197-198
2010710 CIF
Paper		C17 H17 Cl N2 OP 16.326; 31.465; 7.668
90.264; 95.891; 90.154		1518.21Lewis, Michael; Barnes, Charles L.; Glaser, Rainer
4-Chloroacetophenone [1-(4-methoxyphenyl)ethylidene]hydrazone
Acta Crystallographica Section C, 2000, 56, 393-396
2010852 CIF
HKL
Paper		C13 H15 N3 O7P 15.8046; 10.64; 12.9556
109.428; 102.416; 90.25		734.44Gallagher, John F.; Kenny, Peter T. M.; O`Donohoe, Michael
Intermolecular hydrogen bonding of the two independent molecules of <i>N</i>-3,5-dinitrobenzoyl-<small>L</small>-leucine
Acta Crystallographica Section C, 2000, 56, e157-e158
2010913 CIF
HKL
Paper		C13 H15 N O3P 15.8767; 9.9036; 10.4818
103.332; 99.759; 89.792		584.62Gallagher, John F.; Brady, Fiona
O—H···O, C—H···O and C—H···π~arene~ intermolecular interactions in (2<i>S</i>)-2-(1-oxo-1<i>H</i>-2,3-dihydroisoindol-2-yl)pentanoic acid and (2<i>S</i>)-3-methyl-2-(1-oxo-1<i>H</i>-2,3-dihydroisoindol-2-yl)butanoic acid
Acta Crystallographica Section C, 2000, 56, 619-622
2011007 CIF
HKL
Paper		C21 H35 N7 O18 P2P 18.592; 8.845; 11.192
109.64; 90.56; 103.92		773.7Guillot, Benoit; Jelsch, Christian; Lecomte, Claude
The oxidized form of nicotinamide adenine dinucleotide
Acta Crystallographica Section C, 2000, 56, 726-728
2011290 CIF
Paper		C27 H29 N O6 SP 18.319; 13.197; 5.75
100.84; 98.61; 89.43		612.9Suresh, Cheravakkattu G.; Ravindran, Bindu; Rao, K. Narasimha; Pathak, Tanmaya
Comparison of the two anomers of methyl 2-(<i>N</i>-benzylamino)-2,3-dideoxy-4,6-<i>O</i>-phenylmethylene-3-<i>C</i>-phenylsulfonyl-<small>D</small>-glucopyranoside
Acta Crystallographica Section C, 2000, 56, 1030-1032
2011590 CIF
HKL
Paper		C5 H7 Li N4 O4P 15.4017; 8.3903; 4.6325
102.237; 93.676; 104.154		197.46Okabe, Nobuo; Tsujita, Michihiro
<i>catena</i>-Poly[[diaqualithium(I)]-μ-[9<i>H</i>-purine-2,6(1<i>H</i>,3<i>H</i>)-dionato-<i>O</i>^2^:<i>N</i>^7^]]
Acta Crystallographica Section C, 2000, 56, 1418-1419
2011758 CIF
HKL
Paper		C33 H36 N6 O8P 110.328; 11.605; 14.796
70; 86.37; 76.19		1617.9Ejsmont, Krzysztof; Makowski, Maciej; Zaleski, Jacek
<i>N</i>-(<i>tert</i>-Butoxycarbonylglycyl-α,β-dehydrophenylalanylglycylphenylalanyl)-4-nitroaniline
Acta Crystallographica Section C, 2001, 57, 205-207
2011779 CIF
Paper		C7 H13 N O8P 15.0038; 6.442; 8.3179
78.6; 80.62; 79.8		256.39Krishnakumar, R. V.; Subha Nandhini, M.; Natarajan, S.
Sarcosinium tartrate
Acta Crystallographica Section C, 2001, 57, 165-166
2011961 CIF
Paper		C10 H13.5 N4 O3.75 SP 17.995; 9.261; 18.062
98.29; 94.47; 101.21		1290.4Mazumder, G.; De, M.; Mazumder, S. K.; Mukhopadhyay, A.; Das, A. K.; Van Aerschot, A.
9(<i>R</i>)-[6(<i>R</i>)-Hydroxymethyl-1-oxa-4-thiacyclohexan-2-yl]hypoxanthine–water (4/3), a nucleoside analogue
Acta Crystallographica Section C, 2001, 57, 560-561
2012076 CIF
Paper		C14 H29 N O13P 14.86; 7.603; 13.242
85.47; 84.06; 75.19		469.8Lakshmanan, Thiruneelakantan; Sriram, Desikan; Loganathan, Duraikannu
β-1-Acetamido-4-<i>O</i>-β-<small>D</small>-galactopyranosyl-<small>D</small>-glucopyranose dihydrate
Acta Crystallographica Section C, 2001, 57, 825-826
2012091 CIF
HKL
Paper		C5 H11 Cl2 N O2 Pt SP 17.265; 8.361; 8.885
74.95; 86.04; 77.87		509.49Llorca, Jordi; Molins, Elies; Espinosa, Enrique; Mata, Ignasi; Miravitlles, Carles; Cervantes, Gemma; Caubet, Amparo; Moreno, Virtudes
Dichloro(<small>D</small>-methionine-<i>N</i>,<i>S</i>)platinum(II) at 130K
Acta Crystallographica Section C, 2001, 57, 804-806
2012167 CIF
HKL
Paper		C31 H24 N9 OP 17.803; 15.353; 6.985
112.3; 74.44; 111.84		710.73Figgis, Brian N.; Sobolev, Alexandre N.; Kepert, Cameron J.; Kurmoo, Mohamedally
MEM(TCNQ)~2~ at room temperature and 10K, and the absence of a spin-Peierls transition
Acta Crystallographica Section C, 2001, 57, 991-993
2012168 CIF
HKL
Paper		C31 H24 N9 OP 17.773; 15.315; 6.8347
113.249; 73.569; 111.796		685.2Figgis, Brian N.; Sobolev, Alexandre N.; Kepert, Cameron J.; Kurmoo, Mohamedally
MEM(TCNQ)~2~ at room temperature and 10K, and the absence of a spin-Peierls transition
Acta Crystallographica Section C, 2001, 57, 991-993
2012756 CIF
HKL
Paper		C120 H140 N4 O32 ZnP 110.2643; 13.4878; 21.1227
86.2858; 77.9955; 73.932		2748.51Yael Diskin-Posner; Goutam Kumar Patra; Israel Goldberg
Hydrogen-bonded supramolecular lattice of the 1:3:4 complex between [5,10,15,20-<i>meso</i>-tetrakis(4-hydroxyphenyl)porphyrinato-κ^4^<i>N</i>]zinc(II), dibenzo-24-crown-8 and methanol
Acta Crystallographica Section C, 2002, 58, m344-m346
2012868 CIF
HKL
Paper		C16 H22 N2 O4 SP 15.207; 5.876; 15.339
82.21; 81.43; 72.17		439.8Breydo, Leonid; Barnes, Charles L.; Gates, Kent S.
Two (<i>E</i>,<i>E</i>)- and (<i>Z</i>,<i>E</i>)-thiazol-5-ylpenta-2,4-dienones
Acta Crystallographica Section C, 2002, 58, o447-o449
2012896 CIF
HKL
Paper		C58 H56 Cl2 F3 Fe N6 O7 SP 111.366; 14.4438; 17.6675
78.148; 87.016; 75.485		2748.01Kobeissi, Marwan; Toupet, Loic; Simonneaux, Gerard
(5,10,15,20-Tetraphenylporphyrinato-κ^4^<i>N</i>)bis(<small>L</small>-valine-κ<i>N</i> methyl ester)iron(III) trifluoromethylsulfonate dichloromethane solvate
Acta Crystallographica Section C, 2002, 58, m443-m444
2012974 CIF
HKL
Paper		C11 H16 N O5.5P 16.0193; 8.2285; 12.5811
82.545; 86; 89.752		616.36Hu, Zi-Qiang; Xu, Duan-Jun; Xu, Yuan-Zhi; Wu, Jing-Yun; Chiang, Michael Y.
(<i>R</i>)-Mandelic acid (<i>S</i>)-alanine hemihydrate
Acta Crystallographica Section C, 2002, 58, o612-o614
2013051 CIF
HKL
Paper		C24 H38 N16 O15P 16.9588; 7.1984; 17.4239
101.181; 98.559; 95.36		839.95Glidewell, Christopher; Low, John N.; Marchal, Antonio; Melguizo, Manuel; Quesada, Antonio
2-Amino-4,6-dimethoxy-5-nitrosopyrimidine–water (4/3): seven independent molecular components are linked into a three-dimensional framework by six three-centre and eight two-centre hydrogen bonds
Acta Crystallographica Section C, 2002, 58, o655-o657
2013096 CIF
HKL
Paper		C20 H27 Cl3 O11P 18.2962; 9.4622; 9.9471
61.6508; 69.969; 71.4651		634.15Linden, Anthony; Muhammad Sofian, A. S.; Lee, C. Kuan
2,3,3',6-Tetra-<i>O</i>-acetyl-4,1',6'-trichloro-4,1',4',6'-tetradeoxygalactosucrose
Acta Crystallographica Section C, 2002, 58, o718-o720
2013162 CIF
HKL
Paper		C15 H26 Br2 N2 ZnP 17.4715; 7.7082; 9.1435
97.429; 112.808; 110.666		432.02Alcántara-Flores, José Luis; Bernès, Sylvain; Reyes-Ortega, Yasmi; Zamorano-Ulloa, Rafael
The triclinic polymorph of dibromo[(‒)-sparteine-κ^2^<i>N</i>,<i>N</i>']zinc(II)
Acta Crystallographica Section C, 2003, 59, m79-m81
2013225 CIF
HKL
Paper		C61 H98 O18P 110.4353; 10.4491; 14.876
92.412; 101.471; 109.599		1487.14Suchada Chantrapromma; Anwar Usman; Hoong-Kun Fun; Surat Laphookhieo; Chatchanok Karalai; Yanisa Rat-a-pa; Kan Chantrapromma
Bis[14β-hydroxy-3β-<i>O</i>-(<small>L</small>-thevetosyl)-5β-card-20(22)-enolide] methanol solvate monohydrate and 3β-<i>O</i>-(<small>L</small>-2'-<i>o</i>-acetylthevetosyl)-14β-hydroxy-5β-card-20(22)-enolide
Acta Crystallographica Section C, 2003, 59, o68-o70
2013366 CIF
HKL
Paper		C32 H41 N11 O8P 18.8183; 9.6999; 10.4089
86.787; 86.377; 78.798		870.76Glidewell, Christopher; Low, John N.; Melguizo, Manuel; Quesada, Antonio
(<i>R</i>)-1-Phenylethylammonium 6-amino-5-nitropyrimidine-2,4(1<i>H</i>,3<i>H</i>)-dionate (<i>R</i>)-1-phenylethylamine hemisolvate: hydrogen-bonded sheets of ions with pendent solvent molecules
Acta Crystallographica Section C, 2003, 59, o240-o243
2013369 CIF
HKL
Paper		C22 H50 N4 O7P 18.6559; 9.3275; 10.1044
113.379; 108.908; 100.345		662.32Bowes, Katharine F.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher
<i>meso</i>-5,5,7,12,12,14-Hexamethyl-4,11-diaza-1,8-diazoniacyclotetradecane (<i>S</i>)-malate(2–) methanol disolvate: a chain of rings generated by two pairs of N—H···O hydrogen bonds
Acta Crystallographica Section C, 2003, 59, o329-o331
2013520 CIF
Paper		C5 H6 Ba Fe N6 O4P 119.01; 7.694; 8.72
90.04; 90.003; 89.994		1275G. Chevrier; J.M. Kiat; J. Guida; A. Navaza
An ordered low-temperature phase of barium nitroprusside trihydrate studied by neutron diffraction
Acta Crystallographica Section C, 2003, 59, i59-i62
2013645 CIF
HKL
Paper		C13 H14 B N3 OP 16.71; 6.767; 8.059
71.51; 84.68; 70.16		326.4Yongkwan Dong; Hoseop Yun; Chan Sun Park; Won Koo Lee; Hyun-Joon Ha
Dicyano{[(1<i>S</i>)-(1-phenylethyl)aziridin-2-yl]methanolato-κ^2^<i>N</i>,<i>O</i>}boron
Acta Crystallographica Section C, 2003, 59, o659-o660
2013724 CIF
Paper		C24 H25 N O7P 110.16; 10.785; 11.942
66.369; 75.928; 72.005		1129.4Akkurt, Mehmet; Öztürk, Sema; Üngören, Hakan; Saçmacı, Mustafa; Fun, Hoong-Kun; Akçamur, Yunus
Methyl (±)-1-ethyl-2-hydroxy-4-(4-methoxybenzoyl)-5-(4-methoxyphenyl)-3-oxo-2,3-dihydro-1<i>H</i>-pyrrole-2-acetate
Acta Crystallographica Section C, 2003, 59, o598-o600
2013885 CIF
Paper		C5 H6 Ba Fe N6 O4P 137.91; 7.694; 8.705
90.03; 90.086; 90.146		2539Chevrier, G.; Kiat, J. M.; Güida, J. A.; Navaza, A.
A new crystal phase of barium nitroprusside trihydrate studied by neutron diffraction at 20K
Acta Crystallographica Section C, 2004, 60, i27-i29
2013889 CIF
HKL
Paper		C9 H15 N O2P 15.076; 10.076; 10.121
95.691; 102.529; 103.73		484.65Didierjean, Claude; Marin, Julien; Wenger, Emmanuel; Briand, Jean-Paul; Aubry, Andre; Guichard, Gilles
(6<i>S</i>)-6-Isobutylpiperidine-2,4-dione and (4<i>R</i>,6<i>S</i>)/(4<i>S</i>,6<i>S</i>)-4-hydroxy-6-isobutylpiperidin-2-one
Acta Crystallographica Section C, 2004, 60, o204-o207
2013893 CIF
HKL
Paper		C17 H18 Cl Cu N3 O5P 18.3022; 10.0591; 12.393
66.73; 72.047; 68.828		869.9Lu, Li-Ping; Zhu, Miao-Li; Yang, Pin
Chloro(<small>L</small>-glutamato-κ^2^<i>N</i>,<i>O</i>)(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) monohydrate
Acta Crystallographica Section C, 2004, 60, m21-m23
2013939 CIF
HKL
Paper		C42 H92 Li4 N14 Si4P 19.4773; 10.8506; 15.437
100.075; 104.7; 105.896		1424.9Hu, Jing-Hua; Tong, Hong-Bo; Li, Jian-Feng; Huang, Shu-Ping; Liu, Dian-Sheng
(1<i>R</i>,2<i>R</i>)-(‒)-Bis[μ~4~-1-{[1,1-dimethyl-2-(trimethylsilyl)amidino]amino}-2-({1,1-dimethyl-2-[1,1-dimethyl-2-(trimethylsilyl)amidino]amidino}amino)cyclohexane]tetralithium(I)
Acta Crystallographica Section C, 2004, 60, m272-m274
2014064 CIF
HKL
Paper		C25.5 H32 F N3 O1.5P 16.8086; 10.5682; 32.5223
80.7761; 87.7492; 74.1122		2221.61Thamotharan, S.; Parthasarathi, V.; Gupta, Ranju; Jindal, D. P.; Linden, Anthony
2'-(4-Fluorophenyl)-[1,2,3]triazolo[4',5':16,17]androst-5-en-3β-ol methanol hemisolvate
Acta Crystallographica Section C, 2004, 60, o405-o407
2014263 CIF
HKL
Paper		C23 H32 O4P 16.0335; 9.4122; 18.7857
81.175; 89.271; 80.703		1040.26Castro, Ernesto; Cuca Suarez, Luis E.; Siengalewicz, Peter; Gutmann, Rene; Czermak, Georg; Brueggeller, Peter
3,6-Dihydroxy-2-(11-phenylundecanoyl)cyclohex-2-en-1-one from <i>Virola venosa</i> bark
Acta Crystallographica Section C, 2004, 60, o467-o469
2014633 CIF
HKL
Paper		C15 H18 N2 O2P 16.2384; 9.8255; 12.5432
69.344; 78.054; 79.396		698.64Bagaria, A.; Ramakumar, S.; Gupta, M.; Chauhan, V. S.
Cyclo(<small>L</small>-leucyl-α,β-dehydrophenylalanine): the first diketopiperazine containing an α,β-dehydrophenylalanine residue
Acta Crystallographica Section C, 2005, 61, o174-o176
2014757 CIF
HKL
Paper		C26 H41.5 N2 O12.75P 19.308; 9.578; 16.13
77.21; 87.36; 81.57		1387.1Białońska, Agata; Ciunik, Zbigniew; Popek, Tomasz; Lis, Tadeusz
Cyclic water pentamers in triclinic crystals of brucinium <small>L</small>-glycerate
Acta Crystallographica Section C, 2005, 61, o88-o91
2015083 CIF
HKL
Paper		C13 H21 Na O4P 15.7767; 6.0835; 23.88
83.151; 86.482; 61.612		733.01Zhang, Yue-Gang; Grant, David J. W.
Similarity in structures of racemic and enantiomeric ibuprofen sodium dihydrates
Acta Crystallographica Section C, 2005, 61, m435-m438
2015151 CIF
HKL
Paper		C16 H18 N4 O4P 19.3587; 10.3445; 16.925
92.079; 95.775; 95.245		1621.7Doi, Mitsunobu; Nakamoto, Yasuhiko; Asano, Akiko
Cytosine-containing hybrid dipeptides: <i>N</i>-[2-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)propionyl]-<small>L</small>-phenylalanine <i>N</i>-[2-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)propionyl]-<small>L</small>-serine monohydrate and <i>N</i>-[2-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)propionyl]-<small>L</small>-lysine
Acta Crystallographica Section C, 2005, 61, o577-o582
2015152 CIF
HKL
Paper		C10 H16 N4 O6P 14.863; 10.771; 12.228
80.45; 89.23; 88.61		631.4Doi, Mitsunobu; Nakamoto, Yasuhiko; Asano, Akiko
Cytosine-containing hybrid dipeptides: <i>N</i>-[2-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)propionyl]-<small>L</small>-phenylalanine <i>N</i>-[2-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)propionyl]-<small>L</small>-serine monohydrate and <i>N</i>-[2-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)propionyl]-<small>L</small>-lysine
Acta Crystallographica Section C, 2005, 61, o577-o582
2015153 CIF
HKL
Paper		C13 H21 N5 O4P 16.9334; 8.2977; 13.2491
90.78; 93.498; 107.293		726.02Doi, Mitsunobu; Nakamoto, Yasuhiko; Asano, Akiko
Cytosine-containing hybrid dipeptides: <i>N</i>-[2-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)propionyl]-<small>L</small>-phenylalanine <i>N</i>-[2-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)propionyl]-<small>L</small>-serine monohydrate and <i>N</i>-[2-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)propionyl]-<small>L</small>-lysine
Acta Crystallographica Section C, 2005, 61, o577-o582
2015221 CIF
HKL
Paper		C29 H40 N2 O14P 19.2355; 9.6894; 17.1446
75.775; 80.917; 81.553		1459.1Graham Smith; Urs D. Wermuth; Jonathan M. White
Hydrogen bonding in brucinium dihydrogen citrate trihydrate at 130 K
Acta Crystallographica Section C, 2005, 61, o621-o624
2015336 CIF
HKL
Paper		C30 H39 N3 O7P 16.2705; 9.7577; 13.2491
106.648; 94.2733; 105.726		737.36Linden, Anthony; Pradeille, Nicolas; Heimgartner, Heinz
Di- and tripeptide segments of zervamicin II-2: Z-Thr(OBn)-Aib-N(Me)Ph and Z-Val-Aib-Hyp(OBn)-OMe
Acta Crystallographica Section C, 2006, 62, o249-o252
2015372 CIF
HKL
Paper		C27 H42 N2 O14P 19.2915; 9.4337; 16.9287
76.401; 88.716; 82.104		1428.5Graham Smith; Urs D. Wermuth; Jonathan M. White
Brucine salts of <small>L</small>-α-hydroxy acids: brucinium hydrogen (<i>S</i>)-malate pentahydrate and anhydrous brucinium hydrogen (2<i>R</i>,3<i>R</i>)-tartrate at 130K
Acta Crystallographica Section C, 2006, 62, o353-o357
2015565 CIF
HKL
Paper		C22 H31 N3 O7P 15.8816; 10.6294; 19.707
75.24; 82.56; 81.78		1173.56Mitsunobu Doi; Kumiko Imori; Noriko Sakaguchi; Akiko Asano
Boc–Pro–Hyp–Gly–OBzl and Boc–Ala–Hyp–Gly–OBzl, two repeating triplets found in collagen
Acta Crystallographica Section C, 2006, 62, o577-o580
2015703 CIF
HKL
Paper		C24 H20 N2 O10P 14.973; 10.446; 11.655
100.95; 98.903; 106.388		556.2Graham Smith; Urs D. Wermuth; Jonathan M. White
Proton-transfer and non-transfer in compounds of quinoline and quinaldic acid with <small>L</small>-tartaric acid
Acta Crystallographica Section C, 2006, 62, o694-o698
2015731 CIF
HKL
Paper		C12 H15 N3 O4P 18.3908; 9.0698; 9.7303
64.734; 71.721; 88.198		631.33Seela, Frank; Budow, Simone; Eickmeier, Henning; Reuter, Hans
2'-Deoxy-5-propynylcytidine: a nucleoside forming two solid-state conformations
Acta Crystallographica Section C, 2007, 63, o54-o57
2015749 CIF
HKL
Paper		C14 H22.8 N4 O14.4P 14.81; 10.776; 10.8756
69.325; 85.792; 81.946		522.03R. Chitra; Vijay Thiruvenkatam; R. R. Choudhury; M. V. Hosur; T. N. Guru Row
Conformation and structure of bis(glycyl-<small>L</small>-aspartic acid) oxalate 0.4-hydrate
Acta Crystallographica Section C, 2007, 63, o11-o13
2015958 CIF
HKL
Paper		C7 H8 Cd O9P 15.3262; 6.2885; 8.1008
97.733; 105.055; 110.436		237.795Yasodha, Vaduganathan; Govindarajan, Subbaiah; Low, John N.; Glidewell, Christopher
Cationic, neutral and anionic metal(II) complexes derived from 4-oxo-4<i>H</i>-pyran-2,6-dicarboxylic acid (chelidonic acid)
Acta Crystallographica Section C, 2007, 63, m207-m215
2016059 CIF
HKL
Paper		C100 H123 N7 O18P 17.6005; 15.6609; 18.6149
77.718; 89.63; 78.805		2122.4Sankar Muniappan; Sophia Lipstman; Israel Goldberg
Hydrogen-bonded assemblies of 20-(4-pyridyl)porphyrin-5^4^,10^4^,15^4^-tribenzoic acid with dimethyl sulfoxide and 4-acetylpyridine in their dimethyl sulfoxide and tetrahydrofuran solvates
Acta Crystallographica Section C, 2007, 63, o395-o399
2016158 CIF
HKL
Paper		C10 H19 N O6P 15.2767; 5.5375; 10.2809
104.598; 90.393; 104.834		280.2Rodríguez, Ricaurte; Cobo, Justo; Nogueras, Manuel; Low, John N.; Glidewell, Christopher
Hydrogen-bonded sheets of <i>R</i>~2~^2^(10) and <i>R</i>~4~^4^(24) rings in 1-deoxy-1-morpholino-<small>D</small>-fructopyranose
Acta Crystallographica Section C, 2007, 63, o507-o509
2016161 CIF
HKL
Paper		C32 H34 O11 SP 111.5241; 11.6958; 12.453
80.499; 62.449; 75.937		1440.8K. Manoj; R. G. Gonnade; M. M. Bhadbhade; M. S. Shashidhar
Different interaction motifs of dipolar S=O···C=O contacts that associate diastereomers of 2,4(6)-di-<i>O</i>-benzoyl-6(4)-<i>O</i>-{[(1<i>S</i>)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-ylmethyl]sulfonyl}-<i>myo</i>-inositol 1,3,5-orthoacetate
Acta Crystallographica Section C, 2007, 63, o555-o558
2016162 CIF
HKL
Paper		C10 H12 N4 O5 SP 15.2347; 7.1855; 8.9972
110.756; 96.827; 99.511		306.28Seela, Frank; Ming, Xin; Budow, Simone; Eickmeier, Henning; Reuter, Hans
2'-Deoxyimmunosine: a thiazolo[4,5-<i>d</i>]pyrimidine nucleoside adopting the <i>syn</i> conformation
Acta Crystallographica Section C, 2007, 63, o549-o551
2016467 CIF
HKL
Paper		C15 H10 Cl N3P 14.6904; 5.9498; 11.4426
98.361; 93.317; 96.823		312.78Ojala, Charles R.; Ojala, William H.; Britton, Doyle
4-(4-Chlorobenzylidenehydrazonomethyl)benzonitrile and the bromo and iodo analogs
Acta Crystallographica Section C, 2008, 64, o37-o40
2016468 CIF
HKL
Paper		C15 H10 Br N3P 14.6963; 6.0023; 11.585
99.493; 93.767; 96.629		318.74Ojala, Charles R.; Ojala, William H.; Britton, Doyle
4-(4-Chlorobenzylidenehydrazonomethyl)benzonitrile and the bromo and iodo analogs
Acta Crystallographica Section C, 2008, 64, o37-o40
2016469 CIF
HKL
Paper		C15 H10 I N3P 14.7165; 6.1524; 11.9054
101.271; 94.588; 96.038		335.13Ojala, Charles R.; Ojala, William H.; Britton, Doyle
4-(4-Chlorobenzylidenehydrazonomethyl)benzonitrile and the bromo and iodo analogs
Acta Crystallographica Section C, 2008, 64, o37-o40
2016490 CIF
HKL
Paper		C7 H15 N3 O6P 14.7547; 7.5121; 8.5626
115.691; 90.266; 104.957		263.87Görbitz, Carl Henrik; Hartviksen, Lars Male
The monohydrates of the four polar dipeptides <small>L</small>-seryl-<small>L</small>-asparagine, <small>L</small>-seryl-<small>L</small>-tyrosine, <small>L</small>-tryptophanyl-<small>L</small>-serine and <small>L</small>-tyrosyl-<small>L</small>-tryptophan
Acta Crystallographica Section C, 2008, 64, o171-o176
2016960 CIF
HKL
Paper		C20 H21 Cl N2 O2 SP 18.23; 10.927; 11.633
103.9; 106.62; 96.94		952.7Kiefer, Lionel; Dauban, Philippe; Dodd, Robert H.; Retailleau, Pascal
Two enantiomerically pure cyclic arenesulfonamide hydrochloride salts
Acta Crystallographica Section C, 2009, 65, o46-o50
2017146 CIF
HKL
Paper		C15 H24 N2 O4P 15.2317; 5.4232; 14.459
85.936; 85.343; 70.424		384.83Görbitz, Carl Henrik; Rissanen, Kari; Valkonen, Arto; Husabø, Åsmund
Molecular aggregation in selected crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. IV. The <small>L</small>-phenylalanine series
Acta Crystallographica Section C, 2009, 65, o267-o272
2017252 CIF
HKL
Paper		C5 H6 F6 O2P 14.9343; 6.8918; 11.342
81.943; 85.847; 86.529		380.39Ha, Jeong-Myeong; Young, Victor
Enantiotropic phase transition and twinning in 2,2,3,3,4,4-hexafluoropentane-1,5-diol
Acta Crystallographica Section C, 2009, 65, o388-o395
2017253 CIF
HKL
Paper		C5 H6 F6 O2P 14.8848; 6.8723; 11.259
82.261; 84.711; 85.64		372.15Ha, Jeong-Myeong; Young, Victor
Enantiotropic phase transition and twinning in 2,2,3,3,4,4-hexafluoropentane-1,5-diol
Acta Crystallographica Section C, 2009, 65, o388-o395
2017254 CIF
HKL
Paper		C5 H6 F6 O2P 14.8641; 5.738; 13.325
82.814; 87.274; 86.435		367.97Ha, Jeong-Myeong; Young, Victor
Enantiotropic phase transition and twinning in 2,2,3,3,4,4-hexafluoropentane-1,5-diol
Acta Crystallographica Section C, 2009, 65, o388-o395
2017255 CIF
HKL
Paper		C5 H6 F6 O2P 14.9215; 6.871; 11.314
81.973; 85.839; 86.562		377.4Ha, Jeong-Myeong; Young, Victor
Enantiotropic phase transition and twinning in 2,2,3,3,4,4-hexafluoropentane-1,5-diol
Acta Crystallographica Section C, 2009, 65, o388-o395
2017257 CIF
HKL
Paper		C16 H15 N O2P 18.593; 9.761; 10.054
93.32; 114.45; 113.75		676.6Bakowicz, Julia; Turowska-Tyrk, Ilona
2-Oxo-2-phenyl-<i>N</i>-[(<i>R</i>)-1-phenylethyl]acetamide and <i>N</i>,<i>N</i>-dimethyl-2-(1-naphthyl)-2-oxoacetamide: possibility of Yang photocyclization in a crystal
Acta Crystallographica Section C, 2009, 65, o377-o380
2017576 CIF
HKL
Paper		C12 H24 N4 Na O11.5P 17.662; 10.488; 11.606
98.24; 91.07; 98.49		912.1Gainsford, Graeme J.; Furneaux, Richard H.; Tyler, Peter C.; Sauve, Anthony; Shramm, Vern L.
A synchrotron radiation study of the one-dimensional complex of sodium with (1<i>S</i>)-<i>N</i>-carboxylato-1-(9-deazaadenin-9-yl)-1,4-dideoxy-1,4-imino-<small>D</small>-ribitol, a member of the 'immucillin' family
Acta Crystallographica Section C, 2010, 66, m65-m68
2017702 CIF
HKL
Paper		C16 H17 N3 O6P 16.171; 7.4134; 18.2438
91.754; 91.308; 108.135		792.33Smith, Graham; Wermuth, Urs D.; Young, David J.
Phenyl-ring rotational disorder in the two-dimensional hydrogen-bonded structure of the 1:1 proton-transfer salt of the diazo-dye precursor 4-(phenyldiazenyl)aniline (aniline yellow) with <small>L</small>-tartaric acid
Acta Crystallographica Section C, 2010, 66, o345-o348
2018090 CIF
HKL
Paper		C43 H80 Cr K2 N6 O17P 111.034; 11.741; 12.818
63.883; 66.841; 86.82		1356.9Zhai, Jun; Xu, Li
The pentacoordinated [Cr(CO)~5~]^2{-^} dianion in [2,2,2-crypt-K]~2~[Cr(CO)~5~] ethylenediamine monosolvate
Acta Crystallographica Section C, 2011, 67, m202-m204
2018561 CIF
HKL
Paper		C17 H19 N O2 SP 19.0244; 9.7278; 9.7492
92.9699; 107.457; 107.551		768.85Frøstrup, Brian; Peters, Dan; Bond, Andrew D.
Enantiomerically pure (1<i>S</i>,5<i>R</i>) and racemic 3-(1-benzothiophen-2-yl)-8-azoniabicyclo[3.2.1]oct-2-ene acetate
Acta Crystallographica Section C, 2012, 68, o298-o301
2018585 CIF
HKL
Paper		C18.5 H20 Cl N2 O0.5 PdP 111.9699; 12.3754; 12.4793
104.369; 95.465; 95.802		1767.6Raven, William; Kalf, Irmgard; Englert, Ulli
Pseudosymmetry in a cyclopalladated compound
Acta Crystallographica Section C, 2012, 68, m223-m225
2018630 CIF
HKL
Paper		C11 H13 N3 O4P 17.8754; 8.1504; 10.0893
108.637; 96.327; 104.562		580.98Seela, Frank; Mei, Hui; Xiong, Hai; Budow, Simone; Eickmeier, Henning; Reuter, Hans
5-Ethynyl-2'-deoxycytidine: a DNA building block with a `clickable' side chain
Acta Crystallographica Section C, 2012, 68, o395-o398
2018686 CIF
Paper		C20 H38 Co3 N4 O23 S3P 17.286; 11.246; 11.462
72.21; 73.57; 83.5		857.4Zhong, Kai-Long; Qian, Ming-Yi
A novel one-dimensional Co^II^ coordination polymer: <i>catena</i>-poly[[hexaaquacobalt(II)] [[diaquabis(sulfato-κ<i>O</i>)cobalt(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] [[triaqua(sulfato-κ<i>O</i>)cobalt(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>']]
Acta Crystallographica Section C, 2012, 68, m265-m268
2018728 CIF
HKL
Paper		C11 H20 N2 O3P 16.006; 6.8782; 7.9717
90.202; 98.272; 107.193		310.96Kiyotani, Tamiko; Sugawara, Yoko
<small>L</small>-Leucylglycine 0.67-hydrate and [(4<i>S</i>)-2,2-dimethyl-4-(2-methylpropyl)-5-oxoimidazolidin-3-ium-1-yl]acetate
Acta Crystallographica Section C, 2012, 68, o498-o501
2018854 CIFC10 H17 Au Br4 N4 O7P 17.43; 8.272; 8.768
98.96; 108.02; 94.56		501.5Juan M. Salas; Miguel Quirós; M. Purificación Sánchez; André L. Beauchamp
Structure of Inosinium Tetrabromoaurate(III) Dihydrate
Acta Crystallographica, Section C, 1989, 45, 1874-1877
2018961 CIF
HKL
Paper		C18 H21 N5 O2P 18.4528; 8.5689; 12.4424
87.84; 72.284; 87.368		857.31Gelbrich, Thomas; Kahlenberg, Volker; Griesser, Ulrich J.
Alogliptin and its benzoate salt
Acta Crystallographica Section C, 2013, 69, 674-678
2019251 CIF
Paper		C16 H20 Na2 O12 SP 18.098; 8.382; 15.291
75.492; 87.242; 86.712		1002.6Huang, Qiu-Ying; Liu, Chun-Li; Zhou, Zi-Peng
Two sodium(I) coordination polymers constructed by the V-shaped ligands 2,2'-[isopropylidenebis(1,4-phenyleneoxy)]diacetic acid and 2,2'-[sulfonylbis(1,4-phenyleneoxy)]diacetic acid
Acta Crystallographica Section C, 2013, 69, 1322-1327
2019596 CIF
HKL
Paper		C4 H8 Cl N O4P 15.5888; 5.6045; 6.1697
114.57; 97.752; 95.72		171.52Benali-Cherif, Rim; Takouachet, Radhwane; Bendeif, El-Eulmi; Benali-Cherif, Nourredine
A comparative study of two polymorphs of <small>L</small>-aspartic acid hydrochloride
Acta Crystallographica Section C, 2014, 70, 689-692
2019717 CIF
HKL
Paper		C15 H22 O3P 16.6766; 7.1292; 16.0995
78.423; 84.663; 65.46		682.87Paz Robles, Cristian; Mercado, Darío; Suarez, Sebastián; Baggio, Ricardo
Two drimane lactones, valdiviolide and 11-epivaldiviolide, in the form of a 1:1 cocrystal obtained from <i>Drimys winteri</i> extracts
Acta Crystallographica Section C, 2014, 70
2020076 CIF
HKL
Paper		C47 H41 N O3P 19.1196; 9.5474; 11.992
105.682; 90.853; 117.642		878.39Klien, Hendrik; Seichter, Wilhelm; Skobridis, Konstantinos; Weber, Edwin
Two terphenyl-based diol hosts and corresponding solvent inclusions with dimethylformamide and acetonitrile
Acta Crystallographica Section C, 2015, 71
2020110 CIF
HKL
Paper		C9 H14 Cl NP 15.6396; 16.3917; 16.9602
69.427; 89.995; 87.286		1465.98Dennany, Lynn; Kennedy, Alan R.; Walker, Brandon
The hydrochloride and hydrobromide salt forms of (S)-amphetamine
Acta Crystallographica Section C Structural Chemistry, 2015, 71
2020298 CIF
HKL
Paper		C27 H32 Cl2 O7P 17.2367; 8.4193; 11.7507
73.617; 85.522; 69.492		643.17Müller, Peter
Mometasone furoate revisited, or how did the hydrate get in the bottle?
Acta Crystallographica Section C, 2015, 71
2020528 CIF
HKL
Paper		C9 H20 N2 O4 S4P 19.489; 9.8774; 15.079
71.429; 75.65; 89.369		1294.4Görbitz, Carl Henrik; Wragg, David S.; Bakke, Ingrid Marie Bergh; Fleischer, Christian; Grønnevik, Gaute; Mykland, Maria; Park, Yoomin; Trovik, Kristian Wiedicke; Serigstad, Halvard; Sundsli, Bård Edgar Vestheim
A phase transition from monoclinic <i>C</i>2 with <i>Z</i>' = 1 to triclinic <i>P</i>1 with <i>Z</i>' = 4 for the quasiracemate <small>L</small>-2-aminobutyric acid‒<small>D</small>-methionine (1/1)
Acta Crystallographica Section C, 2016, 72, 536-543
2020737 CIF
HKL
Paper		C30 H18 N4 SP 18.3617; 8.7261; 8.859
104.451; 94.187; 112.344		568.69Averkiev, Boris B.; Davydenko, Iryna; Wang, Xu; Barlow, Stephen; Marder, Seth R.
Crystal structure of 5,6-bis(9<i>H</i>-carbazol-9-yl)benzo[<i>c</i>][1,2,5]thiadiazole: distortion from a hypothetical higher-symmetry structure
Acta Crystallographica Section C, 2017, 73, 319-324
2020807 CIF
HKL
Paper		C25.5 H29 Cl N2 O3P 110.1501; 14.8556; 17.662
109.248; 97.929; 91.214		2483.9Kramer, Philipp; Bolte, Michael
Synthesis and crystal structures of two structurally related kryptoracemates
Acta Crystallographica Section C, 2017, 73, 575-581
2020997 CIF
HKL
Paper		C17 H20 N5 O3.5P 17.3991; 10.637; 11.931
93.65; 107.37; 108.11		839Ardhapure, Ajaykumar V.; Sanghvi, Yogesh S.; Borozdina, Yulia; Kapdi, Anant Ramakant; Schulzke, Carola
Crystal structure of 8-(4-methylphenyl)-2'-deoxyadenosine hemihydrate
Acta Crystallographica Section E, 2018, 74, 1-5
2021094 CIF
HKL
Paper		C23 H24 F2 N3 O2 PP 19.7608; 10.6134; 11.2721
77.398; 75.589; 87.635		1103.64Eghbali Toularoud, Mahsa; Pourayoubi, Mehrdad; Dušek, Michal; Eigner, Václav; Damodaran, Krishnan
Chiral one-dimensional hydrogen-bonded architectures constructed from single-enantiomer phosphoric triamides
Acta Crystallographica Section C, 2018, 74, 608-617
2021095 CIF
HKL
Paper		C23 H24 F2 N3 O2 PP 19.7524; 10.6117; 11.251
77.3381; 75.6221; 87.7313		1100.33Eghbali Toularoud, Mahsa; Pourayoubi, Mehrdad; Dušek, Michal; Eigner, Václav; Damodaran, Krishnan
Chiral one-dimensional hydrogen-bonded architectures constructed from single-enantiomer phosphoric triamides
Acta Crystallographica Section C, 2018, 74, 608-617
2021133 CIF
HKL
Paper		C24 H31 N O6P 19.5552; 10.3175; 11.9645
91.085; 110.515; 93.998		1100.85Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D.
Cocrystals of the antimalarial drug 11-azaartemisinin with three alkenoic acids of 1:1 or 2:1 stoichiometry
Acta Crystallographica Section C, 2018, 74
2021194 CIF
HKL
Paper		C13 H22 N O2 P SP 18.4954; 8.679; 10.7105
100.366; 100.314; 90.093		763.79Torabi Farkhani, Elham; Pourayoubi, Mehrdad; Izadyar, Mohammad; Andreev, Pavel V.; Shchegravina, Ekaterina S.
Evaluation of N—H···S and N—H···π interactions in <i>O</i>,<i>O</i>'-diethyl <i>N</i>-(2,4,6-trimethylphenyl)thiophosphate: a combination of X-ray crystallographic and theoretical studies
Acta Crystallographica Section C, 2018, 74, 847-855
2021283 CIF
HKL
Paper		C22 H30 I4 N4 O2P 17.5105; 7.5353; 13.8994
79.612; 75.806; 61.115		665.96Owczarzak, Agata; Przybył, Anna K.; Kubicki, Maciej
Different cationic forms of (–)-cytisine in the crystal structures of its simple inorganic salts
Acta Crystallographica Section C, 2018, 74
2021341 CIF
HKL
Paper		C30 H32 N2 O6 P2P 110.2789; 10.8253; 15.02
101.229; 105.716; 109.782		1436.22Vahdani Alviri, Banafsheh; Pourayoubi, Mehrdad; Farhadipour, Abolghasem; Nečas, Marek; Bertolasi, Valerio
A combined X-ray crystallography and theoretical study of N—H···O<i>X</i> (<i>X</i> is =P and —C) hydrogen bonds in two new structures with a (C—O)~2~(N)P(=<i>Y</i>) (<i>Y</i> is O and S) skeleton
Acta Crystallographica Section C, 2018, 74
2021349 CIF
HKL		C34 H34 N4P 17.727; 8.9264; 10.491
97.989; 96.215; 106.294		679.5Dwivedi, Bhavna; Das, Dinabandhu
Polymorphism in some new bis-hydrazone compounds
Acta Crystallographica Section C, 2018, 74
2021764 CIF
HKL
Paper		C65.89 H107.18 N10 O12.7P 114.4354; 14.4617; 28.6558
93.284; 101.441; 113.33		5322.26Asano, Akiko; Matsuoka, Shiori; Minami, Chisato; Kato, Takuma; Doi, Mitsinobu
[Leu^2^]Gramicidin S preserves the structural properties of its parent peptide and forms helically aligned β-sheets
Acta Crystallographica Section C, 2019, 75
2021971 CIF
HKL
Paper		C21 H40 O3P 16.1728; 12.3721; 13.6788
84.302; 80.846; 80.909		1015.45Bibi, Memoona; Choudhary, M. Iqbal; Yousuf, Sammer
Crystal structure and Hirshfeld surface analysis of the methanol solvate of sclareol, a labdane-type diterpenoid
Acta Crystallographica Section E Crystallographic Communications, 2020, 76, 294
2022027 CIFC6 H18 Cl2 N2 O4P 15.4491; 7.3962; 8.1337
79.382; 73.191; 69.544		292.75Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022127 CIF
HKL
Paper		C49.25 H44 N O7.25P 19.738; 9.9295; 10.803
75.924; 79.438; 86.77		995.97Zhao, Yong-Jin; Ma, Jian-Ping; Fan, Jianzhong; Geng, Yan; Dong, Yu-Bin
Syntheses and structures of two novel fluorescent metal‒organic frameworks generated from a tridentate donor‒acceptor motif ligand
Acta Crystallographica Section C, 2020, 76
2022591 CIF
Paper		Ca10.974 O27.64 P6.012P 19.449; 9.449; 6.908
90; 90; 120		534.14Arnold, Emily L.; Keeble, Dean S.; Evans, J. P. O.; Greenwood, Charlene; Rogers, Keith D.
Investigating pair distribution function use in analysis of nanocrystalline hydroxyapatite and carbonate-substituted hydroxyapatite
Acta Crystallographica Section C, 2022, 78
2022683 CIF
HKL
Paper		C18 H26 O6P 19.4726; 10.3; 15.3583
73.378; 88.382; 86.4		1432.94Mohammed, Adnan I.; Bhadbhade, Mohan M.; Read, Roger W.
3,4-Bis-<i>O</i>-propargyl-1,2:5,6-di-<i>O</i>-isopropylidene-<small>D</small>-mannitol: a study of multiple weak hydrogen bonds in the solid state
Acta Crystallographica Section C, 2022, 78
2023140 CIF
Paper		C19 H17 N O5 SP 15.526; 8.5012; 10.1076
110.91; 98.128; 96.006		432.885Naghiyev, Farid N.; Khrustalev, Victor N.; Akkurt, Mehmet; Huseynov, Elnur Z.; Bhattarai, Ajaya; Khalilov, Ali N.; Mamedov, İbrahim G.
Crystal structure and Hirshfeld surface analysis of dimethyl 2-oxo-4-(pyridin-2-yl)-6-(thiophen-2-yl)cyclohex-3-ene-1,3-dicarboxylate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023312 CIF
Paper		C44 H42 N2 Ni O4P 110.583; 12.411; 13.9837
94.352; 100.599; 90.584		1799.61Ito, Masataka; Chikaraishi Kasuga, Noriko; Matsuse, Ryo; Hirotsu, Masakazu
Crystal structures and circular dichroism of {2,2′-[(1S,2S)-1,2-diphenylethane-1,2-diylbis(nitrilophenylmethanylylidene)]diphenolato}nickel(II) and its ethanol solvate
Acta Crystallographica Section E Crystallographic Communications, 2024, 80
2023460 CIFC37 H40 B F4 Ir N3 PP 19.47197; 9.50712; 18.7104
79.8203; 86.1222; 89.3859		1654.57Lerch, Timothy G.; Albert, Daniel R.; Gau, Michael; Rajaseelan, Edward
Syntheses and crystal structures of 4-benzyl-1-ethyl-1,2,4-triazolium bromide and its corresponding NHC complexes of rhodium and iridium.
Acta crystallographica. Section E, Crystallographic communications, 2025, 81, 350-357
2100138 CIF
Paper		C41 H60 N4 O13P 19.0822; 15.7819; 15.904
108.746; 96.858; 90.06		2141.33Turkington, David E.; MacLean, Elizabeth J.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher
Supramolecular structures of 1-phenylethylammonium tartrates
Acta Crystallographica Section B, 2005, 61, 103-114
2100183 CIF
Paper		C12 H22 O11P 17.65217; 19.8637; 4.98773
92.0279; 106.261; 97.1529		720.18Platteau, Cyril; Lefebvre, Jacques; Affouard, Frederic; Willart, Jean-François; Derollez, Patrick; Mallet, Franck
Structure determination of the stable anhydrous phase of α-lactose from X-ray powder diffraction
Acta Crystallographica Section B, 2005, 61, 185-191
2100204 CIF
Paper		C12 H22 O11P 17.6258; 19.6559; 5.0613
95.646; 105.43; 80.996		721.01Lefebvre, Jacques; Willart, J.-F.; Caron, V.; Lefort, R.; Affouard, F.; Danède, F.
Structure determination of the 1/1 α/β mixed lactose by X-ray powder diffraction
Acta Crystallographica Section B, 2005, 61, 455-463
2100460 CIF
Paper		C24 H38 N2 O6P 15.9642; 10.4125; 11.7403
108.175; 104.56; 104.087		628.08Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts
17 salts of ephedrine: crystal structures and packing analysis
Acta Crystallographica Section B, 2006, 62, 498-505
2100477 CIF
Paper		C24 H42 N2 O11P 15.9373; 7.0594; 18.3791
80.254; 88.527; 66.247		694.14Edwin A Collier; Roger J Davey; Simon N Black; Ronald J Roberts
17 salts of ephedrine: crystal structures and packing analysis
Acta Crystallographica Section B, 2006, 62, 498-505
2100878 CIF
Paper		C33 H44 N4 O10P 119.409; 15.332; 11.784
95.51; 92.17; 83.59		3467.3Ebitani, M.; In, Y.; Ishida, T.; Sakaguchi, K.-i.; Flippen-Anderson, J. L.; Karle, I. L.
Structures of riboflavin tetraacetate and tetrabutyrate: molecular packing mode of riboflavin tetracarboxylate and its extensive stacking and hydrogen-bonding characteristics
Acta Crystallographica Section B, 1993, 49, 136-144
2100898 CIF
Paper		H O4 Rb SeP 110.622; 4.622; 7.575
89.35; 110.84; 102.13		339Makarova, I. P.
Thermal vibrations of atoms and phase transition in RbHSeO~4~ and NH~4~HSeO~4~ single crystals
Acta Crystallographica Section B, 1993, 49, 11-18
2101063 CIF
Paper		C15 H27 Co N6 O4P 111.723; 15.658; 11.118
98.71; 90.17; 98.52		1994.3Takenaka, Y.; Ohashi, Y.; Tamura, T.; Uchida, A.; Sasada, Y.
Three polymorphs of (<i>rac</i>-1-cyanoethyl)(pyrrolidine)cobaloxime
Acta Crystallographica Section B, 1993, 49, 1015-1020
2101110 CIF
Paper		C13 H18 N2 O7P 15.9701; 6.7357; 9.577
77.21; 79.95; 75.45		360.62Wei, Y.; Barton, R.; Robertson, B.
Electron-density and electrostatic potential distributions in nucleoside analogs. I. An experimental study of 3'-<i>O</i>-acetyl-2'-deoxy-5-methoxymethyluridine
Acta Crystallographica Section B, 1994, 50, 161-174
2101121 CIF
Paper		C18 H19 N5 O SP 18.577; 9.197; 11.83
86.57; 81.88; 69.83		867.1Bannister, C.; Burns, K.; Prout, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Ife, R. J.; Sach, G. S.
Structures of histamine H~1~-receptor antagonists derived from the cimetidine group of histamine H~2~-receptor antagonists
Acta Crystallographica Section B, 1994, 50, 221-243
2101255 CIF
Paper		C67 H130 Cl2 N10 O53P 117.909; 18.466; 18.873
96.65; 114.15; 114.78		4850Sheldrick, G. M.; Paulus, E.; Vértesy, L.; Hahn, F.
Structure of ureido-balhimycin
Acta Crystallographica Section B, 1995, 51, 89-98
2101289 CIF
Paper		C56 H88 S4P 123.9; 15.6; 3.8
90; 90; 90		1416.79Luzny, W.
X-ray diffraction and computer modelling study of the structure and conformation of poly(3-decylthiophene)
Acta Crystallographica Section B, 1995, 51, 255-260
2101327 CIF
Paper		C46 H80 N4 O14P 110.3796; 14.5809; 17.1521
105.225; 96.14; 90.248		2489Sheldrick, G. M.; Kojić-Prodić, B.; Banić, Z.; Kobrehel, G.; Kujundzić, N.
Structure of 9-deoxo-9a-<i>N</i>-[<i>N</i>'-(4-pyridyl)-carbamoyl]-9a-aza-9a-homoerythromycin A and conformational analysis of analogous 9a-aza 15-membered azalides in the solid state
Acta Crystallographica Section B, 1995, 51, 358-366
2101618 CIF
Paper		Cl2 H6 N2 PdP 16.3121; 6.4984; 3.3886
96.604; 97.29; 104.691		131.786Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S.; Blokhina, M. L.
Structures and isomerization in diamminedichloropalladium(II)
Acta Crystallographica Section B, 1996, 52, 909-916
2102042 CIF
Paper		C98.32 H223.88 O102.63P 118.153; 15.456; 15.251
102.81; 113.13; 99.9		3674Makedonopoulou, Stella; Mavridis, Irene M.
Structure of the inclusion complex of β-cyclodextrin with 1,12-dodecanedioic acid using synchrotron radiation data; a detailed dimeric β-cyclodextrin structure
Acta Crystallographica Section B, 2000, 56, 322-331
2102043 CIF
HKL
Paper		C97.03 H209.44 O96.69P 118.22; 15.488; 15.409
102.903; 113.122; 99.708		3735.3Makedonopoulou, Stella; Mavridis, Irene M.
Structure of the inclusion complex of β-cyclodextrin with 1,12-dodecanedioic acid using synchrotron radiation data; a detailed dimeric β-cyclodextrin structure
Acta Crystallographica Section B, 2000, 56, 322-331
2102097 CIF
Paper		C10 H13 N3 O6P 15.3893; 9.3851; 12.3681
107.054; 98.569; 97.303		581.65J.V. Pratap; R. Ravishankar; M.Vijayan
X-ray studies on crystalline complexes involving amino acids and peptides. XXXV. Invariance and variability in amino acid aggregation in the complexes of maleic acid with <small>L</small>-histidine and <small>L</small>-lysine
Acta Crystallographica Section B, 2000, 56, 690-696
2102120 CIF
Paper		C6 H13 N O2P 15.2438; 5.3978; 13.2562
93.042; 92.811; 109.897		351.42Dalhus, Bjørn; Görbitz, Carl Henrik
Structural relationships in crystals accommodating different stereoisomers of 2-amino-3-methylpentanoic acid
Acta Crystallographica Section B, 2000, 56, 720-727
2102234 CIF
Paper		C16 H33.592 Ba N10 O17P 17.1387; 7.4974; 13.5644
99.504; 94.308; 99.6		702.05Godino Salido, M. Luz; Arranz Mascarós, Paloma; López Garzón, Rafael; Gutiérrez Valero, M. Dolores; Low, John N.; Gallagher, John F.; Glidewell, Christopher
Hydrated metal(II) complexes of <i>N</i>-(6-amino-3,4-dihydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl) derivatives of glycine, glycylglycine, threonine, serine, valine and methionine: a monomeric complex and coordination polymers in one, two and three dimensions linked by hydrogen bonding
Acta Crystallographica Section B, 2004, 60, 46-64
2102618 CIF
Paper		C12 H27 N3 O3P 16.7765; 9.718; 11.882
81.58; 80.484; 88.35		763.4Görbitz, Carl Henrik
A crystallographic titration of the dipeptide <small>L</small>-isoleucyl-<small>L</small>-isoleucine
Acta Crystallographica Section B, 2004, 60, 569-577
2103078 CIF
Paper		C7 H6 Cl N3 O4 S2P 14.8499; 6.3694; 8.9106
74.401; 83.865; 80.524		260.93Broder, Charlotte K.; Fabbiani, Francesca P. A.; Shankland, Kenneth; David, Bill I. F.; Ibberson, Richard
Accurate molecular structures of chlorothiazide and hydrochlorothiazide by joint refinement against powder neutron and X-ray diffraction data
Acta Crystallographica Section B, 2008, 64, 101-107
2103126 CIF
Paper		C14 H26 N2 O10P 15.8757; 7.8751; 10.6165
70.345; 74.5; 87.435		445.24Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher
Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines
Acta Crystallographica, Section B, 2002, 58, 530-544
2103127 CIF
Paper		C14 H14 N2 O5P 15.1647; 6.2749; 10.2126
83.235; 89.808; 79.601		323.21Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher
Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines
Acta Crystallographica, Section B, 2002, 58, 530-544
2103130 CIF
Paper		C16 H16 N2 O5P 14.9325; 8.3343; 9.3502
72.751; 89.414; 80.207		361.41Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher
Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines
Acta Crystallographica, Section B, 2002, 58, 530-544
2103255 CIF
HKL
Paper		C27 H46 OP 127.565; 38.624; 10.748
93.49; 90.9; 117.15		10151Hsu, Leh-Yeh; Kampf, Jeff W.; Nordman, Christer E.
Structure and pseudosymmetry of cholesterol at 310K
Acta Crystallographica Section B, 2002, 58, 260-264
2103265 CIF
HKL
Paper		C32 H32 N4 O12P 18.6195; 9.5654; 9.8727
103.162; 109.912; 90.262		742.22Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher
Chiral <i>versus</i> racemic building blocks in supramolecular chemistry: tartrate salts of organic diamines
Acta Crystallographica Section B, 2002, 58, 272-288
2103285 CIF
HKL
Paper		C22 H23 N5 O4P 17.9899; 8.4278; 17.0042
99.91; 90.561; 111.488		1046.22Quesada, Antonio; Marchal, Antonio; Melguizo, Manuel; Nogueras, Manuel; Sánchez, Adolfo; Low, John N.; Cannon, Debbie; Farrell, Dorcas M. M.; Glidewell, Christopher
Amino-substituted O^6^-benzyl-5-nitrosopyrimidines: interplay of molecular, molecular-electronic and supramolecular structures
Acta Crystallographica Section B, 2002, 58, 300-315
2103332 CIF
Paper		C8 H2 Cl4 K2 O8P 15.048; 7.84; 8.839
81.46; 85.05; 89.35		344.6Olovsson, I.; Ptasiewicz-Bak, H.; Gustafsson, T.; Majerz, I.
Asymmetric hydrogen bonds in centrosymmetric environment. II. Neutron study of very short hydrogen bonds in potassium hydrogen dichloromaleate at 90K and 170K
Acta Crystallographica Section B, 2002, 58, 627-631
2103333 CIF
Paper		C8 H2 Cl4 K2 O8P 15.031; 7.827; 8.835
81.24; 85.17; 89.16		342.6Olovsson, I.; Ptasiewicz-Bak, H.; Gustafsson, T.; Majerz, I.
Asymmetric hydrogen bonds in centrosymmetric environment. II. Neutron study of very short hydrogen bonds in potassium hydrogen dichloromaleate at 90K and 170K
Acta Crystallographica Section B, 2002, 58, 627-631
2103475 CIF
HKL
Paper		C32 H36 N3 O7 P3P 110.166; 12.105; 13.313
88.86; 86.54; 78.14		1600.3Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kılıç, Adem; Mayer, Thomas A.; Shaw, Robert A.
Structural investigations of phosphorus–nitrogen compounds. 5. Relationships between molecular parameters of 2,2-diphenyl-4,6-<i>cis</i>-oxytetra(ethyleneoxy)-4,6-<i>R</i>~2~-cyclotriphosphazatrienes (<i>R</i> = Cl, OCH~2~CF~3~, OPh, OMe, NHPh, NHBu^<i>t^</i>) and substituent basicity constants
Acta Crystallographica Section B, 2002, 58, 1067-1073
2103481 CIF
HKL
Paper		C9 H18 N4 O6P 15.353; 6.931; 9.922
69.53; 89.035; 71.128		324.4Saraswathi, N. T.; Vijayan, M.
X-ray studies on crystalline complexes involving amino acids and peptides. XL. Conformational variability, recurring and new features of aggregation, and effect of chirality in the malonic acid complexes of <small>DL</small>- and <small>L</small>-arginine
Acta Crystallographica Section B, 2002, 58, 1051-1056
2103681 CIF
Paper		C8 H2 Cl4 K2 O8P 15.083; 7.881; 8.863
81.72; 84.78; 89.59		349.9Olovsson, I.; Ptasiewicz-Bak, H.; Gustafsson, T.; Majerz, I.
Asymmetric hydrogen bonds in centrosymmetric environment: neutron study of very short hydrogen bonds in potassium hydrogen dichloromaleate
Acta Crystallographica Section B, 2001, 57, 311-316
2103682 CIF
Paper		C8 H2 Cl4 K2 O8P 15.022; 7.827; 8.838
80.99; 85.13; 88.95		341.9Olovsson, I.; Ptasiewicz-Bak, H.; Gustafsson, T.; Majerz, I.
Asymmetric hydrogen bonds in centrosymmetric environment: neutron study of very short hydrogen bonds in potassium hydrogen dichloromaleate
Acta Crystallographica Section B, 2001, 57, 311-316
2103747 CIF
HKL
Paper		C34 H52 N12 O16P 15.791; 13.11; 14.36
110.46; 89.78; 95.62		1016Saraswathi, N. T.; Vijayan, M.
X-ray studies on crystalline complexes involving amino acids and peptides. XXXVIII. Crystal structures of the complexes of <small>L</small>-arginine and <small>L</small>-histidine with glutaric acid and a comparative study of amino acid‒glutaric acid complexes
Acta Crystallographica Section B, 2001, 57, 842-849
2103845 CIF
HKL
Paper		C22 H28 N2 O4P 18.5318; 10.3775; 23.3884
99.819; 95.478; 90.787		2030.18Zakaria, Choudhury M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher
(1<i>R</i>,3<i>S</i>)-Camphoric acid as a building block in supramolecular chemistry: adducts with organic polyamines
Acta Crystallographica Section B, 2003, 59, 118-131
2103872 CIF
HKL
Paper		C17 H15 N5 O2P 14.7622; 5.8123; 13.5635
79.851; 87.346; 89.692		369.16Melguizo, Manuel; Quesada, Antonio; Low, John N.; Glidewell, Christopher
Supramolecular structures of <i>N</i>^4^-substituted 2,4-diamino-6-benzyloxy-5-nitrosopyrimidines
Acta Crystallographica Section B, 2003, 59, 263-276
2104113 CIF
HKL
Paper		C66 H92 N2 O8P 112.8559; 13.5462; 17.4215
75.39; 83.254; 82.771		2900.9Rychlewska, Urszula; Warżajtis, Beata; Joachimiak, Roman; Paryzek, Zdzisław
Synthesis and structural characteristics of lithocholate triads: steroid-type channels occupied by spacer fragments
Acta Crystallographica Section B, 2008, 64, 383-392
2104114 CIF
Paper		C66 H92 N2 O8P 16.8044; 12.887; 17.0661
94.431; 97.935; 97.341		1463.14Rychlewska, Urszula; Warżajtis, Beata; Joachimiak, Roman; Paryzek, Zdzisław
Synthesis and structural characteristics of lithocholate triads: steroid-type channels occupied by spacer fragments
Acta Crystallographica Section B, 2008, 64, 383-392
2104116 CIF
Paper		C56.5 H92 N2 O8.5P 17.7755; 9.8697; 17.754
103.04; 101.086; 90.463		1300.7Rychlewska, Urszula; Warżajtis, Beata; Joachimiak, Roman; Paryzek, Zdzisław
Synthesis and structural characteristics of lithocholate triads: steroid-type channels occupied by spacer fragments
Acta Crystallographica Section B, 2008, 64, 383-392
2104253 CIF
Paper		C16 H18 N2 O3P 15.6984; 9.7762; 13.8553
100.011; 94.302; 103.919		732.26Lemmerer, Andreas; Báthori, Nikoletta B.; Bourne, Susan A.
Chiral carboxylic acids and their effects on melting-point behaviour in co-crystals with isonicotinamide
Acta Crystallographica Section B, 2008, 64, 780-790
2104254 CIF
Paper		C16 H18 N2 O3P 15.7059; 9.7727; 13.8321
100.323; 94.09; 103.881		731.37Lemmerer, Andreas; Báthori, Nikoletta B.; Bourne, Susan A.
Chiral carboxylic acids and their effects on melting-point behaviour in co-crystals with isonicotinamide
Acta Crystallographica Section B, 2008, 64, 780-790
2104273 CIF
HKL
Paper		C6 H18 Cl2 N2 O4P 15.4491; 7.3962; 8.1337
79.382; 73.191; 69.544		292.75Dittrich, B.; McKinnon, J. J.; Warren, J. E.
Improvement of anisotropic displacement parameters from invariom-model refinements for three <small>L</small>-hydroxylysine structures
Acta Crystallographica Section B, 2008, 64, 750-759
2104299 CIF
HKL
Paper		C43 H30 N2 O8P 19.2897; 10.0849; 11.0897
103.203; 111.486; 107.147		855.11Rychlewska, Urszula; Plutecka, Agnieszka; Hoffmann, Marcin; Skowronek, Paweł; Gawrońska, Krystyna; Gawroński, Jacek
Probing the shapes of chiral bis-(<i>o</i>-naphthalimidobenzoyl) systems using X-ray and circular dichroism methods
Acta Crystallographica Section B, 2009, 65, 86-95
2104333 CIF
HKL
Paper		C40 H50 O4P 17.7821; 9.9578; 11.4162
88.126; 78.329; 84.34		862.08Bartalucci, Giuditta; Fisher, Stuart; Helliwell, John R.; Helliwell, Madeleine; Liaaen-Jensen, Synnøve; Warren, John E.; Wilkinson, James
X-ray crystal structures of diacetates of 6-s-<i>cis</i> and 6-s-<i>trans</i> astaxanthin and of 7,8-didehydroastaxanthin and 7,8,7',8'-tetradehydroastaxanthin: comparison with free and protein-bound astaxanthins
Acta Crystallographica Section B, 2009, 65, 238-247
2104334 CIF
HKL
Paper		C40 H48 O4P 17.4769; 10.4729; 11.633
75.606; 85.901; 76.389		857.5Bartalucci, Giuditta; Fisher, Stuart; Helliwell, John R.; Helliwell, Madeleine; Liaaen-Jensen, Synnøve; Warren, John E.; Wilkinson, James
X-ray crystal structures of diacetates of 6-s-<i>cis</i> and 6-s-<i>trans</i> astaxanthin and of 7,8-didehydroastaxanthin and 7,8,7',8'-tetradehydroastaxanthin: comparison with free and protein-bound astaxanthins
Acta Crystallographica Section B, 2009, 65, 238-247
2104336 CIF
HKL
Paper		Ca O3 TeP 125.6201; 10.2408; 11.3279
107.218; 110.245; 33.016		1519.28Stöger, Berthold; Weil, Matthias; Zobetz, Erich; Giester, Gerald
Polymorphism of CaTeO~3~ and solid solutions Ca~<i>x~</i>Sr~1{-~<i>x</i>}TeO~3~
Acta Crystallographica Section B, 2009, 65, 167-181
2104337 CIF
HKL
Paper		Ca O3 TeP 125.622; 10.2426; 11.3327
107.218; 110.245; 33.019		1520.42Stöger, Berthold; Weil, Matthias; Zobetz, Erich; Giester, Gerald
Polymorphism of CaTeO~3~ and solid solutions Ca~<i>x~</i>Sr~1{-~<i>x</i>}TeO~3~
Acta Crystallographica Section B, 2009, 65, 167-181
2104873 CIF
HKL
Paper		As2 Ni2 O7P 119.497; 5.297; 8.868
58.32; 148.78; 127.3		377.6Weil, Matthias; Stöger, Berthold
Crystal chemistry of transition metal diarsenates <i>M</i>~2~As~2~O~7~ (<i>M</i> = Mn, Co, Ni, Zn): variants of the thortveitite structure
Acta Crystallographica Section B, 2010, 66, 603-614

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