Crystallography Open Database

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7249181 CIFC41 H41 Br N4 O6 SP 21 21 219.0487; 16.0617; 26.212
90; 90; 90
3809.6Zhang, Xiaowen; Meng, Dongshuo; Zang, Zongwu; Xu, Zhiru; Liu, Yu
New bedaquiline salt with improved bioavailability and reduced food effect
CrystEngComm, 2024, 26, 5071-5077
7249215 CIFC17 H16 O3P 21 21 219.0416; 20.2173; 22.2247
90; 90; 90
4062.6Zhang, Yu; Yu, Yueyang; Ma, Xiaoqiang; Zhao, Xiaofei; Huang, Jialin; Zhao, Depeng
Conformational studies of biaryl-bridged seven-membered lactones with a quaternary carbon center.
RSC advances, 2024, 14, 25663-25668
7249217 CIFC18 H18 O3P 21 21 217.9631; 9.0415; 19.8923
90; 90; 90
1432.21Zhang, Yu; Yu, Yueyang; Ma, Xiaoqiang; Zhao, Xiaofei; Huang, Jialin; Zhao, Depeng
Conformational studies of biaryl-bridged seven-membered lactones with a quaternary carbon center.
RSC advances, 2024, 14, 25663-25668
7249255 CIFC44 H68 Cl2 N2P 21 21 217.0051; 18.9291; 36.914
90; 90; 90
4894.8Zheng, Cameron H. M.; Nadeau, Ben E.; Trajano, Heather L.; Schafer, Laurel L.
Exploiting natural complexity for substrate controlled regioselectivity and stereoselectivity in tantalum catalysed hydroaminoalkylation
Green Chemistry, 2024, 26, 9729-9736
7249259 CIFC31 H57 Cl5 Cu4 N6 O2 S6 WP 21 21 2111.3271; 13.5211; 33.2108
90; 90; 90
5086.4Xu, Meng-Yuan; Wu, Qian; Wang, Chen; Sun, Yao; Teng, Yu-Kang; Zhang, Rui; Lu, Zhen-Zhong
Coordination polymers and supramolecular cages based on [(MS4)Cux]x−2 cluster units and N-containing ligands
CrystEngComm, 2024, 26, 5585-5590
7249290 CIFC54 H65 N2 O8P 21 21 219.7335; 13.0898; 38.4467
90; 90; 90
4898.5Zhang, Liming; Yang, Chen; Wang, Xinhai; Yang, Taixin; Yang, Dandan; Dou, Yingchao; Niu, Jun-Long
Enantioselective electrosynthesis of inherently chiral calix[4]arenes via a cobalt-catalyzed aryl C–H acyloxylation
Green Chemistry, 2024, 26, 10232-10239
7249305 CIFC17 H12 N2P 21 21 217.4481; 12.5608; 13.0832
90; 90; 90
1223.99Li, Haonan; Gao, Chenping; Li, Zhibin; Guo, Yanchun; Cao, Shuxia; Zhao, Yufen
Structural insight into imidazopyridines and benzimidazoles: the importance of the hydrogen bond, π-stacking interactions and intramolecular charge transfer effect for fluorescence
CrystEngComm, 2024, 26, 5380-5392
7249377 CIFC8 H4 I N O2P 21 21 214.9049; 7.0364; 24.1144
90; 90; 90
832.26Jeon, Ie-Rang; Jeannin, Olivier; Robert, Antoine; Barrière, Frédéric; Fourmigué, Marc
N-Iodophthalimide as a halogen bond donor, a comparison with N-iodosuccinimide and N-iodosaccharin
CrystEngComm, 2024, 26, 6075-6081
7249409 CIFC27 H19 Br N2 O2 SP 21 21 219.2241; 10.399; 25.056
90; 90; 90
2403.4Wu, Yingtao; Guan, Xin; Jiao, Kehan; Zhao, Huaqiu; Li, Mingrui; Sun, Jiaqiong; Zheng, Guangfan; Zhang, Qian
Synthesis of axially chiral thiourea by NHC-catalyzed desymmetrizative amidation
Green Chemistry, 2024, 26, 10940-10949
7249437 CIFC2 H4 As F7 O3P 21 21 217.4858; 8.0027; 12.7743
90; 90; 90
765.27Virmani, Alan; Jessen, Christoph; Nitzer, Alexander; Kornath, Andreas J.
Deoxyfluorination with superacids – synthesis and characterization of protonated α-fluorohydroxyacetic acid
RSC Advances, 2024, 14, 31517-31523
7249504 CIFC18 H22 Cl Eu O12P 21 21 216.2461; 18.7509; 19.0329
90; 90; 90
2229.13Wang, Xue-Ting; Lv, Fang-Wen; Qin, Hang; Dai, Xin-Tong; Jin, Shan; Zheng, Xiu-Ying
Amplified circularly polarized luminescence of chiral lanthanide-based chains through helical assembly
CrystEngComm, 2024, 26, 6676-6682
7249505 CIFC18 H22 Cl O12 TbP 21 21 2118.7651; 18.9706; 6.2102
90; 90; 90
2210.74Wang, Xue-Ting; Lv, Fang-Wen; Qin, Hang; Dai, Xin-Tong; Jin, Shan; Zheng, Xiu-Ying
Amplified circularly polarized luminescence of chiral lanthanide-based chains through helical assembly
CrystEngComm, 2024, 26, 6676-6682
7249506 CIFC18 H22 Cl O12 TbP 21 21 2118.7948; 18.9335; 6.2122
90; 90; 90
2210.62Wang, Xue-Ting; Lv, Fang-Wen; Qin, Hang; Dai, Xin-Tong; Jin, Shan; Zheng, Xiu-Ying
Amplified circularly polarized luminescence of chiral lanthanide-based chains through helical assembly
CrystEngComm, 2024, 26, 6676-6682
7249511 CIFC18 H22 Cl Eu O12P 21 21 2118.7671; 19.0219; 6.2535
90; 90; 90
2232.41Wang, Xue-Ting; Lv, Fang-Wen; Qin, Hang; Dai, Xin-Tong; Jin, Shan; Zheng, Xiu-Ying
Amplified circularly polarized luminescence of chiral lanthanide-based chains through helical assembly
CrystEngComm, 2024, 26, 6676-6682
7249538 CIFC11 H5 F5 O S2P 21 21 215.4947; 9.2154; 23.473
90; 90; 90
1188.6Capozzi, Maria Annunziata M.; Alvarez-Larena, Angel; Piniella Febrer, Joan F.; Cardellicchio, Cosimo
Investigation of the titanium-mediated catalytic enantioselective oxidation of aryl benzyl sulfides containing heterocyclic groups
RSC Advances, 2024, 14, 35105-35113
7249564 CIFC13 H14 Ag Bi Br8 N2P 21 21 217.4426; 16.8474; 19.2123
90; 90; 90
2409Shentseva, Irina A.; Usoltsev, Andrey N.; Korobeynikov, Nikita A.; Sokolov, Maxim N.; Adonin, Sergey A.
One-dimensional heterometallic Bi/Ag and Sb/Ag bromometalates(iii): structures, thermal stability and optical properties
CrystEngComm, 2024, 26, 6823-6827
7249610 CIFC10 H16 N4 O6 P2P 21 21 2112.496; 16.008; 15.982
90; 90; 90
3197Budzikur-Maciąg, Daria; Kinzhybalo, Vasyl; Ślepokura, Katarzyna
Structural landscape studies of aminopyridinium hypodiphosphates: dehydration and polymorphism in 4-aminopyridinium salts
CrystEngComm, 2024, 26, 6861-6872
7249635 CIFC22 H15 Cl2 N3 SP 21 21 214.4462; 18.662; 22.7605
90; 90; 90
1888.6Nath, Jitendra; Baruah, Jubaraj B.
Positional isomers of (E)-2-(anthracen-9-ylmethylene)-N-(aryl)hydrazinecarbothioamide, zinc complexes and polymorphic solvates
CrystEngComm, 2025, 27, 46-54
7249636 CIFC27 H33 N O4 SP 21 21 218.0588; 12.1638; 25.1238
90; 90; 90
2462.78Boháček, Vojtěch; Erbenová, Tereza; Malina, Jakub Dávid; Kloubcová, Marie; Šmahel, Michal; Eigner, Václav; T°uma, Jiří
Spectroscopic and photochemical evaluation of stereochemically biased 3′-substituted spiropyran photoswitches
RSC Advances, 2024, 14, 37370-37379
7249740 CIFC15 H14 F3 N O2P 21 21 216.8059; 9.5499; 22.0878
90; 90; 90
1435.61Liang, Hanyu; Cao, Jiaxuan; Zhang, Hailong; Huang, Longjie; Liu, Siqi; Wu, Tianhao; Xiao, Xiao; Zhao, Baoguo
Direct asymmetric α-C–H functionalization of N-unprotected allylamine catalyzed by chiral pyridoxal
Green Chemistry, 2025, 27, 1374-1380
7249741 CIFC28 H27 Br F3 N O3P 21 21 215.8722; 15.561; 28.0723
90; 90; 90
2565.2Liang, Hanyu; Cao, Jiaxuan; Zhang, Hailong; Huang, Longjie; Liu, Siqi; Wu, Tianhao; Xiao, Xiao; Zhao, Baoguo
Direct asymmetric α-C–H functionalization of N-unprotected allylamine catalyzed by chiral pyridoxal
Green Chemistry, 2025, 27, 1374-1380
7249790 CIFC10 H13 Cl N4P 21 21 215.3663; 5.4055; 39.3933
90; 90; 90
1142.7Toynton, Arthur; Ferrins, Lori; Newson, Harriet; Sykes, Melissa; Varghese, Swapna; Nguyen, Nghi; Russell, Stephanie; Rahmani, Raphaël; Cheang, Jeremy; Flematti, Gavin; Skelton, Brian W.; Zulfiqar, Bilal; Avery, Vicky Mary; Baell, Jonathan Bayldon; Piggott, Matthew
Heterocyclic Core Modifications in Trypanosomacidal 2-[(Phenylheteroaryl)ethyl]ureas
RSC Medicinal Chemistry, 2025
7249793 CIFC15 H16 N2 O2P 21 21 215.1916; 8.5358; 29.4619
90; 90; 90
1305.59Sobczak, Paulina; Sierański, Tomasz; Świątkowski, Marcin; Trzęsowska-Kruszyńska, Agata; Kolińska, Jolanta
Unraveling the structure–property relationships in fluorescent phenylhydrazones: the role of substituents and molecular interactions
RSC Advances, 2025, 15, 1514-1526
7249796 CIFC18 H21 N3 O2P 21 21 215.9786; 7.2442; 36.294
90; 90; 90
1571.9Sobczak, Paulina; Sierański, Tomasz; Świątkowski, Marcin; Trzęsowska-Kruszyńska, Agata; Kolińska, Jolanta
Unraveling the structure–property relationships in fluorescent phenylhydrazones: the role of substituents and molecular interactions
RSC Advances, 2025, 15, 1514-1526
7249798 CIFC15 H15 Br N2 OP 21 21 215.304; 8.7988; 29.2208
90; 90; 90
1363.7Sobczak, Paulina; Sierański, Tomasz; Świątkowski, Marcin; Trzęsowska-Kruszyńska, Agata; Kolińska, Jolanta
Unraveling the structure–property relationships in fluorescent phenylhydrazones: the role of substituents and molecular interactions
RSC Advances, 2025, 15, 1514-1526
7249816 CIFC15 H18 N2 O2P 21 21 216.1179; 8.0879; 27.871
90; 90; 90
1379.08Zhang, Zhou-Tian-Le; Ren, Zhen; Su, Xiaoyu; Xie, Tian-Peng; Yi, Mengzhuo; Zhou, Hao; Yin, Min; Ding, Zhong-Tao
Genome mining of albocandins A–E from Streptomyces sp. YINM00030
RSC Advances, 2025, 15, 1805-1812
7249852 CIFC9 H14 N3 O8 PP 21 21 218.338; 31.318; 4.8912
90; 90; 90
1277.2Kaszubowski, Oskar; Ślepokura, Katarzyna; Wojciechowski, Jakub
Same but different: structural diversity of cytidine 5′-monophosphate (CMP) (an)hydrates
CrystEngComm, 2025, 27, 1174-1184
7249856 CIFC9 H16 N3 O9 PP 21 21 218.367; 34.158; 4.8236
90; 90; 90
1378.6Kaszubowski, Oskar; Ślepokura, Katarzyna; Wojciechowski, Jakub
Same but different: structural diversity of cytidine 5′-monophosphate (CMP) (an)hydrates
CrystEngComm, 2025, 27, 1174-1184
7249858 CIFC9 H17 N3 O9.5 PP 21 21 218.422; 35.163; 9.693
90; 90; 90
2870.5Kaszubowski, Oskar; Ślepokura, Katarzyna; Wojciechowski, Jakub
Same but different: structural diversity of cytidine 5′-monophosphate (CMP) (an)hydrates
CrystEngComm, 2025, 27, 1174-1184
7249860 CIFC25 H17 Cl2 N O3P 21 21 219.917; 13.467; 16.34
90; 90; 90
2182.2Farajpour, Behnaz; Kakaie, Marzie; Hussain, Faiq H. S.; Rakaee, Fataneh; Moradkhani, Fatemeh; Shiri, Morteza
One-pot reaction of 3-vinylchromones, aromatic aldehydes, and ammonium acetate: an efficient approach to highly functionalized 1,6-dihydropyridine derivatives.
RSC advances, 2025, 15, 2602-2607
7249861 CIFC25 H17 Cl2 N O3P 21 21 219.894; 13.487; 16.351
90; 90; 90
2181.9Farajpour, Behnaz; Kakaie, Marzie; Hussain, Faiq H. S.; Rakaee, Fataneh; Moradkhani, Fatemeh; Shiri, Morteza
One-pot reaction of 3-vinylchromones, aromatic aldehydes, and ammonium acetate: an efficient approach to highly functionalized 1,6-dihydropyridine derivatives.
RSC advances, 2025, 15, 2602-2607
7249898 CIFC20 H20 O2 S2P 21 21 215.8241; 10.0409; 29.8544
90; 90; 90
1745.86Xu, Tiantian; Wang, Fen-Dou; Yang, Wen-Chao; Lu, Tong; Wang, Min; Li, Pinhua
Photo-induced intramolecular alkyl/aryl group transfer and SO2 insertion: a new strategy for the synthesis of 3-(alkyl/arylsulfonyl)benzothiophenes
Green Chemistry, 2025, 27, 2386-2391
7249912 CIFC11 H17 Cl2 N3 O Pt SP 21 21 217.1928; 13.8777; 15.0416
90; 90; 90
1501.45O'Sullivan, Patrick; Previtali, Viola; Twamley, Brendan; Marmion, Celine J.; McDonald, Aidan R.; Rozas, Isabel
Platinum(ii) complexes of aryl guanidine-like derivatives as potential anticancer agents: between coordination and cyclometallation.
RSC advances, 2025, 15, 3427-3438
7249933 CIFC40 H32 O2P 21 21 219.1458; 11.4764; 26.799
90; 90; 90
2812.8Lam, Kevin; Dillon, Robert J.; Carreras, Abel; Nishiuchi, Tomohiko; Kubo, Takashi; Al-Kaysi, Rabih O; Casanova, David; Bardeen, Christopher J.
Using an aromatic linker to optimize charge-resonance states, photodimerization and reversibility in covalent anthracene dimers
Physical Chemistry Chemical Physics, 2024
7249934 CIFC6 H8 O4P 21 21 216.2271; 8.9744; 10.7641
90; 90; 90
601.55Chen, Zhifei; Ning, Yibo; Li, Lei; Cao, Xueying; Xi, Gaolei; Cheng, Dongxu; Wang, Qingfu; Lu, Changtong; Yang, Kai
Production of 1,4:3,6-dianhydro-α-d-glucopyranose from methyl 3,6-anhydro-α-d-glucopyranoside and its taste identification
RSC Advances, 2025, 15, 4481-4486
7249937 CIFC21 H26 O5P 21 21 215.52413; 15.246; 22.0591
90; 90; 90
1857.84Kohyama, Aki; Namioka, Motoki; Naka, Hiroshi; Ashikari, Yosuke; Nagaki, Aiichiro; Takikawa, Hiroshi; Yamaoka, Yousuke; Takasu, Kiyosei
Continuous flow synthesis of cyclobutenes via lithium ynolates
Green Chemistry, 2025, 27, 2760-2765
7249948 CIFC20 H30 O3P 21 21 217.6524; 13.8446; 17.0676
90; 90; 90
1808.22Lai, Kuei-Hung; Chung, Hsiao-Ling; Chen, You-Ying; Zheng, Li-Guo; Su, Jui-Hsin; El-Shazly, Mohamed
Insights into the structural diversity of cembranoids from Sarcophyton glaucum and their bioactivity
RSC Advances, 2025, 15, 4702-4707
7249949 CIFC20 H28 O3P 21 21 2110.9227; 11.4366; 14.0387
90; 90; 90
1753.69Lai, Kuei-Hung; Chung, Hsiao-Ling; Chen, You-Ying; Zheng, Li-Guo; Su, Jui-Hsin; El-Shazly, Mohamed
Insights into the structural diversity of cembranoids from Sarcophyton glaucum and their bioactivity
RSC Advances, 2025, 15, 4702-4707
7249950 CIFC20 H28 O3P 21 21 2110.9787; 11.8275; 13.8005
90; 90; 90
1792Lai, Kuei-Hung; Chung, Hsiao-Ling; Chen, You-Ying; Zheng, Li-Guo; Su, Jui-Hsin; El-Shazly, Mohamed
Insights into the structural diversity of cembranoids from Sarcophyton glaucum and their bioactivity
RSC Advances, 2025, 15, 4702-4707
7250011 CIFC16 H15 N3 O2P 21 21 217.1923; 12.7507; 15.16
90; 90; 90
1390.3liu, Xiaohan; zhou, bin; Chen, Yan; lin, Jinyuan; shao, Chenwen; Chen, Liuzeng; Ruan, Banfeng; zhang, xingxing; Qian, Yong
Design, synthesis of 2-phenyl-1H-benzo[d]imidazole derivatives as 17β-HSD10 inhibitor for the treatment of Alzheimer's Disease
RSC Medicinal Chemistry, 2025
7250027 CIFC28 H45 N O5P 21 21 2120.0237; 17.0222; 8.20215
90; 90; 90
2795.68Koryťáková, Adéla; Chatziadi, Argyro; Rohlíček, Jan; Zmeškalová, Eliška; Beránek, Josef; Šoóš, Miroslav
Stability study and structural insights into cannabidiol cocrystals
CrystEngComm, 2025, 27, 2154-2165
7250028 CIFC39 H39 N O4P 21 21 219.6215; 10.7098; 29.8886
90; 90; 90
3079.9Recchia, Daniella L.; Barton, Benita; Hosten, Eric C.
Extremely effective separations of pyridine/picoline mixtures through supramolecular chemistry strategies employing (4R,5R)-bis(diphenylhydroxymethyl)-2-spiro-1′-cyclohexane-1,3-dioxolane as the host compound
CrystEngComm, 2025, 27, 1960-1976
7250063 CIFC21 H30 O3 SP 21 21 218.30717; 12.2319; 20.046
90; 90; 90
2036.92Huang, Wanhui; Liu, Ge; Yang, Fangyuanhang; Ren, Yuxi; Gao, Yuzhen; Su, Weiping
CO2-Promoted photoredox-catalyzed hydrosulfonylation of alkenes with sulfinates
Green Chemistry, 2025, 27, 3627-3633
7250090 CIFC11 H8 Br Fe NP 21 21 219.018; 10.319; 10.748
90; 90; 90
1000.2Horikoshi, Ryo; Inoue, Ryota; Sumitani, Ryo; Takahashi, Kazuyuki; Mochida, Tomoyuki
Synthesis and structural characterization of the racemic and meso forms of 2,2′′-dibromo-1,1′′-biferrocenes and their mixed-valence salts
CrystEngComm, 2025, 27, 2371-2381
7250180 CIFC22 H24 O2 S SeP 21 21 215.9476; 18.2684; 18.31
90; 90; 90
1989.4Xiao, Xiao; Tian, Hong-Yu; Sun, Jia-Chen; Bai, Jun; Wang, Min; Chen, Biao; Jin, Yu-Xia; Jiang, Hai-Bo; Cheng, Dang; Chen, Fen-Er
Deuterated methylselenylating reagents designed for diverse Se-methyl-d3 scaffold construction
Green Chemistry, 2025, 27, 4779-4794
7250183 CIFC20 H32 Al Cl4 NP 21 21 2111.4289; 14.0183; 15.0816
90; 90; 90
2416.3Francis, Maria; Shinde, Kishor; Roy, Sudipta
Theoretical and experimental studies on stability, bonding and isolation of elusive bis-(dichloro-aluminium) oxides supported by donor-base ligands
RSC Advances, 2025, 15, 9208-9215
7250199 CIFC20 H28 O5P 21 21 2111.299; 11.3809; 14.0929
90; 90; 90
1812.25Nhi Nguyen, Thi Uyen; Kung, Chen-Chen; Liaw, Chia-Ching; Lin, Yu-Chi; Chen, You-Ying; Zheng, Li-Guo; Chien, Su-Ying; Tang, Chi-Chieh; Weng, Jing-Ru; Su, Jui-Hsin; Sheu, Jyh-Horng; Sung, Ping-Jyun
Sarcophytonin H: a novel endoperoxide-containing dihydrofuranocembranoid from an octocoral Sarcophyton species
RSC Advances, 2025, 15, 9454-9460
7250235 CIFC32 H26 N4P 21 21 217.7573; 17.2615; 19.0749
90; 90; 90
2554.2Chuskit, Stanzin; Kumar, Sunil; Das, Dinabandhu
Polymorphism in novel symmetric and asymmetric bis-hydrazone derivatives
CrystEngComm, 2025, 27, 3247-3256
7250271 CIFC12 H12 N2 OP 21 21 216.0306; 10.3023; 16.1959
90; 90; 90
1006.24Takaishi, Kazuto; Morishita, Hajime; Iwaki, Kosuke; Ema, Tadashi
Deoxygenative dual CO2 conversions: methylenation and switchable N-formylation/N-methylation of tryptamines
Green Chemistry, 2025, 27, 5359-5365
7250273 CIFC6 H10 O5P 21 21 216.6617; 7.5013; 13.278
90; 90; 90
663.52Li, Xianda; Shao, Zhongping; Shan, Haozhe; Liu, Li
Evolution process of humins derived from cellulose by a humin extraction approach
Green Chemistry, 2025, 27, 5322-5331
7250292 CIFC12 H19 Cl3 O8P 21 21 217.3167; 12.0459; 18.1855
90; 90; 90
1602.8Zhou, Dongyu; Li, Yongshang; Jie, Huimin; Lei, Jiayan; Chen, Zi'ang; Chen, Xiaoping; Cui, Can; Luo, Huadong; Chen, Jingjing; Li, Haohong; Zheng, Huidong
Intermittent ultrasound-assisted anti-solvent crystallization for sucralose production with ultra-low aspect ratio and larger crystal size
CrystEngComm, 2025, 27, 3492-3501
7250293 CIFC12 H19 Cl3 O8P 21 21 217.2843; 12.0048; 18.0766
90; 90; 90
1580.7Zhou, Dongyu; Li, Yongshang; Jie, Huimin; Lei, Jiayan; Chen, Zi'ang; Chen, Xiaoping; Cui, Can; Luo, Huadong; Chen, Jingjing; Li, Haohong; Zheng, Huidong
Intermittent ultrasound-assisted anti-solvent crystallization for sucralose production with ultra-low aspect ratio and larger crystal size
CrystEngComm, 2025, 27, 3492-3501
7250294 CIFC12 H19 Cl3 O8P 21 21 2112.041; 7.3141; 18.158
90; 90; 90
1599.2Zhou, Dongyu; Li, Yongshang; Jie, Huimin; Lei, Jiayan; Chen, Zi'ang; Chen, Xiaoping; Cui, Can; Luo, Huadong; Chen, Jingjing; Li, Haohong; Zheng, Huidong
Intermittent ultrasound-assisted anti-solvent crystallization for sucralose production with ultra-low aspect ratio and larger crystal size
CrystEngComm, 2025, 27, 3492-3501
7250295 CIFC12 H19 Cl3 O8P 21 21 217.2691; 11.947; 17.987
90; 90; 90
1562.1Zhou, Dongyu; Li, Yongshang; Jie, Huimin; Lei, Jiayan; Chen, Zi'ang; Chen, Xiaoping; Cui, Can; Luo, Huadong; Chen, Jingjing; Li, Haohong; Zheng, Huidong
Intermittent ultrasound-assisted anti-solvent crystallization for sucralose production with ultra-low aspect ratio and larger crystal size
CrystEngComm, 2025, 27, 3492-3501
7250299 CIFC15 H39 Bi2 Br12 N3P 21 21 219.1942; 11.9957; 35.471
90; 90; 90
3912.1Ben Elhaj, Yassine; Hajlaoui, Fadhel; Karoui, Karim; Allain, Magali; Mercier, Nicolas; Kozma, Erika; Botta, Chiara; Zouari, Nabil
Novel lead-free bismuth-based perovskite-like (BrC5H13N)3Bi2Br9: synthesis, structural investigations and optoelectronic properties
RSC Advances, 2025, 15, 12834-12842
7250352 CIFC12 H18 O4P 21 21 217.7247; 8.6013; 18.5304
90; 90; 90
1231.21Galvez, Carolina E.; Piro, Oscar E.; Echeverría, Gustavo A.; Vignesh, Krishnan; Thamotharan, Subbiah; Loandos, María del H.; Gil, Diego M.
Supramolecular assembly mediated by hydrogen bonds and weak noncovalent interactions in two eucalyptol derivatives with potential antineoplastic activity: crystal structure, Hirshfeld surface analysis, DFT calculations and molecular docking analysis
CrystEngComm, 2025, 27, 3806-3822
7250388 CIFC17 H15 N3P 21 21 216.1053; 13.209; 16.219
90; 90; 90
1308Xu, Dongping; Jin, Lizhen; Huang, Mengya; Zhang, Wu
Visible-light-induced selenium-mediated cascade cyclization of 2-isocyanobenzonitriles with secondary amines to access indole-fused polycyclics
Green Chemistry, 2025, 27, 6880-6886
7250395 CIFC41 H34 Cl N2 Ni PP 21 21 219.9018; 16.9395; 19.7237
90; 90; 90
3308.29Li, Jin-Ge; Qiu, Bing-Bo; Jiang, Hui; Song, Mao-Ping; Gong, Jun-Fang
Chiral PCN pincer Ni(ii) complex-catalyzed asymmetric hydrophosphination of 2-alkenoylpyridines with diphenylphosphine
RSC Advances, 2025, 15, 15904-15918
7250396 CIFC42 H36 Cl3 N2 Ni O2 P SP 21 21 2110.22391; 13.9906; 26.8623
90; 90; 90
3842.35Li, Jin-Ge; Qiu, Bing-Bo; Jiang, Hui; Song, Mao-Ping; Gong, Jun-Fang
Chiral PCN pincer Ni(ii) complex-catalyzed asymmetric hydrophosphination of 2-alkenoylpyridines with diphenylphosphine
RSC Advances, 2025, 15, 15904-15918
7250414 CIFC52.3 H66.9 O12.15P 21 21 2112.6137; 16.6885; 23.7719
90; 90; 90
5004.07Gee, Anthony P.; Gianga, Tiberiu-M.; Kociok-Köhn, Gabriele; Pantoş, G. Dan; Lewis, Simon E.
Synthesis and resolution of a 1,1′-biazulene analogue of BINOL
RSC Advances, 2025, 15, 14881-14892
7250415 CIFC52 H66 O12P 21 21 2112.4714; 17.3833; 22.554
90; 90; 90
4889.6Gee, Anthony P.; Gianga, Tiberiu-M.; Kociok-Köhn, Gabriele; Pantoş, G. Dan; Lewis, Simon E.
Synthesis and resolution of a 1,1′-biazulene analogue of BINOL
RSC Advances, 2025, 15, 14881-14892
7250416 CIFC30 H30 O8P 21 21 217.0912; 9.4533; 37.611
90; 90; 90
2521.3Gee, Anthony P.; Gianga, Tiberiu-M.; Kociok-Köhn, Gabriele; Pantoş, G. Dan; Lewis, Simon E.
Synthesis and resolution of a 1,1′-biazulene analogue of BINOL
RSC Advances, 2025, 15, 14881-14892
7250427 CIFC19.92 H11.83 Cl1.83 F N5 O3P 21 21 2116.7979; 22.4214; 35.2924
90; 90; 90
13292.3Song, Luying; Sun, Yuhong; An, Renbo; Wang, Liming; Jin, Ying
Enantioselective synthesis of spiro[indoline-3,1′-pyrazolo[1,2-b]phthalazine] derivatives via an organocatalytic three-component cascade reaction
RSC Advances, 2025, 15, 17031-17035
7250443 CIFC5 H13 N2 O5 PP 21 21 216.1084; 8.9906; 15.92
90; 90; 90
874.3Kwain, Samuel; Morris, James W. D.; McKeon, Jillian Elisa Milanes; Roster, Colm P.; Noori, Monireh; Gibbs, Aysiah R.; Stevenson III, Robert L; McMillen, Colin; Dominy, Brian N.; Morris, James C.; Whitehead, Daniel Charles
Assessment of the structure-activity relationship of analogs of the Naegleria fowleri enolase inhibitor HEX
RSC Medicinal Chemistry, 2025
7250447 CIFC5 H14 Cl4 Cu N2P 21 21 218.9767; 9.9167; 13.7275
90; 90; 90
1222Zuo, Kang; Yu, Ruisi; Bao, Wei; Shao, Shuai; Cao, Qing-Ling; Du, Hao; Tian, Linna; Zhao, Jia-Jia; Chen, Li-Zhuang
A stable and sensitive organic–inorganic hybrid reversible thermochromic material: [1-(2-fluoroethyl)piperazine]2[CuCl4]
CrystEngComm, 2025, 27, 4707-4712
7250448 CIFC6 H15 Cl4 Cu N2P 21 21 217.5307; 9.9035; 17.459
90; 90; 90
1302.1Zuo, Kang; Yu, Ruisi; Bao, Wei; Shao, Shuai; Cao, Qing-Ling; Du, Hao; Tian, Linna; Zhao, Jia-Jia; Chen, Li-Zhuang
A stable and sensitive organic–inorganic hybrid reversible thermochromic material: [1-(2-fluoroethyl)piperazine]2[CuCl4]
CrystEngComm, 2025, 27, 4707-4712
7250466 CIFC19 H21 N O4P 21 21 215.6443; 17.2728; 17.5092
90; 90; 90
1707Jemai, Mahdi; Barceló-Oliver, Miquel; Marouani, Houda; Roisnel, Thierry; Frontera, Antonio; Prohens, Rafel
Structural and computational analysis of H-bond mediated anion⋯anion interactions in new salts of fumaric and maleic acids
CrystEngComm, 2025, 27, 4686-4698
7250468 CIFC32 H25 N O2P 21 21 2110.4369; 10.7155; 21.6126
90; 90; 90
2417.08Groenewaldt, Jaime-lee; Barton, Benita; Hosten, Eric C.
The selectivity behaviour of 9,9′-bifluorenyl-9,9′-diol as a host compound for highly efficient separations of mixed pyridines
CrystEngComm, 2025, 27, 4176-4188
7250474 CIFC18 H16 O2P 21 21 215.926; 11.6332; 19.3715
90; 90; 90
1335.44Chen, Yirui; Cheng, Yuqi; Tong, Wanting; Wu, Hangtao; Zhao, Chuhan; Song, Dingguo; Ling, Fei; Zhong, Weihui
Supported manganese catalysts achieve highly efficient C–H bond oxidation and olefin epoxidation
Green Chemistry, 2025, 27, 7717-7727
7250488 CIFC23 H25 Br2 Cl N8 O2P 21 21 214.4671; 14.8151; 39.6576
90; 90; 90
2624.6Al-Buthabhak, Hawraa S.; Al-Ameed, Karrar; Yu, Yu; Sobolev, Alexandre N.; Moggach, Stephen A.; Al-Salami, Hani; Ferro, Vito; Baker, Murray V.
Gold(i) and gold(iii) complexes of triazolyl-functionalised NHCs
RSC Advances, 2025, 15, 18123-18141
7250514 CIFC24 H16 Cl N O2P 21 21 217.5166; 16.8538; 28.8531
90; 90; 90
3655.21Enamullah, Mohammed; Haque, Imdadul; Resma, Amina Khan; Abdullah, Galib; Uddin, Md. Najem; Haj Hassani Sohi, Takin; Woschko, Dennis; Ferber, Peter; Janiak, Christoph
Square planar vs. pyramidal copper(ii)-complexes with benzylal vs. naphthylal-based Schiff bases
RSC Advances, 2025, 15, 18358-18371
7250572 CIFC31 H32 O3P 21 21 216.4947; 13.8436; 27.5171
90; 90; 90
2474.06Reinhard, Garrett L.; Dowling, Reed; Hewitt, Patrick; Varshney, Vikas; Simone, Davide L.
An efficient pathway to high persistence length helicenes from scalable [4]-helicene synthons
RSC Advances, 2025, 15, 20935-20943
7250591 CIFC16 H22 F N O3P 21 21 215.5276; 22.2991; 12.726
90; 90; 90
1568.61Chen, Jing; Chen, Xi; Song, Jinsong; Zhang, Hongliu; Yang, Hongjiang; Feng, Jinhui; Wu, Qiaqing; Zhu, Dunming
Enzymatic synthesis of four stereoisomers of 3-substituted-4-hydroxypiperidines by carbonyl reductase-catalyzed reduction
RSC Advances, 2025, 15, 21133-21141
7250592 CIFC16 H22 F N O3P 21 21 216.08342; 12.36031; 21.0393
90; 90; 90
1582.01Chen, Jing; Chen, Xi; Song, Jinsong; Zhang, Hongliu; Yang, Hongjiang; Feng, Jinhui; Wu, Qiaqing; Zhu, Dunming
Enzymatic synthesis of four stereoisomers of 3-substituted-4-hydroxypiperidines by carbonyl reductase-catalyzed reduction
RSC Advances, 2025, 15, 21133-21141
7250593 CIFC16 H22 F N O3P 21 21 216.0869; 12.398; 20.9757
90; 90; 90
1582.94Chen, Jing; Chen, Xi; Song, Jinsong; Zhang, Hongliu; Yang, Hongjiang; Feng, Jinhui; Wu, Qiaqing; Zhu, Dunming
Enzymatic synthesis of four stereoisomers of 3-substituted-4-hydroxypiperidines by carbonyl reductase-catalyzed reduction
RSC Advances, 2025, 15, 21133-21141
7250594 CIFC16 H22 N O3P 21 21 216.2527; 13.3719; 18.7005
90; 90; 90
1563.6Chen, Jing; Chen, Xi; Song, Jinsong; Zhang, Hongliu; Yang, Hongjiang; Feng, Jinhui; Wu, Qiaqing; Zhu, Dunming
Enzymatic synthesis of four stereoisomers of 3-substituted-4-hydroxypiperidines by carbonyl reductase-catalyzed reduction
RSC Advances, 2025, 15, 21133-21141
7250661 CIFC22 H28 O8P 21 21 218.25833; 12.69524; 20.3354
90; 90; 90
2131.99Williams, Katherine; Spencer, Catherine E.; de Mattos-Shipley, Kate M. J.; Shah, Anjali D.; Dao, Trong-Tuan; Davies, Jonathan A.; Heard, David M.; Song, Zhongshu; Winter, Ashley J.; Crump, Matthew P.; Willis, Christine L.; Bailey, Andrew M.
In vivo and in vitro investigations provide insights into maleidride biosynthesis in fungi
RSC Advances, 2025, 15, 22799-22806
7250682 CIFC12 H28 N6 O7P 21 21 218.7794; 10.2396; 20.7518
90; 90; 90
1865.54Chen, Lei; Shen, Zhili; Kong, Deren; Zhang, Chong; Hu, Bingcheng; Gao, Chao
Improving the anti-hygroscopicity and safety of hydroxylamine pentazolate salt (NH3OH+N5−) by cocrystallization
CrystEngComm, 2025, 27, 5312-5318
7250698 CIFC20 H30 O4P 21 21 2112.0825; 12.7004; 12.9052
90; 90; 90
1980.3Su, Wan-Bai; Hou, Xiao-Meng; Zhang, Ling; Yan, Li; Tang, Zhi-Yang; Yu, Yang; Liu, Jin-Song; Sun, Yun-Peng; Wang, Guo-Kai
Muhenrins A–C, pimarane-type diterpenoids from Munronia henryi
RSC Advances, 2025, 15, 25542-25547
7250751 CIFC24 H22 O2P 21 21 217.9481; 12.8917; 17.71
90; 90; 90
1814.6Ahamad, Jarish; Khatua, Rashmi Ranjan; Khan, Faiz Ahmed
Lewis acid-promoted intramolecular cyclization of ortho-prenylated chalcones: application to first total synthesis of (±) involucrasin C and its novel analogues
RSC Advances, 2025, 15, 27254-27259
7250802 CIFC16 H22 B D F4 N2P 21 21 217.1533; 13.3033; 17.4216
90; 90; 90
1657.88Ozeryanskii, Valery A.; Demidov, Oleg P.; Marchenko, Andrey V.
Intramolecular hydrogen bonding in 1,8-bis(dimethylamino)naphthalenes containing two to four heteroatomic functions in the ortho- and peri-positions: from CD3 to sulfur and selenium
CrystEngComm, 2025, 27, 6163-6173
7250816 CIFC16 H14 F N O2P 21 21 217.3027; 10.689; 17.559
90; 90; 90
1370.6Fu, Han; Wang, Feixia; Wu, Ziyan; Xie, Xiaoyu; Zhang, Yicheng; Liu, Jie; Wang, Lei
Tetrabutylammonium decatungstate-catalyzed hydroalkylation/alkoxylation of 3-methyleneisoindolin-1-ones with alcohols/ethers through hydrogen atom transfer process
RSC Advances, 2025, 15, 30285-30289
7250819 CIFC21 H32 N O2 P S2P 21 21 2112.713; 12.93; 14.0951
90; 90; 90
2316.94Kumar, Pretam; Gomila, Rosa M.; Frontera, Antonio; Pandey, Sushil K.
Establishing σ-hole tetrel bonds by hemidirected lead(ii) phosphonodithioates
CrystEngComm, 2025, 27, 6386-6396
7250863 CIFC12 H15 N O5P 21 21 215.9429; 11.8071; 18.0729
90; 90; 90
1268.15Karthick, Subramani; Li, Bing-Xiang; Sridhar, Balasubramanian; Aya, Satoshi; Brahadeeswaran, Srinivasan
Pyrrolidin-1-ium-2-carboxylate·4-hydroxybenzoic acid co-crystal: a novel phase-matchable acentric organic material for efficient second-harmonic generation
CrystEngComm, 2025, 27, 6449-6461
7250904 CIFC15 H11 F O2P 21 21 217.1384; 12.7929; 12.9301
90; 90; 90
1180.79Cassará, María Lucrecia Arias; Pérez, Hiram; Davies, Lilian E.; Echeverría, Gustavo A.; Piro, Oscar E.; Gil, Diego M.
Deciphering weak hydrogen bonds, halogen bonds, and π-stacking interactions in two fluorinated 2′-hydroxychalcones: insights from experimental and theoretical analysis
CrystEngComm, 2025, 27, 6781-6796
7250911 CIFC35 H38 N4 Ni O3P 21 21 218.0669; 11.4585; 32.7459
90; 90; 90
3026.85Hayriyan, Liana; Grigoryan, Anna; Gevorgyan, Hasmik; Tsaturyan, Avetis; Sargsyan, Armen; Langer, Peter; Saghyan, Ashot; Mkrtchyan, Anna
A<sup>3</sup>-Mannich coupling reaction <i>via</i> chiral propargylglycine Ni(ii) complex: an approach for synthesizing enantiomerically enriched unnatural α-amino acids.
RSC advances, 2025, 15, 35379-35387
7250912 CIFC41 H40 N4 Ni O4P 21 21 219.27604; 9.63867; 38.6709
90; 90; 90
3457.51Hayriyan, Liana; Grigoryan, Anna; Gevorgyan, Hasmik; Tsaturyan, Avetis; Sargsyan, Armen; Langer, Peter; Saghyan, Ashot; Mkrtchyan, Anna
A<sup>3</sup>-Mannich coupling reaction <i>via</i> chiral propargylglycine Ni(ii) complex: an approach for synthesizing enantiomerically enriched unnatural α-amino acids.
RSC advances, 2025, 15, 35379-35387
7250932 CIFC73 H67 N4 O8 TbP 21 21 2117.0372; 17.9771; 21.5515
90; 90; 90
6600.8Wang, Taoyu; Peng, Yanhong; Wang, Yang; Gao, Congli; Li, Xi-Li
Impact of nuclear number on SHG and THG performances: a comparative study of chiral mono- and dinuclear TbIII complexes with identical organic ligands
CrystEngComm, 2025, 27, 7213-7218
7250938 CIFC5 H10 O5P 21 21 214.8396; 6.516; 19.4563
90; 90; 90
613.55Wu, Qingfeng; Li, chuchu; Li, Xintong; Xiao, Yuting; Ding, Qin; Zhou, Qing
Photoluminescence and mechanism insights of isomers D- (-)-Arabinose and L-(+)-Arabinose crystals
Physical Chemistry Chemical Physics, 2025
7250939 CIFC5 H10 O5P 21 21 214.8438; 6.522; 19.4436
90; 90; 90
614.25Wu, Qingfeng; Li, chuchu; Li, Xintong; Xiao, Yuting; Ding, Qin; Zhou, Qing
Photoluminescence and mechanism insights of isomers D- (-)-Arabinose and L-(+)-Arabinose crystals
Physical Chemistry Chemical Physics, 2025
7250957 CIFC18 H12 N4 O7P 21 21 216.8385; 8.6736; 27.7797
90; 90; 90
1647.74Ahmed, Ruby; Ali, Farman; Alam, Mohammad Jane; Tameem, Mohd; Ali, Abid; Ahmad, Musheer; Khan, Mohd Adeel
Fluorescence quenching aptitude of carbazole for the detection of nitro-aromatics: a comprehensive experimental analysis and computational studies validation.
RSC advances, 2025, 15, 29479-29489
7251006 CIFC25.5 H26.5 Cl0.5 N2 O8 SP 21 21 2113.1247; 13.4043; 28.9113
90; 90; 90
5086.3Naumkina, Yelizaveta; Kratochvil, B.; Korotkova, Elena; Cejka, Jan
New forms of apremilast with halogen derivates of benzoic acid
CrystEngComm, 2025
7251007 CIFC25.5 H26.5 Br0.5 N2 O8 SP 21 21 2113.2266; 13.4694; 28.8772
90; 90; 90
5144.6Naumkina, Yelizaveta; Kratochvil, B.; Korotkova, Elena; Cejka, Jan
New forms of apremilast with halogen derivates of benzoic acid
CrystEngComm, 2025
7251009 CIFC93 H86 F42 N4 O13 Yb2P 21 21 2120.1753; 21.9101; 23.9762
90; 90; 90
10598.5Douib, Haiet; Lefeuvre, Bertrand; Flores Gonzalez, Jessica; Dorcet, Vincent; Pointillart, Fabrice
Versatility of the Methyl-Bipyrimidine-N-oxide Ligand for the Design of Lanthanide Single-Molecule Magnets
CrystEngComm, 2025
7251010 CIFC93 H92 F42 N4 O13 Yb2P 21 21 2120.1867; 21.914; 23.957
90; 90; 90
10597.9Douib, Haiet; Lefeuvre, Bertrand; Flores Gonzalez, Jessica; Dorcet, Vincent; Pointillart, Fabrice
Versatility of the Methyl-Bipyrimidine-N-oxide Ligand for the Design of Lanthanide Single-Molecule Magnets
CrystEngComm, 2025
7251011 CIFC93 H92 Dy2 F42 N4 O13P 21 21 2120.3763; 21.8829; 23.9653
90; 90; 90
10685.9Douib, Haiet; Lefeuvre, Bertrand; Flores Gonzalez, Jessica; Dorcet, Vincent; Pointillart, Fabrice
Versatility of the Methyl-Bipyrimidine-N-oxide Ligand for the Design of Lanthanide Single-Molecule Magnets
CrystEngComm, 2025
7251016 CIFC93 H92 Dy2 F42 N4 O13P 21 21 2120.373; 21.863; 23.974
90; 90; 90
10678Douib, Haiet; Lefeuvre, Bertrand; Flores Gonzalez, Jessica; Dorcet, Vincent; Pointillart, Fabrice
Versatility of the Methyl-Bipyrimidine-N-oxide Ligand for the Design of Lanthanide Single-Molecule Magnets
CrystEngComm, 2025
7251055 CIFC14 H18 O10P 21 21 217.4995; 13.933; 14.2792
90; 90; 90
1492Uzma,; Parveen, Mehtab; Fatima, Sabiha; Kumar, Avadhesh; Azeem, Mohammad; Siddiqui, Masooma; Alam, Mahboob
Isolation and comprehensive characterization of a bioactive compound from Garcinia nervosa: single-crystal X-ray diffraction, antioxidant, protein-binding, and chemosensing studies
RSC Advances, 2025, 15, 38916-38932
7251191 CIFC24 H20 N4 O8 S2P 21 21 217.8117; 13.3456; 22.478
90; 90; 90
2343.4Dong, Fu-Wan; Zhang, Yang-Lu; Zhang, Kun-Hua; Chen, Yi; Sun, Ao-Na; Shao, Dong
Proton conduction in three molecular assemblies of bipyridyl-organodisulfonate salts
CrystEngComm, 2025
7251194 CIFC13 H14 N2 O3P 21 21 218.1357; 10.6328; 14.3118
90; 90; 90
1238.05Zhang, Jing-Yi; Li, Ming-Han; Cui, Yu-Shun; Yang, Ying; Lai, Miao; Gao, Zi-Xun; Zheng, Lin-Yu; Lu, Si-Ao; Liu, Bin-Tao; Lu, Fang-Ling; Feng, Yu-Lin
Site-selective electrochemical C(sp3)–H late-stage functionalization of pyrazolones
Green Chemistry, 2025, 27, 14783-14791

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