Crystallography Open Database

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7251003 CIFC25.5 H26.5 Cl0.5 N2 O8 SP 41 21 213.0114; 13.0114; 29.2398
90; 90; 90
4950.2Naumkina, Yelizaveta; Kratochvíl, Bohumil; Korotkova, Elena; Čejka, Jan
New forms of apremilast with halogen derivatives of benzoic acid
CrystEngComm, 2025, 27, 7713-7720
7251004 CIFC25.5 H26.5 Cl0.5 N2 O8 SP 41 21 213.0171; 13.0171; 29.3731
90; 90; 90
4977.12Naumkina, Yelizaveta; Kratochvíl, Bohumil; Korotkova, Elena; Čejka, Jan
New forms of apremilast with halogen derivatives of benzoic acid
CrystEngComm, 2025, 27, 7713-7720
7251005 CIFC25.5 H26.5 Br0.5 N2 O8 SP 41 21 213.0239; 13.0239; 29.5351
90; 90; 90
5009.8Naumkina, Yelizaveta; Kratochvíl, Bohumil; Korotkova, Elena; Čejka, Jan
New forms of apremilast with halogen derivatives of benzoic acid
CrystEngComm, 2025, 27, 7713-7720
7251006 CIFC25.5 H26.5 Cl0.5 N2 O8 SP 21 21 2113.1247; 13.4043; 28.9113
90; 90; 90
5086.3Naumkina, Yelizaveta; Kratochvíl, Bohumil; Korotkova, Elena; Čejka, Jan
New forms of apremilast with halogen derivatives of benzoic acid
CrystEngComm, 2025, 27, 7713-7720
7251007 CIFC25.5 H26.5 Br0.5 N2 O8 SP 21 21 2113.2266; 13.4694; 28.8772
90; 90; 90
5144.6Naumkina, Yelizaveta; Kratochvíl, Bohumil; Korotkova, Elena; Čejka, Jan
New forms of apremilast with halogen derivatives of benzoic acid
CrystEngComm, 2025, 27, 7713-7720
7251008 CIFC63 H29 Dy3 F54 N8 O22C 1 2/c 121.636; 15.445; 27.323
90; 99.797; 90
8997Douib, Haiet; Lefeuvre, Bertrand; Flores Gonzalez, Jessica; Dorcet, Vincent; Pointillart, Fabrice
Versatility of the methyl-bipyrimidine-<i>N</i>-oxide ligand for the design of lanthanide single-molecule magnets.
CrystEngComm, 2025, 27, 7677-7688
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-<i>N</i>-oxide ligand for the design of lanthanide single-molecule magnets.
CrystEngComm, 2025, 27, 7677-7688
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-<i>N</i>-oxide ligand for the design of lanthanide single-molecule magnets.
CrystEngComm, 2025, 27, 7677-7688
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-<i>N</i>-oxide ligand for the design of lanthanide single-molecule magnets.
CrystEngComm, 2025, 27, 7677-7688
7251012 CIFC88 H34 F84 N8 O34 Yb6P 1 21/c 124.4464; 18.0114; 32.9488
90; 110.32; 90
13605Douib, Haiet; Lefeuvre, Bertrand; Flores Gonzalez, Jessica; Dorcet, Vincent; Pointillart, Fabrice
Versatility of the methyl-bipyrimidine-<i>N</i>-oxide ligand for the design of lanthanide single-molecule magnets.
CrystEngComm, 2025, 27, 7677-7688
7251013 CIFC50 H22 Cl2 Dy2 F36 N8 O14P 1 21/n 112.0886; 13.4975; 21.222
90; 93.84; 90
3454.9Douib, Haiet; Lefeuvre, Bertrand; Flores Gonzalez, Jessica; Dorcet, Vincent; Pointillart, Fabrice
Versatility of the methyl-bipyrimidine-<i>N</i>-oxide ligand for the design of lanthanide single-molecule magnets.
CrystEngComm, 2025, 27, 7677-7688
7251014 CIFC33 H20 F9 N4 O7 S3 YbP b c n33.7474; 10.9749; 20.4309
90; 90; 90
7567.1Douib, Haiet; Lefeuvre, Bertrand; Flores Gonzalez, Jessica; Dorcet, Vincent; Pointillart, Fabrice
Versatility of the methyl-bipyrimidine-<i>N</i>-oxide ligand for the design of lanthanide single-molecule magnets.
CrystEngComm, 2025, 27, 7677-7688
7251015 CIFC39 H14 F36 N4 O13 Yb2P -111.695; 15.9999; 16.7054
71.873; 70.644; 81.626
2799.7Douib, Haiet; Lefeuvre, Bertrand; Flores Gonzalez, Jessica; Dorcet, Vincent; Pointillart, Fabrice
Versatility of the methyl-bipyrimidine-<i>N</i>-oxide ligand for the design of lanthanide single-molecule magnets.
CrystEngComm, 2025, 27, 7677-7688
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-<i>N</i>-oxide ligand for the design of lanthanide single-molecule magnets.
CrystEngComm, 2025, 27, 7677-7688
7251017 CIFC88 H34 Dy6 F84 N8 O34P 1 21/n 116.4799; 19.9305; 43.082
90; 93.33; 90
14126.5Douib, Haiet; Lefeuvre, Bertrand; Flores Gonzalez, Jessica; Dorcet, Vincent; Pointillart, Fabrice
Versatility of the methyl-bipyrimidine-<i>N</i>-oxide ligand for the design of lanthanide single-molecule magnets.
CrystEngComm, 2025, 27, 7677-7688
7251018 CIFC13 H13 Br2 N O2P 1 21/c 110.5935; 14.8164; 9.1423
90; 114.945; 90
1301.09Jia, Longxia; Liu, Hongling; Shi, Weiwei; Xu, Yingru; Sun, Ruihan; Zuo, Jia; Wang, Bin; Huang, Jianjian; Zhong, Fangrui; Wang, Dangui
A bifunctional recyclable Gemini surfactant catalyst for oxidative nitroso Diels–Alder reactions in water
Green Chemistry, 2025, 27, 13885-13892
7251019 CIFC27 H21 N3 OC 1 2/c 117.309; 12.0431; 20.6182
90; 105.402; 90
4143.59Zou, Pei-Sen; Geng, Yi-Fan; Liu, Xiao-Qing; Su, Jun-Cheng; Pan, Cheng-Xue; Mo, Dong-Liang; Su, Gui-Fa
An unexpected transition-metal free regioselective cyclization of alkynyl-tethered indoles to prepare indole-fused azepino[2,1-b]quinazolinones and spiroindole-pyrrolo[2,1-b]quinazolinones
Green Chemistry, 2025, 27, 14556-14563
7251020 CIFC25 H17 N3 OP 1 21/n 111.4831; 11.2094; 15.2029
90; 92.885; 90
1954.42Zou, Pei-Sen; Geng, Yi-Fan; Liu, Xiao-Qing; Su, Jun-Cheng; Pan, Cheng-Xue; Mo, Dong-Liang; Su, Gui-Fa
An unexpected transition-metal free regioselective cyclization of alkynyl-tethered indoles to prepare indole-fused azepino[2,1-b]quinazolinones and spiroindole-pyrrolo[2,1-b]quinazolinones
Green Chemistry, 2025, 27, 14556-14563
7251021 CIFC18 H21 F3 N2C 1 2/c 127.2009; 8.2531; 14.6469
90; 91.613; 90
3286.81Wu, Ziyan; Fang, Guodong; Li, Xindi; Wu, Yuhao; Li, Jinshan; Feng, Yan; Xie, Jialin; Zhou, Xueqing; Wen, Zhenchang; Jia, Chunman
Different paths lead to the same destination: a highly efficient TMSOTf/HFIP catalytic system for large-scale synthesis of fluoroalkyl-containing 4,4′-methylenedianiline (MDA) monomers
Green Chemistry, 2025, 27, 13751-13761
7251022 CIFC16 H18 F2 N2P 1 21/c 112.3495; 7.3054; 15.1869
90; 93.228; 90
1367.96Wu, Ziyan; Fang, Guodong; Li, Xindi; Wu, Yuhao; Li, Jinshan; Feng, Yan; Xie, Jialin; Zhou, Xueqing; Wen, Zhenchang; Jia, Chunman
Different paths lead to the same destination: a highly efficient TMSOTf/HFIP catalytic system for large-scale synthesis of fluoroalkyl-containing 4,4′-methylenedianiline (MDA) monomers
Green Chemistry, 2025, 27, 13751-13761
7251023 CIFC11 H14 N2 OP b c a10.4817; 12.0401; 16.6754
90; 90; 90
2104.45Hu, Qi-Long; Deng, Jun-Jie; Ye, Jia; Li, Jian; Chan, Albert S. C.; Su, Hang; Xiong, Xiao-Feng
Chemoselective Minisci alkylation in aqueous medium: a general strategy for functionalization of complex N-heteroarenes and biomolecules
Green Chemistry, 2025, 27, 13944-13952
7251024 CIFC11 H12 N2 OP -14.8344; 8.9159; 11.6752
76.951; 82.321; 80.632
481.24Hu, Qi-Long; Deng, Jun-Jie; Ye, Jia; Li, Jian; Chan, Albert S. C.; Su, Hang; Xiong, Xiao-Feng
Chemoselective Minisci alkylation in aqueous medium: a general strategy for functionalization of complex N-heteroarenes and biomolecules
Green Chemistry, 2025, 27, 13944-13952
7251025 CIFC13 H15 F3 N2 O2P -19.882; 11.9858; 12.755
81.611; 78.193; 67.255
1360.05Hu, Qi-Long; Deng, Jun-Jie; Ye, Jia; Li, Jian; Chan, Albert S. C.; Su, Hang; Xiong, Xiao-Feng
Chemoselective Minisci alkylation in aqueous medium: a general strategy for functionalization of complex N-heteroarenes and biomolecules
Green Chemistry, 2025, 27, 13944-13952
7251026 CIFC20 H19 N O3C 1 2/c 123.793; 6.0607; 22.675
90; 94.841; 90
3258.1Das, Akash; Chatterjee, Shreyoshi; Guchhait, Nikhil
Janus Particle Type Behavior of a Model Flavone Derivative with Distinct Solvent Dependent Competitive Photoinduced Processes
Physical Chemistry Chemical Physics, 2025
7251027 CIFC13 H2 F10 O SP 1 21 19.0321; 5.9155; 13.5634
90; 108.758; 90
686.19Capozzi, Maria Annunziata M.; Alvarez-Larena, Angel; Piniella Febrer, Joan F.; Cardellicchio, Cosimo
Comparison between the crystal structures of racemic and enantiopure aryl benzyl sulfoxides.
RSC advances, 2025, 15, 37824-37832
7251028 CIFC13 H5 Cl2 F5 O SP 1 21/n 17.8924; 12.8239; 14.3783
90; 96.73; 90
1445.2Capozzi, Maria Annunziata M.; Alvarez-Larena, Angel; Piniella Febrer, Joan F.; Cardellicchio, Cosimo
Comparison between the crystal structures of racemic and enantiopure aryl benzyl sulfoxides.
RSC advances, 2025, 15, 37824-37832
7251029 CIFC14 H13 Br O2 SP -17.3042; 7.6512; 12.3586
96.168; 96.341; 95.461
678.46Capozzi, Maria Annunziata M.; Alvarez-Larena, Angel; Piniella Febrer, Joan F.; Cardellicchio, Cosimo
Comparison between the crystal structures of racemic and enantiopure aryl benzyl sulfoxides.
RSC advances, 2025, 15, 37824-37832
7251030 CIFC11 H5 F5 O S2P 1 21/c 18.5319; 5.3467; 25.5242
90; 97.512; 90
1154.36Capozzi, Maria Annunziata M.; Alvarez-Larena, Angel; Piniella Febrer, Joan F.; Cardellicchio, Cosimo
Comparison between the crystal structures of racemic and enantiopure aryl benzyl sulfoxides.
RSC advances, 2025, 15, 37824-37832
7251031 CIFC13 H10 Br N O3 SP 1 21/n 17.5989; 13.6591; 13.3151
90; 100.127; 90
1360.5Capozzi, Maria Annunziata M.; Alvarez-Larena, Angel; Piniella Febrer, Joan F.; Cardellicchio, Cosimo
Comparison between the crystal structures of racemic and enantiopure aryl benzyl sulfoxides.
RSC advances, 2025, 15, 37824-37832
7251032 CIFC11 H4 Cl F5 O S2P 1 21/c 126.479; 5.1357; 9.4706
90; 92.401; 90
1286.8Capozzi, Maria Annunziata M.; Alvarez-Larena, Angel; Piniella Febrer, Joan F.; Cardellicchio, Cosimo
Comparison between the crystal structures of racemic and enantiopure aryl benzyl sulfoxides.
RSC advances, 2025, 15, 37824-37832
7251033 CIFC11 H4 Cl F5 O S2P 1 21 15.4298; 9.9501; 11.8841
90; 97.249; 90
636.93Capozzi, Maria Annunziata M.; Alvarez-Larena, Angel; Piniella Febrer, Joan F.; Cardellicchio, Cosimo
Comparison between the crystal structures of racemic and enantiopure aryl benzyl sulfoxides.
RSC advances, 2025, 15, 37824-37832
7251034 CIFC13 H10 Br Cl O SP 1 21/c 114.7677; 10.6376; 8.7815
90; 104.795; 90
1333.77Capozzi, Maria Annunziata M.; Alvarez-Larena, Angel; Piniella Febrer, Joan F.; Cardellicchio, Cosimo
Comparison between the crystal structures of racemic and enantiopure aryl benzyl sulfoxides.
RSC advances, 2025, 15, 37824-37832
7251035 CIFC13 H10 Br N O3 SP 1 21/c 15.5795; 15.8279; 15.0311
90; 97.03; 90
1317.44Capozzi, Maria Annunziata M.; Alvarez-Larena, Angel; Piniella Febrer, Joan F.; Cardellicchio, Cosimo
Comparison between the crystal structures of racemic and enantiopure aryl benzyl sulfoxides.
RSC advances, 2025, 15, 37824-37832
7251036 CIFC13 H2 F10 O SP 1 c 112.966; 5.3774; 9.6002
90; 93.82; 90
667.9Capozzi, Maria Annunziata M.; Alvarez-Larena, Angel; Piniella Febrer, Joan F.; Cardellicchio, Cosimo
Comparison between the crystal structures of racemic and enantiopure aryl benzyl sulfoxides.
RSC advances, 2025, 15, 37824-37832
7251037 CIFC15 H10 N2P -18.0709; 8.4139; 9.3777
99.9568; 101.678; 116.603
531.76Ozomarisi, Hamza Enesi; Outlaw, Victor K.
A rapid, metal-free synthesis of amino- and hydroxyphenanthrenes with tunable photophysical properties.
RSC advances, 2025, 15, 38024-38028
7251038 CIFC17 H13 Br O3P 1 21/n 14.52734; 25.31093; 12.21079
90; 93.0826; 90
1397.22Ozomarisi, Hamza Enesi; Outlaw, Victor K.
A rapid, metal-free synthesis of amino- and hydroxyphenanthrenes with tunable photophysical properties.
RSC advances, 2025, 15, 38024-38028
7251039 CIFC53 H69 Cu4 N11 O35P 1 21/c 111.2016; 27.5447; 22.4151
90; 98.98; 90
6831.3Ajibade, Peter A.; Oloyede, Solomon O.
Ultrasensitive electrochemical detection of bisphenol A using copper(ii) metal–organic framework ternary quantum dot (Cu-MOF/TQD) composite-modified gold electrodes
RSC Advances, 2025, 15, 38359-38377
7251040 CIFC17 H12 Cl N O2P 1 21/c 15.5582; 16.5166; 14.6656
90; 90.907; 90
1346.17Chakraborty, Sourav; Bhattachrjyya, Arghyadeep; Paul, Bhaswati; Das, Barnali; Natarajan, Ramalingam; Majumdar, Swapan
Metal-free access to 4-indolyl coumarin from coumarin 3-carboxylic acid and indole <i>via</i> a Michael addition-decarboxylation and dehydrogenation protocol: a photo-physical study and utility as an invisible ink.
RSC advances, 2025, 15, 37888-37898
7251041 CIFC18 H12 Cl N O4P 1 21 114.6606; 7.2869; 16.3207
90; 111.475; 90
1622.5Chakraborty, Sourav; Bhattachrjyya, Arghyadeep; Paul, Bhaswati; Das, Barnali; Natarajan, Ramalingam; Majumdar, Swapan
Metal-free access to 4-indolyl coumarin from coumarin 3-carboxylic acid and indole <i>via</i> a Michael addition-decarboxylation and dehydrogenation protocol: a photo-physical study and utility as an invisible ink.
RSC advances, 2025, 15, 37888-37898
7251042 CIFC26 H40 N0 O33 Sc6P 62 2 214.9796; 14.9796; 25.7042
90; 90; 120
4995Zhang, Liying; Li, Yan; Fan, Meiqing; Gao, Lu; Fan, Yong; Wang, Li
Homochiral coordination polymer with a 1D helical chain based on self-assembly of an achiral Sc(iii) trimer
CrystEngComm, 2025, 27, 7514-7519
7251043 CIFC47 H36 Cd N2 O6P 1 21/c 115.5067; 16.2821; 15.4048
90; 103.201; 90
3786.65Hossain, Ersad; Sil, Sayantan; Malik, Srikanta; Goura, Joydeb; Chatterjee, Moumita; Ray, Partha Pratim; Mir, Mohammad Hedayetullah; Mukhopadhyay, Subrata
Influence of cations on charge transport and Schottky properties in mesaconate-bridged isostructural 1D coordination polymers
CrystEngComm, 2025, 27, 7531-7539
7251044 CIFC47 H38 N2 O6 ZnP 1 21/c 115.3041; 15.6105; 15.5655
90; 103.72; 90
3612.6Hossain, Ersad; Sil, Sayantan; Malik, Srikanta; Goura, Joydeb; Chatterjee, Moumita; Ray, Partha Pratim; Mir, Mohammad Hedayetullah; Mukhopadhyay, Subrata
Influence of cations on charge transport and Schottky properties in mesaconate-bridged isostructural 1D coordination polymers
CrystEngComm, 2025, 27, 7531-7539
7251045 CIFC60 H60 N14 O15P 19.5583; 9.59; 17.1147
78.722; 79.352; 69.659
1430.89Mudda, Ramesh Reddy; Devarapalli, Ramesh; Bollineni, Manjunath; Das, Arijit; Chennuru, Ramanaiah
Emphasis on pharmaceutically acceptable solvates: linking solubility with isostructurality for better drug design
CrystEngComm, 2025, 27, 7562-7574
7251046 CIFC62 H62 N14 O14P 19.49588; 9.79722; 17.0733
78.0108; 81.7049; 70.9622
1463.72Mudda, Ramesh Reddy; Devarapalli, Ramesh; Bollineni, Manjunath; Das, Arijit; Chennuru, Ramanaiah
Emphasis on pharmaceutically acceptable solvates: linking solubility with isostructurality for better drug design
CrystEngComm, 2025, 27, 7562-7574
7251047 CIFC26 H35 N O10P 1 21 15.6929; 17.0162; 13.4451
90; 96.135; 90
1294.99Madu, Shadrack J.; Wang, Ke; Fábián, László; Li, Mingzhong
Novel multicomponent crystal forms of artesunate
CrystEngComm, 2025, 27, 7146-7169
7251048 CIFC22 H35 N3 O9P 1 21 110.5562; 7.3837; 15.7892
90; 98.315; 90
1217.73Madu, Shadrack J.; Wang, Ke; Fábián, László; Li, Mingzhong
Novel multicomponent crystal forms of artesunate
CrystEngComm, 2025, 27, 7146-7169
7251049 CIFC44 H68 N2 O16P 1 21 110.3355; 10.1548; 21.6741
90; 102.644; 90
2219.64Madu, Shadrack J.; Wang, Ke; Fábián, László; Li, Mingzhong
Novel multicomponent crystal forms of artesunate
CrystEngComm, 2025, 27, 7146-7169
7251050 CIFC44 H68 N2 O16P 1 21 111.0046; 8.5912; 23.6155
90; 98.743; 90
2206.7Madu, Shadrack J.; Wang, Ke; Fábián, László; Li, Mingzhong
Novel multicomponent crystal forms of artesunate
CrystEngComm, 2025, 27, 7146-7169
7251051 CIFC31 H36 N2 O8P 1 21 19.57054; 51.5305; 9.8305
90; 118.766; 90
4249.85Madu, Shadrack J.; Wang, Ke; Fábián, László; Li, Mingzhong
Novel multicomponent crystal forms of artesunate
CrystEngComm, 2025, 27, 7146-7169
7251052 CIFC21 H36 N2 O10P 1 21 110.3625; 7.3357; 15.0315
90; 93.125; 90
1140.94Madu, Shadrack J.; Wang, Ke; Fábián, László; Li, Mingzhong
Novel multicomponent crystal forms of artesunate
CrystEngComm, 2025, 27, 7146-7169
7251053 CIFC26 H29 Cl F I N3 O2C 1 2/c 137.035; 9.0602; 15.608
90; 94.353; 90
5222.1Jin, Chengliu; Zhang, Zhen; Liao, Peng; Zhang, Chen; Cao, Hua; Ma, Yanlong
Design, synthesis and structure-activity relationship analysis of the dibenzodiazepinone derivatives against osimertinib resistant NSCLC
RSC Medicinal Chemistry, 2025
7251054 CIFC30 H22 Br2 O4 SP 1 21/n 111.8305; 17.7949; 12.865
90; 103.504; 90
2633.5Chen, Dongdong; Wang, Yan; Wu, Yujun; Yu, Qiaoqiao; Wang, Yunhan; Zheng, Junyao; Ying, Zhong; Hou, Changhui
Design, synthesis and acaricidal activity of tetrahydrothiophene derivatives against Psoroptes cuniculi
RSC Advances, 2025, 15, 39028-39036
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
7251056 CIFC16 H12 N2 O2P 1 21/c 114.5096; 17.8805; 10.3906
90; 110.379; 90
2527Constantin, Ana M.; Mele, Francesco; Botla, Vinayak; Ca', Nicola Della; Maggi, Raimondo; Maestri, Giovanni; Cerveri, Alessandro; Sundermann, Remie M.; Cauzzi, Daniele; Pancrazzi, Francesco; Mazzeo, Paolo P.
A deep dive into mechanochemical organic reactions by accurate crystallographic analysis via TAAM refinement
CrystEngComm, 2026, 28, 2029-2035
7251057 CIFC17 H14 N2 O2P 1 21/c 111.954; 7.454; 15.468
90; 95.33; 90
1372.3Constantin, Ana M.; Mele, Francesco; Botla, Vinayak; Ca', Nicola Della; Maggi, Raimondo; Maestri, Giovanni; Cerveri, Alessandro; Sundermann, Remie M.; Cauzzi, Daniele; Pancrazzi, Francesco; Mazzeo, Paolo P.
A deep dive into mechanochemical organic reactions by accurate crystallographic analysis via TAAM refinement
CrystEngComm, 2026, 28, 2029-2035
7251058 CIFC18 H23 N3 O SP 1 21/n 114.2535; 6.5278; 18.3623
90; 102.641; 90
1667.09Al-Wahaibi, Lamya H.; Blacque, Olivier; Al-Mutairi, Aamal A; El-Emam, Ali A.; Gomila, Rosa Maria; Frontera, Antonio; Tiekink, Edward R. T.
Beyond hydrogen bonds: unveiling the structure-directing role of side-on X···π interactions in adamantane-thiourea crystals
CrystEngComm, 2025
7251059 CIFC18 H21 F2 N3 SP -16.3669; 11.814; 11.8768
78.145; 84.27; 79.081
856.745Al-Wahaibi, Lamya H.; Blacque, Olivier; Al-Mutairi, Aamal A; El-Emam, Ali A.; Gomila, Rosa Maria; Frontera, Antonio; Tiekink, Edward R. T.
Beyond hydrogen bonds: unveiling the structure-directing role of side-on X···π interactions in adamantane-thiourea crystals
CrystEngComm, 2025
7251060 CIFC18 H21 Cl2 N3 SP -17.2877; 11.4798; 11.5478
71.734; 79.215; 83.192
899.36Al-Wahaibi, Lamya H.; Blacque, Olivier; Al-Mutairi, Aamal A; El-Emam, Ali A.; Gomila, Rosa Maria; Frontera, Antonio; Tiekink, Edward R. T.
Beyond hydrogen bonds: unveiling the structure-directing role of side-on X···π interactions in adamantane-thiourea crystals
CrystEngComm, 2025
7251061 CIFC18 H22 N4 O2 SP -16.3418; 11.5247; 12.209
96.592; 97.243; 104.197
848.26Al-Wahaibi, Lamya H.; Blacque, Olivier; Al-Mutairi, Aamal A; El-Emam, Ali A.; Gomila, Rosa Maria; Frontera, Antonio; Tiekink, Edward R. T.
Beyond hydrogen bonds: unveiling the structure-directing role of side-on X···π interactions in adamantane-thiourea crystals
CrystEngComm, 2025
7251062 CIFC11 H10 Br N O3 SP 1 21/n 16.6087; 21.264; 9.0465
90; 106.598; 90
1218.3Čulig, Matija; Nemec, Vinko; Bregović, Nikola; Cinčić, Dominik
Halopyridinium cations as bifunctional donors of halogen and hydrogen bonds in salts with benzenesulfonic and p-toluenesulfonic acids
CrystEngComm, 2025, 27, 7638-7643
7251063 CIFC12 H12 Cl N O3 SP -16.5344; 9.1056; 11.7424
100.892; 91.458; 105.79
658.01Čulig, Matija; Nemec, Vinko; Bregović, Nikola; Cinčić, Dominik
Halopyridinium cations as bifunctional donors of halogen and hydrogen bonds in salts with benzenesulfonic and p-toluenesulfonic acids
CrystEngComm, 2025, 27, 7638-7643
7251064 CIFC11 H10 Cl N O3 SP 1 21/n 16.5431; 20.755; 9.1169
90; 106.423; 90
1187.6Čulig, Matija; Nemec, Vinko; Bregović, Nikola; Cinčić, Dominik
Halopyridinium cations as bifunctional donors of halogen and hydrogen bonds in salts with benzenesulfonic and p-toluenesulfonic acids
CrystEngComm, 2025, 27, 7638-7643
7251065 CIFC66 H54 Br6 I6 N6 O18 S6P n m a16.043; 37.2257; 6.8695
90; 90; 90
4102.5Čulig, Matija; Nemec, Vinko; Bregović, Nikola; Cinčić, Dominik
Halopyridinium cations as bifunctional donors of halogen and hydrogen bonds in salts with benzenesulfonic and p-toluenesulfonic acids
CrystEngComm, 2025, 27, 7638-7643
7251066 CIFC12 H12 I N O3 SP 1 21/n 17.3872; 24.047; 8.6774
90; 113.73; 90
1411.1Čulig, Matija; Nemec, Vinko; Bregović, Nikola; Cinčić, Dominik
Halopyridinium cations as bifunctional donors of halogen and hydrogen bonds in salts with benzenesulfonic and p-toluenesulfonic acids
CrystEngComm, 2025, 27, 7638-7643
7251067 CIFC11 H10 I N O3 SP b c a12.5118; 9.3438; 21.996
90; 90; 90
2571.5Čulig, Matija; Nemec, Vinko; Bregović, Nikola; Cinčić, Dominik
Halopyridinium cations as bifunctional donors of halogen and hydrogen bonds in salts with benzenesulfonic and p-toluenesulfonic acids
CrystEngComm, 2025, 27, 7638-7643
7251068 CIFC12 H12 I N O3 SP 1 21/n 17.6818; 19.4505; 9.7988
90; 111.819; 90
1359.2Čulig, Matija; Nemec, Vinko; Bregović, Nikola; Cinčić, Dominik
Halopyridinium cations as bifunctional donors of halogen and hydrogen bonds in salts with benzenesulfonic and p-toluenesulfonic acids
CrystEngComm, 2025, 27, 7638-7643
7251069 CIFC12 H11 Br I N O3 SP 1 21/c 113.6268; 6.7637; 15.8045
90; 98.434; 90
1440.9Čulig, Matija; Nemec, Vinko; Bregović, Nikola; Cinčić, Dominik
Halopyridinium cations as bifunctional donors of halogen and hydrogen bonds in salts with benzenesulfonic and p-toluenesulfonic acids
CrystEngComm, 2025, 27, 7638-7643
7251070 CIFC12 H12 Br N O3 SP 1 21/n 17.518; 19.441; 9.745
90; 111.921; 90
1321.3Čulig, Matija; Nemec, Vinko; Bregović, Nikola; Cinčić, Dominik
Halopyridinium cations as bifunctional donors of halogen and hydrogen bonds in salts with benzenesulfonic and p-toluenesulfonic acids
CrystEngComm, 2025, 27, 7638-7643
7251071 CIFC11 H10 I N O3 SP b c a12.925; 9.7288; 21.2989
90; 90; 90
2678.2Čulig, Matija; Nemec, Vinko; Bregović, Nikola; Cinčić, Dominik
Halopyridinium cations as bifunctional donors of halogen and hydrogen bonds in salts with benzenesulfonic and p-toluenesulfonic acids
CrystEngComm, 2025, 27, 7638-7643
7251072 CIFC26 H15 Cd N2 O8P 1 21/c 110.3644; 15.773; 13.564
90; 104.357; 90
2148.2Meng, Xin; Shen, Yuan; Hua, Yang; Bai, Yun-Ying; Yang, Yu-Fan; Zhang, Hong
Two Cd(ii)–viologen coordination polymers with wave-like layered structures used as multi-stimulus-responsive materials
CrystEngComm, 2025, 27, 7128-7134
7251073 CIFC52 H44 Cd2 N4 O16P 1 21/n 121.6271; 10.1463; 21.9122
90; 107.862; 90
4576.53Meng, Xin; Shen, Yuan; Hua, Yang; Bai, Yun-Ying; Yang, Yu-Fan; Zhang, Hong
Two Cd(ii)–viologen coordination polymers with wave-like layered structures used as multi-stimulus-responsive materials
CrystEngComm, 2025, 27, 7128-7134
7251074 CIFC6 H10 N6 OP 1 21/n 16.869; 8.1816; 14.4226
90; 95.38; 90
806.97Guo, Benyue; Hu, Lu; Pang, Siping
A methyl-driven strategy enhances sensitivity through the modulation of aromaticity
CrystEngComm, 2025, 27, 7328-7332
7251075 CIFC6 H12 N8 O7C 1 c 113.8934; 11.8961; 8.5408
90; 121.962; 90
1197.6Guo, Benyue; Hu, Lu; Pang, Siping
A methyl-driven strategy enhances sensitivity through the modulation of aromaticity
CrystEngComm, 2025, 27, 7328-7332
7251076 CIFC6 H8 N2 O5P 1 21/c 18.4782; 14.2395; 6.3998
90; 97.711; 90
765.63Guo, Benyue; Hu, Lu; Pang, Siping
A methyl-driven strategy enhances sensitivity through the modulation of aromaticity
CrystEngComm, 2025, 27, 7328-7332
7251077 CIFC6 H5 N3 O2P c c n7.699; 12.322; 14.09
90; 90; 90
1336.7Guo, Benyue; Hu, Lu; Pang, Siping
A methyl-driven strategy enhances sensitivity through the modulation of aromaticity
CrystEngComm, 2025, 27, 7328-7332
7251078 CIFC6 H11 N9 O5C 1 2/c 114.1206; 19.4498; 8.7731
90; 106.183; 90
2314Guo, Benyue; Hu, Lu; Pang, Siping
A methyl-driven strategy enhances sensitivity through the modulation of aromaticity
CrystEngComm, 2025, 27, 7328-7332
7251079 CIFC6 H13 N9 O7P -112.646; 13.107; 15.668
89.95; 79.6; 87.27
2551Guo, Benyue; Hu, Lu; Pang, Siping
A methyl-driven strategy enhances sensitivity through the modulation of aromaticity
CrystEngComm, 2025, 27, 7328-7332
7251080 CIFC10 H3 F5 SP -16.4378; 7.2041; 19.8873
94.374; 90.518; 94.324
916.94Yonezawa, Takeharu; Ito, Hajime; Jin, Mingoo
Systematic investigation of the effect of trialkylsilyl groups on the crystal structures of perfluorophenyl-substituted thiophene
CrystEngComm, 2026, 28, 390-395
7251081 CIFC19 H23 F5 S SiP 1 21/n 18.5617; 19.8126; 11.6723
90; 94.529; 90
1973.78Yonezawa, Takeharu; Ito, Hajime; Jin, Mingoo
Systematic investigation of the effect of trialkylsilyl groups on the crystal structures of perfluorophenyl-substituted thiophene
CrystEngComm, 2026, 28, 390-395
7251082 CIFC13 H11 F5 S SiP c a 2130.7633; 6.8541; 13.4097
90; 90; 90
2827.5Yonezawa, Takeharu; Ito, Hajime; Jin, Mingoo
Systematic investigation of the effect of trialkylsilyl groups on the crystal structures of perfluorophenyl-substituted thiophene
CrystEngComm, 2026, 28, 390-395
7251083 CIFC16 H17 F5 S SiP -17.453; 7.5747; 17.1723
85.62; 80.227; 61.642
840.72Yonezawa, Takeharu; Ito, Hajime; Jin, Mingoo
Systematic investigation of the effect of trialkylsilyl groups on the crystal structures of perfluorophenyl-substituted thiophene
CrystEngComm, 2026, 28, 390-395
7251084 CIFC4 H13 Cl2 N5P 1 21 17.0914; 5.7846; 12.48
90; 105.231; 90
493.96Hitchings, Thomas; Students, School Project; Shepherd, Angela; Alfredsson, Maria; Saines, Paul James
Analysis of a New Hydrochloride Salt of the Common Pharmaceutical Metformin
CrystEngComm, 2025
7251085 CIFC96 H104 N24 O48 P16 Pt12P 1 21/n 112.0055; 25.3262; 24.2636
90; 94.6459; 90
7353.2Uemura, Kazuhiro; Kanamori, Shota
Electrostatically assembled one-dimensional platinum chains with red-shifted MMLCT transitions
CrystEngComm, 2025, 27, 7633-7637
7251086 CIFC24 H28 N6 O12 P4 Pt3P 1 21/n 113.0195; 18.9029; 15.0103
90; 90.943; 90
3693.63Uemura, Kazuhiro; Kanamori, Shota
Electrostatically assembled one-dimensional platinum chains with red-shifted MMLCT transitions
CrystEngComm, 2025, 27, 7633-7637
7251087 CIFC29 H24 N5 O4.5C 1 2/c 133.386; 11.052; 14.922
90; 100.97; 90
5405.3Nicholson, Elliot J.; Hanton, Lyall R.; Macreadie, Lauren K.
Metal ion influence on paddlewheel SBUs formed from a mixed donor multidentate ligand and the consequences for MOF structures
CrystEngComm, 2025, 27, 7135-7145
7251088 CIFC27 H14 Cu1.5 N4 O5.5P 42/n b c :232.051; 32.051; 28.537
90; 90; 90
29315Nicholson, Elliot J.; Hanton, Lyall R.; Macreadie, Lauren K.
Metal ion influence on paddlewheel SBUs formed from a mixed donor multidentate ligand and the consequences for MOF structures
CrystEngComm, 2025, 27, 7135-7145
7251089 CIFC62 H48 Mg2 N10 O15P 1 21/c 119.8544; 18.8871; 20.3096
90; 111.172; 90
7101.87Nicholson, Elliot J.; Hanton, Lyall R.; Macreadie, Lauren K.
Metal ion influence on paddlewheel SBUs formed from a mixed donor multidentate ligand and the consequences for MOF structures
CrystEngComm, 2025, 27, 7135-7145
7251090 CIFC162 H84 Gd4 N24 O25I -442.346; 42.346; 33.254
90; 90; 90
59631Nicholson, Elliot J.; Hanton, Lyall R.; Macreadie, Lauren K.
Metal ion influence on paddlewheel SBUs formed from a mixed donor multidentate ligand and the consequences for MOF structures
CrystEngComm, 2025, 27, 7135-7145
7251091 CIFC27 H14.62 Cu1.5 N4 O5.5P 42/n b c :233.9994; 33.9994; 21.8483
90; 90; 90
25255.7Nicholson, Elliot J.; Hanton, Lyall R.; Macreadie, Lauren K.
Metal ion influence on paddlewheel SBUs formed from a mixed donor multidentate ligand and the consequences for MOF structures
CrystEngComm, 2025, 27, 7135-7145
7251092 CIFC54 H28 Ca2 N8 O10P 3218.9715; 18.9715; 24.607
90; 90; 120
7670Nicholson, Elliot J.; Hanton, Lyall R.; Macreadie, Lauren K.
Metal ion influence on paddlewheel SBUs formed from a mixed donor multidentate ligand and the consequences for MOF structures
CrystEngComm, 2025, 27, 7135-7145
7251093 CIFC64 H84 N4 O17P -113.651; 14.252; 15.902
88.819; 81.557; 74.642
2950.4Kawahata, Masatoshi; Makino, Hayahide; Hyodo, Tadashi; Tominaga, Masahide; Yamaguchi, Kentaro
Tetrameric H-shaped assemblies as a motif in inclusion crystals of bent-shaped host molecules having nitrophenol moieties
CrystEngComm, 2025, 27, 7655-7661
7251094 CIFC26 H28 N2 O8P -17.0389; 10.51; 15.782
91.671; 90.864; 100.318
1147.9Kawahata, Masatoshi; Makino, Hayahide; Hyodo, Tadashi; Tominaga, Masahide; Yamaguchi, Kentaro
Tetrameric H-shaped assemblies as a motif in inclusion crystals of bent-shaped host molecules having nitrophenol moieties
CrystEngComm, 2025, 27, 7655-7661
7251095 CIFC26 H30 N2 O8P n m a22.1125; 6.6904; 16.0518
90; 90; 90
2374.7Kawahata, Masatoshi; Makino, Hayahide; Hyodo, Tadashi; Tominaga, Masahide; Yamaguchi, Kentaro
Tetrameric H-shaped assemblies as a motif in inclusion crystals of bent-shaped host molecules having nitrophenol moieties
CrystEngComm, 2025, 27, 7655-7661
7251096 CIFC22 H22 Br2 O2P 1 21/c 113.123; 11.645; 12.458
90; 106.293; 90
1827.3Kawahata, Masatoshi; Makino, Hayahide; Hyodo, Tadashi; Tominaga, Masahide; Yamaguchi, Kentaro
Tetrameric H-shaped assemblies as a motif in inclusion crystals of bent-shaped host molecules having nitrophenol moieties
CrystEngComm, 2025, 27, 7655-7661
7251097 CIFC13 H6 F5 N O SP 1 21/n 16.8713; 12.7549; 14.2974
90; 97.542; 90
1242.22Toshima, Ryo; Eguchi, Yuto; Oshima, Ibuki; Yoshino, Riku; Tamano, Natsuki; Fukumoto, Hiroki; Yasui, Motohiro; Konno, Tsutomu; Yamada, Shigeyuki; Morita, Masato
Co-crystallization of benzothiazole via halogen and hydrogen bonding: crystal structure and photoluminescence properties
CrystEngComm, 2025, 27, 7649-7654
7251098 CIFC14 H6 F5 N O2 SC 1 c 112.7322; 12.9715; 8.4476
90; 101.938; 90
1364.99Toshima, Ryo; Eguchi, Yuto; Oshima, Ibuki; Yoshino, Riku; Tamano, Natsuki; Fukumoto, Hiroki; Yasui, Motohiro; Konno, Tsutomu; Yamada, Shigeyuki; Morita, Masato
Co-crystallization of benzothiazole via halogen and hydrogen bonding: crystal structure and photoluminescence properties
CrystEngComm, 2025, 27, 7649-7654
7251099 CIFC20 H10 F4 I2 N2 S2P 1 21/n 110.4312; 4.2982; 23.6454
90; 97.6; 90
1050.84Toshima, Ryo; Eguchi, Yuto; Oshima, Ibuki; Yoshino, Riku; Tamano, Natsuki; Fukumoto, Hiroki; Yasui, Motohiro; Konno, Tsutomu; Yamada, Shigeyuki; Morita, Masato
Co-crystallization of benzothiazole via halogen and hydrogen bonding: crystal structure and photoluminescence properties
CrystEngComm, 2025, 27, 7649-7654
7251100 CIFC32 H19 Cl3 N4 S2P 1 21/c 110.29396; 23.41077; 11.59685
90; 91.6145; 90
2793.61Ogawa, Kota; Sumida, Ayaka; Kubota, Rikuto; Tachikawa, Takashi; Ito, Suguru
Reprecipitation-driven access to solvates and solvent-free crystals: achieving two-solvent-mediated vapochromic luminescence
CrystEngComm, 2025, 27, 7484-7490
7251101 CIFC31 H18 N4 S2P 1 21 111.7158; 5.8667; 17.82
90; 106.345; 90
1175.32Ogawa, Kota; Sumida, Ayaka; Kubota, Rikuto; Tachikawa, Takashi; Ito, Suguru
Reprecipitation-driven access to solvates and solvent-free crystals: achieving two-solvent-mediated vapochromic luminescence
CrystEngComm, 2025, 27, 7484-7490
7251102 CIFC15 H15 Ag N4 O3P 32 2 110.6796; 10.6796; 25.274
90; 90; 120
2496.4Radiush, Ekaterina A.; Sinelnikov, Gleb O.; Sukhikh, Taisiya Sergeevna; Shurikov, Matvey K.; Shamshurin, Maxim; Semenov, Nikolay A.; Postnikov, Pavel S.; Sokolov, Maksim Nailyevich; Abramov, Pavel A.
Substituent effects on the structure of [Ag(py-R)n](NO3) ionic pairs: structural and computational studies
CrystEngComm, 2025
7251103 CIFC15 H12 Ag Br3 N4 O3P -17.4692; 9.0221; 15.0268
80.89; 81.659; 82.125
982.51Radiush, Ekaterina A.; Sinelnikov, Gleb O.; Sukhikh, Taisiya Sergeevna; Shurikov, Matvey K.; Shamshurin, Maxim; Semenov, Nikolay A.; Postnikov, Pavel S.; Sokolov, Maksim Nailyevich; Abramov, Pavel A.
Substituent effects on the structure of [Ag(py-R)n](NO3) ionic pairs: structural and computational studies
CrystEngComm, 2025
7251104 CIFC15 H15 Ag N4 O3C 1 2/c 118.667; 10.5025; 17.581
90; 99.65; 90
3398Radiush, Ekaterina A.; Sinelnikov, Gleb O.; Sukhikh, Taisiya Sergeevna; Shurikov, Matvey K.; Shamshurin, Maxim; Semenov, Nikolay A.; Postnikov, Pavel S.; Sokolov, Maksim Nailyevich; Abramov, Pavel A.
Substituent effects on the structure of [Ag(py-R)n](NO3) ionic pairs: structural and computational studies
CrystEngComm, 2025
7251105 CIFC18 H21 Ag N4 O3R 3 m :H15.04; 15.04; 7.918
90; 90; 120
1551.1Radiush, Ekaterina A.; Sinelnikov, Gleb O.; Sukhikh, Taisiya Sergeevna; Shurikov, Matvey K.; Shamshurin, Maxim; Semenov, Nikolay A.; Postnikov, Pavel S.; Sokolov, Maksim Nailyevich; Abramov, Pavel A.
Substituent effects on the structure of [Ag(py-R)n](NO3) ionic pairs: structural and computational studies
CrystEngComm, 2025
7251106 CIFC12 H14 Ag N3 O3P -17.3646; 9.0861; 10.5942
88.57; 74.611; 74.664
658.38Radiush, Ekaterina A.; Sinelnikov, Gleb O.; Sukhikh, Taisiya Sergeevna; Shurikov, Matvey K.; Shamshurin, Maxim; Semenov, Nikolay A.; Postnikov, Pavel S.; Sokolov, Maksim Nailyevich; Abramov, Pavel A.
Substituent effects on the structure of [Ag(py-R)n](NO3) ionic pairs: structural and computational studies
CrystEngComm, 2025
7251107 CIFC12 H14 Ag N3 O3P 1 21/n 17.5615; 9.927; 19.0398
90; 99.541; 90
1409.42Radiush, Ekaterina A.; Sinelnikov, Gleb O.; Sukhikh, Taisiya Sergeevna; Shurikov, Matvey K.; Shamshurin, Maxim; Semenov, Nikolay A.; Postnikov, Pavel S.; Sokolov, Maksim Nailyevich; Abramov, Pavel A.
Substituent effects on the structure of [Ag(py-R)n](NO3) ionic pairs: structural and computational studies
CrystEngComm, 2025
7251108 CIFC12 H14 Ag N3 O3C 1 2/c 17.5095; 20.5024; 9.176
90; 105.706; 90
1360Radiush, Ekaterina A.; Sinelnikov, Gleb O.; Sukhikh, Taisiya Sergeevna; Shurikov, Matvey K.; Shamshurin, Maxim; Semenov, Nikolay A.; Postnikov, Pavel S.; Sokolov, Maksim Nailyevich; Abramov, Pavel A.
Substituent effects on the structure of [Ag(py-R)n](NO3) ionic pairs: structural and computational studies
CrystEngComm, 2025
7251109 CIFC24 H28 Ag2 N6 O6P -19.0446; 9.4801; 9.9233
67.336; 64.591; 69.458
691.41Radiush, Ekaterina A.; Sinelnikov, Gleb O.; Sukhikh, Taisiya Sergeevna; Shurikov, Matvey K.; Shamshurin, Maxim; Semenov, Nikolay A.; Postnikov, Pavel S.; Sokolov, Maksim Nailyevich; Abramov, Pavel A.
Substituent effects on the structure of [Ag(py-R)n](NO3) ionic pairs: structural and computational studies
CrystEngComm, 2025
7251110 CIFC21 H27 Ag N4 O3P 1 21/n 18.4906; 30.3813; 9.46
90; 107.563; 90
2326.5Radiush, Ekaterina A.; Sinelnikov, Gleb O.; Sukhikh, Taisiya Sergeevna; Shurikov, Matvey K.; Shamshurin, Maxim; Semenov, Nikolay A.; Postnikov, Pavel S.; Sokolov, Maksim Nailyevich; Abramov, Pavel A.
Substituent effects on the structure of [Ag(py-R)n](NO3) ionic pairs: structural and computational studies
CrystEngComm, 2025
7251111 CIFC21 H27 Ag N4 O3P 1 21/n 18.45; 29.055; 9.635
90; 110.092; 90
2221.6Radiush, Ekaterina A.; Sinelnikov, Gleb O.; Sukhikh, Taisiya Sergeevna; Shurikov, Matvey K.; Shamshurin, Maxim; Semenov, Nikolay A.; Postnikov, Pavel S.; Sokolov, Maksim Nailyevich; Abramov, Pavel A.
Substituent effects on the structure of [Ag(py-R)n](NO3) ionic pairs: structural and computational studies
CrystEngComm, 2025
7251112 CIFC10 H8 Ag Br2 N3 O3C 1 2/c 113.5949; 15.0778; 7.1886
90; 100.67; 90
1448.05Radiush, Ekaterina A.; Sinelnikov, Gleb O.; Sukhikh, Taisiya Sergeevna; Shurikov, Matvey K.; Shamshurin, Maxim; Semenov, Nikolay A.; Postnikov, Pavel S.; Sokolov, Maksim Nailyevich; Abramov, Pavel A.
Substituent effects on the structure of [Ag(py-R)n](NO3) ionic pairs: structural and computational studies
CrystEngComm, 2025
7251113 CIFC9.5 H7 N5 Se0.5P -18.168; 10.9027; 11.8936
75.122; 77.773; 80.977
994.53Smirnov, Andrey S.; Katlenok, Eugene A.; Vakhrushev, Aleksandr Yu.; Krasilnikov, Vitalii A.; Belskaya, Nataliya P.; Katkova, Svetlana A.; Bokach, Nadezhda A.
Divergent noncovalent interactions of isomeric nitrile and isocyanide groups in selenodiazole–triazole cocrystals: σ-hole chalcogen bonding versus π–π stacking
CrystEngComm, 2025, 27, 7390-7398
7251114 CIFC18 H12 N10 O SeP 1 21/c 111.0474; 21.2353; 8.1038
90; 94.318; 90
1895.71Smirnov, Andrey S.; Katlenok, Eugene A.; Vakhrushev, Aleksandr Yu.; Krasilnikov, Vitalii A.; Belskaya, Nataliya P.; Katkova, Svetlana A.; Bokach, Nadezhda A.
Divergent noncovalent interactions of isomeric nitrile and isocyanide groups in selenodiazole–triazole cocrystals: σ-hole chalcogen bonding versus π–π stacking
CrystEngComm, 2025, 27, 7390-7398
7251115 CIFC2.24 H1.92 N0.96 O0.16P -17.4527; 14.1001; 14.2337
65.216; 82.064; 79.392
1331.65Smirnov, Andrey S.; Katlenok, Eugene A.; Vakhrushev, Aleksandr Yu.; Krasilnikov, Vitalii A.; Belskaya, Nataliya P.; Katkova, Svetlana A.; Bokach, Nadezhda A.
Divergent noncovalent interactions of isomeric nitrile and isocyanide groups in selenodiazole–triazole cocrystals: σ-hole chalcogen bonding versus π–π stacking
CrystEngComm, 2025, 27, 7390-7398
7251116 CIFC19 H13 N3 O2 Pt SP 1 21/c 17.7842; 22.6186; 13.3599
90; 136.167; 90
1629.1Stubbs, Clare L.; Bryant, Mathew J.; Hatcher, Lauren E.; Raithby, Paul R.
Manipulating vapochromic or solvatochromic properties of platinum(ii) pincer complexes through ligand modifications
CrystEngComm, 2025, 27, 7498-7513
7251117 CIFC19 H13 N3 O3 PtP -17.2737; 10.8511; 11.9475
64.988; 88.479; 72.764
810.85Stubbs, Clare L.; Bryant, Mathew J.; Hatcher, Lauren E.; Raithby, Paul R.
Manipulating vapochromic or solvatochromic properties of platinum(ii) pincer complexes through ligand modifications
CrystEngComm, 2025, 27, 7498-7513
7251118 CIFC40 H42 N4 O13 Pt2P -17.08014; 15.7289; 18.5245
73.209; 84.553; 80.933
1947.64Stubbs, Clare L.; Bryant, Mathew J.; Hatcher, Lauren E.; Raithby, Paul R.
Manipulating vapochromic or solvatochromic properties of platinum(ii) pincer complexes through ligand modifications
CrystEngComm, 2025, 27, 7498-7513
7251119 CIFC52 H62 N6 O12P -16.016; 10.8276; 18.939
96.883; 92.383; 93.239
1221.4Brown, Corey L.; Elliott, Scarlett H.; Woodfine, Sian E.; Hawes, Chris S.
Structural chemistry and environment-dependent fluorescence of a tetratopic pyrrolo[3,2-b]pyrrole ligand
CrystEngComm, 2025, 27, 7358-7366
7251120 CIFC45 H47 N5 O13 Sr2P -112.1393; 13.144; 15.0291
73.654; 81.676; 84.428
2272.84Brown, Corey L.; Elliott, Scarlett H.; Woodfine, Sian E.; Hawes, Chris S.
Structural chemistry and environment-dependent fluorescence of a tetratopic pyrrolo[3,2-b]pyrrole ligand
CrystEngComm, 2025, 27, 7358-7366
7251121 CIFC42 H40 N4 O10P -15.9506; 11.1443; 13.9257
82.324; 82.077; 85.923
905.17Brown, Corey L.; Elliott, Scarlett H.; Woodfine, Sian E.; Hawes, Chris S.
Structural chemistry and environment-dependent fluorescence of a tetratopic pyrrolo[3,2-b]pyrrole ligand
CrystEngComm, 2025, 27, 7358-7366
7251122 CIFC37.75 H37 N2 O13.75 Sr2P -112.1771; 13.2036; 14.7842
72.297; 81.998; 82.619
2233.05Brown, Corey L.; Elliott, Scarlett H.; Woodfine, Sian E.; Hawes, Chris S.
Structural chemistry and environment-dependent fluorescence of a tetratopic pyrrolo[3,2-b]pyrrole ligand
CrystEngComm, 2025, 27, 7358-7366
7251123 CIFC15 H13 N O SP 1 21/n 16.2269; 13.1586; 15.0552
90; 92.462; 90
1232.44Rao, Feiyang; Hu, Kui; He, Yuanxiang; Zuo, Ziyi; Lv, Shiming; Geng, Shu; Pan, Li; Wang, Hongmei; Huang, Feng
Mechanism-controlled switchable regioselective O- and N-cyclization alkenylation of alkenylbenzamides via dual photoredox and cobalt catalysis
Green Chemistry, 2025, 27, 14328-14337
7251124 CIFC17 H15 N OP -16.2451; 9.7295; 11.3595
82.15; 86.291; 82.644
677.34Rao, Feiyang; Hu, Kui; He, Yuanxiang; Zuo, Ziyi; Lv, Shiming; Geng, Shu; Pan, Li; Wang, Hongmei; Huang, Feng
Mechanism-controlled switchable regioselective O- and N-cyclization alkenylation of alkenylbenzamides via dual photoredox and cobalt catalysis
Green Chemistry, 2025, 27, 14328-14337
7251125 CIFC24 H18 OP 1 21/c 113.582; 6.928; 18.231
90; 94.755; 90
1709.6Luo, Hui; Wang, Yan; He, Yu; Li, Li; Ma, Yinfeng; Wang, Guohui; Yang, Jinhui
Electrochemical synthesis of tetralones utilizing platinum nanoparticles as the anode material
Green Chemistry, 2025, 27, 13644-13650
7251126 CIFC23 H19 Cl F3 N OP 1 21/c 111.45488; 17.2029; 9.67733
90; 97.5738; 90
1890.35Branco, Daniela; Yektaei, Zahra; Chandrabose, Sureka; Almeida Paz, Filipe Alexandre; Kandhavelu, Meenakshisundaram; Candeias, Nuno R.
Glioblastoma Antitumoral Activity of Tetrahydroquinoline-derived Triarylmethanes
RSC Medicinal Chemistry, 2025
7251127 CIFC23 H20 F3 N OP 1 21/c 111.1723; 16.3213; 10.3436
90; 98.802; 90
1863.91Branco, Daniela; Yektaei, Zahra; Chandrabose, Sureka; Almeida Paz, Filipe Alexandre; Kandhavelu, Meenakshisundaram; Candeias, Nuno R.
Glioblastoma Antitumoral Activity of Tetrahydroquinoline-derived Triarylmethanes
RSC Medicinal Chemistry, 2025
7251128 CIFC37 H27 Cl F3 N O3P -17.9684; 12.2691; 16.0679
78.803; 79.663; 76.349
1482.67Branco, Daniela; Yektaei, Zahra; Chandrabose, Sureka; Almeida Paz, Filipe Alexandre; Kandhavelu, Meenakshisundaram; Candeias, Nuno R.
Glioblastoma Antitumoral Activity of Tetrahydroquinoline-derived Triarylmethanes
RSC Medicinal Chemistry, 2025
7251129 CIFC60 H60 N2 O2P -16.388; 7.282; 26.451
91.253; 95.768; 96.982
1214.4Femina, C.; Yamamoto, Norifumi; Ramya, N. K.; Sajith, Pookkottu K.; Thomas, Reji
Photophysical Divergence Driven by π-Spacer Variations in Anthracene-Cyanostilbene Architecture
Physical Chemistry Chemical Physics, 2025
7251130 CIFC48 H52 N2 O2P -16.1036; 8.6157; 18.5115
80.96; 81.39; 85.005
948.52Femina, C.; Yamamoto, Norifumi; Ramya, N. K.; Sajith, Pookkottu K.; Thomas, Reji
Photophysical Divergence Driven by π-Spacer Variations in Anthracene-Cyanostilbene Architecture
Physical Chemistry Chemical Physics, 2025
7251131 CIFC16 H32 Bi2 Br10 N4 O2P 1 21/c 110.6409; 12.0862; 14.1356
90; 108.685; 90
1722.14Alibi, Amin; Elleuch, Nour; Shova, Sergiu; Lhoste, Jerome; Duval, Guillaume; Boujelbene, Mohamed
Comprehensive structural and DFT analysis of a newly synthesized bismuth-based organic-inorganic hybrid material: in-depth insights into vibrational, optical, and photoluminescence properties of (C<sub>8</sub>H<sub>14</sub>N<sub>2</sub>)<sub>2</sub>[Bi<sub>2</sub>Br<sub>10</sub>]·2H<sub>2</sub>O.
RSC advances, 2025, 15, 40439-40455
7251132 CIFC8 H21 B I N3 OP 1 21/c 19.6367; 12.7626; 11.3363
90; 107.192; 90
1331.95Crowley, Margaret E.; Merchant, Gabriel A.; Davis, James H.; Stachurski, Christopher D.; Zeller, Matthias; Salter, E. A.; Wierzbicki, A.; Trulove, Paul C.; Durkin, David P.; Kingrey, Grace L.; Escalante, Edgar E.; O'Brien, Richard A.; Whillock, Novita M.
Ureas are identified as the first neutral O-donors broadly effective in stabilizing ionic liquids and other salts of boron-centred cations: synthesis and detailed characterization
RSC Advances, 2025, 15, 40519-40527
7251133 CIFC8 H23 B I N3 OP 1 21/c 110.2265; 9.5381; 14.3703
90; 95.782; 90
1394.57Crowley, Margaret E.; Merchant, Gabriel A.; Davis, James H.; Stachurski, Christopher D.; Zeller, Matthias; Salter, E. A.; Wierzbicki, A.; Trulove, Paul C.; Durkin, David P.; Kingrey, Grace L.; Escalante, Edgar E.; O'Brien, Richard A.; Whillock, Novita M.
Ureas are identified as the first neutral O-donors broadly effective in stabilizing ionic liquids and other salts of boron-centred cations: synthesis and detailed characterization
RSC Advances, 2025, 15, 40519-40527
7251134 CIFC12 H31 B I N3 OP 1 21/c 110.2903; 8.023; 21.9128
90; 102.169; 90
1768.45Crowley, Margaret E.; Merchant, Gabriel A.; Davis, James H.; Stachurski, Christopher D.; Zeller, Matthias; Salter, E. A.; Wierzbicki, A.; Trulove, Paul C.; Durkin, David P.; Kingrey, Grace L.; Escalante, Edgar E.; O'Brien, Richard A.; Whillock, Novita M.
Ureas are identified as the first neutral O-donors broadly effective in stabilizing ionic liquids and other salts of boron-centred cations: synthesis and detailed characterization
RSC Advances, 2025, 15, 40519-40527
7251135 CIFC6 H19 B I N3 OP 1 21/c 19.8683; 15.6874; 7.9504
90; 101.165; 90
1207.49Crowley, Margaret E.; Merchant, Gabriel A.; Davis, James H.; Stachurski, Christopher D.; Zeller, Matthias; Salter, E. A.; Wierzbicki, A.; Trulove, Paul C.; Durkin, David P.; Kingrey, Grace L.; Escalante, Edgar E.; O'Brien, Richard A.; Whillock, Novita M.
Ureas are identified as the first neutral O-donors broadly effective in stabilizing ionic liquids and other salts of boron-centred cations: synthesis and detailed characterization
RSC Advances, 2025, 15, 40519-40527
7251136 CIFC8 H23 B I N3 OP 1 21/n 19.8196; 12.5339; 11.74
90; 96.402; 90
1435.92Crowley, Margaret E.; Merchant, Gabriel A.; Davis, James H.; Stachurski, Christopher D.; Zeller, Matthias; Salter, E. A.; Wierzbicki, A.; Trulove, Paul C.; Durkin, David P.; Kingrey, Grace L.; Escalante, Edgar E.; O'Brien, Richard A.; Whillock, Novita M.
Ureas are identified as the first neutral O-donors broadly effective in stabilizing ionic liquids and other salts of boron-centred cations: synthesis and detailed characterization
RSC Advances, 2025, 15, 40519-40527
7251137 CIFC8 H23 B I N3 OP 1 21/n 111.3609; 7.2321; 17.9361
90; 107.119; 90
1408.4Crowley, Margaret E.; Merchant, Gabriel A.; Davis, James H.; Stachurski, Christopher D.; Zeller, Matthias; Salter, E. A.; Wierzbicki, A.; Trulove, Paul C.; Durkin, David P.; Kingrey, Grace L.; Escalante, Edgar E.; O'Brien, Richard A.; Whillock, Novita M.
Ureas are identified as the first neutral O-donors broadly effective in stabilizing ionic liquids and other salts of boron-centred cations: synthesis and detailed characterization
RSC Advances, 2025, 15, 40519-40527
7251138 CIFC6 H19 B I N3 OP n a 219.9877; 17.8852; 7.0593
90; 90; 90
1261.02Crowley, Margaret E.; Merchant, Gabriel A.; Davis, James H.; Stachurski, Christopher D.; Zeller, Matthias; Salter, E. A.; Wierzbicki, A.; Trulove, Paul C.; Durkin, David P.; Kingrey, Grace L.; Escalante, Edgar E.; O'Brien, Richard A.; Whillock, Novita M.
Ureas are identified as the first neutral O-donors broadly effective in stabilizing ionic liquids and other salts of boron-centred cations: synthesis and detailed characterization
RSC Advances, 2025, 15, 40519-40527
7251139 CIFC5 H17 B F6 N3 O PP n m a11.7816; 8.5561; 13.0621
90; 90; 90
1316.72Crowley, Margaret E.; Merchant, Gabriel A.; Davis, James H.; Stachurski, Christopher D.; Zeller, Matthias; Salter, E. A.; Wierzbicki, A.; Trulove, Paul C.; Durkin, David P.; Kingrey, Grace L.; Escalante, Edgar E.; O'Brien, Richard A.; Whillock, Novita M.
Ureas are identified as the first neutral O-donors broadly effective in stabilizing ionic liquids and other salts of boron-centred cations: synthesis and detailed characterization
RSC Advances, 2025, 15, 40519-40527
7251140 CIFC7 H21 B I N3 OP 1 21/n 16.8276; 18.2829; 10.3532
90; 93.525; 90
1289.93Crowley, Margaret E.; Merchant, Gabriel A.; Davis, James H.; Stachurski, Christopher D.; Zeller, Matthias; Salter, E. A.; Wierzbicki, A.; Trulove, Paul C.; Durkin, David P.; Kingrey, Grace L.; Escalante, Edgar E.; O'Brien, Richard A.; Whillock, Novita M.
Ureas are identified as the first neutral O-donors broadly effective in stabilizing ionic liquids and other salts of boron-centred cations: synthesis and detailed characterization
RSC Advances, 2025, 15, 40519-40527
7251141 CIFC9 H21 B F6 N4 O5 S2P 1 21/c 18.9317; 22.3717; 9.821
90; 90.539; 90
1962.32Crowley, Margaret E.; Merchant, Gabriel A.; Davis, James H.; Stachurski, Christopher D.; Zeller, Matthias; Salter, E. A.; Wierzbicki, A.; Trulove, Paul C.; Durkin, David P.; Kingrey, Grace L.; Escalante, Edgar E.; O'Brien, Richard A.; Whillock, Novita M.
Ureas are identified as the first neutral O-donors broadly effective in stabilizing ionic liquids and other salts of boron-centred cations: synthesis and detailed characterization
RSC Advances, 2025, 15, 40519-40527
7251142 CIFC33 H43 B2 N3 OP b c a19.249; 16.089; 19.492
90; 90; 90
6037Crowley, Margaret E.; Merchant, Gabriel A.; Davis, James H.; Stachurski, Christopher D.; Zeller, Matthias; Salter, E. A.; Wierzbicki, A.; Trulove, Paul C.; Durkin, David P.; Kingrey, Grace L.; Escalante, Edgar E.; O'Brien, Richard A.; Whillock, Novita M.
Ureas are identified as the first neutral O-donors broadly effective in stabilizing ionic liquids and other salts of boron-centred cations: synthesis and detailed characterization
RSC Advances, 2025, 15, 40519-40527
7251143 CIFC8 H19 B F6 N4 O5 S2P 1 21/n 18.544; 9.321; 47.36
90; 90.952; 90
3771Crowley, Margaret E.; Merchant, Gabriel A.; Davis, James H.; Stachurski, Christopher D.; Zeller, Matthias; Salter, E. A.; Wierzbicki, A.; Trulove, Paul C.; Durkin, David P.; Kingrey, Grace L.; Escalante, Edgar E.; O'Brien, Richard A.; Whillock, Novita M.
Ureas are identified as the first neutral O-donors broadly effective in stabilizing ionic liquids and other salts of boron-centred cations: synthesis and detailed characterization
RSC Advances, 2025, 15, 40519-40527
7251144 CIFC20 H17 O4P 1 21/c 110.731; 5.879; 24.449
90; 94.21; 90
1538.3Falasca, Valerio; Yee, Eugene; Sabir, Shekh; Bhadbade, Mohan; Wenholz, Daniel S.; StC Black, David; Kumar, Naresh
Synthesis and biological evaluation of pyrano and furano fused ring isoflavene derivatives.
RSC advances, 2025, 15, 40149-40163
7251145 CIFC15 H21 N O6P 1 21 15.1486; 11.036; 14.01
90; 94.408; 90
793.7Halder, Tapas; Hore, Ratul; Das, Susanta; Sett, Subhadip; Maity, Joykrishna
Acid-catalysed rearrangement of acyl groups: synthesis of β-d-gluco aminocyclopentitols and carbanucleoside derivatives.
RSC advances, 2025, 15, 40390-40399
7251146 CIFC20 H22.33 N O5.67P 1 21 117.9551; 7.5298; 20.8678
90; 98.955; 90
2786.9Halder, Tapas; Hore, Ratul; Das, Susanta; Sett, Subhadip; Maity, Joykrishna
Acid-catalysed rearrangement of acyl groups: synthesis of β-d-gluco aminocyclopentitols and carbanucleoside derivatives.
RSC advances, 2025, 15, 40390-40399
7251147 CIFC33 H26 Cl6 F N O3C 1 2/c 123.3655; 9.5263; 30.8642
90; 108.24; 90
6524.8Dietl, Martin C.; Hüßler, Christopher; Scherr, Matthias; Frederiksen, Zoé M.; Graf, Jürgen; Rominger, Frank; Rudolph, Matthias; Caligiuri, Isabella; Tripodi, Laura; Rizzolio, Flavio; Scattolin, Thomas; Hashmi, A. Stephen K.
Synthesis of azulenyl-substituted gold(i)-carbene complexes and investigation of their anticancer activity
RSC Advances, 2025, 15, 41260-41269
7251148 CIFC40.5 H34.5 Au Cl F N2 O2P -114.66; 15.507; 15.652
89.298; 89.61; 88.852
3557.2Dietl, Martin C.; Hüßler, Christopher; Scherr, Matthias; Frederiksen, Zoé M.; Graf, Jürgen; Rominger, Frank; Rudolph, Matthias; Caligiuri, Isabella; Tripodi, Laura; Rizzolio, Flavio; Scattolin, Thomas; Hashmi, A. Stephen K.
Synthesis of azulenyl-substituted gold(i)-carbene complexes and investigation of their anticancer activity
RSC Advances, 2025, 15, 41260-41269
7251149 CIFC31 H22 Au Cl F N O2P 1 21/c 112.9318; 13.3667; 15.7531
90; 110.458; 90
2551.3Dietl, Martin C.; Hüßler, Christopher; Scherr, Matthias; Frederiksen, Zoé M.; Graf, Jürgen; Rominger, Frank; Rudolph, Matthias; Caligiuri, Isabella; Tripodi, Laura; Rizzolio, Flavio; Scattolin, Thomas; Hashmi, A. Stephen K.
Synthesis of azulenyl-substituted gold(i)-carbene complexes and investigation of their anticancer activity
RSC Advances, 2025, 15, 41260-41269
7251150 CIFC35.5 H34 Au Cl2 F N2 O2P 43 21 29.543; 9.543; 70.4724
90; 90; 90
6417.8Dietl, Martin C.; Hüßler, Christopher; Scherr, Matthias; Frederiksen, Zoé M.; Graf, Jürgen; Rominger, Frank; Rudolph, Matthias; Caligiuri, Isabella; Tripodi, Laura; Rizzolio, Flavio; Scattolin, Thomas; Hashmi, A. Stephen K.
Synthesis of azulenyl-substituted gold(i)-carbene complexes and investigation of their anticancer activity
RSC Advances, 2025, 15, 41260-41269
7251151 CIFC32 H24 Au Cl3 F N O2P 1 21/n 17.0291; 31.375; 40.124
90; 91.392; 90
8846.3Dietl, Martin C.; Hüßler, Christopher; Scherr, Matthias; Frederiksen, Zoé M.; Graf, Jürgen; Rominger, Frank; Rudolph, Matthias; Caligiuri, Isabella; Tripodi, Laura; Rizzolio, Flavio; Scattolin, Thomas; Hashmi, A. Stephen K.
Synthesis of azulenyl-substituted gold(i)-carbene complexes and investigation of their anticancer activity
RSC Advances, 2025, 15, 41260-41269
7251152 CIFC35 H33 Au Cl F N2 O2P 1 21/c 114.262; 17.54; 12.714
90; 107.296; 90
3036.7Dietl, Martin C.; Hüßler, Christopher; Scherr, Matthias; Frederiksen, Zoé M.; Graf, Jürgen; Rominger, Frank; Rudolph, Matthias; Caligiuri, Isabella; Tripodi, Laura; Rizzolio, Flavio; Scattolin, Thomas; Hashmi, A. Stephen K.
Synthesis of azulenyl-substituted gold(i)-carbene complexes and investigation of their anticancer activity
RSC Advances, 2025, 15, 41260-41269
7251153 CIFC30 H25 N O4P -110.9981; 11.306; 11.7371
107.674; 102.727; 113.268
1177Devaraj, Thangaraj; Srinivasan, Kannupal
Three-component reaction of formyl-substituted donor-acceptor cyclopropanes, primary aromatic amines and 2-naphthol: access to cyclopropane fused 2-pyrrolidinone derivatives.
RSC advances, 2025, 15, 39689-39695
7251154 CIFC12 H8 Cl4 Co N4P 41 21 26.8311; 6.8311; 36.092
90; 90; 90
1684.19Khachroum, Hajer; Rhaiem, Abdallah Ben; Abdelbaky, Mohammed S. M.; García-Granda, Santiago; Dammak, Mohamed
Next-generation cobalt hybrid material: structural, luminescence, and dielectric properties for advanced functional applications.
RSC advances, 2025, 15, 40687-40697
7251155 CIFC10 H26 Br8 N2 SnP b c a12.792; 12.973; 14.605
90; 90; 90
2423.7Elghoul, Amal; Ben Salah, Bochra; Hajlaoui, Fadhel; Karoui, Karim; Audebrand, Nathalie; Roisnel, Thierry; Kozma, Erika; Botta, Chiara; Zouari, Nabil
Investigation on the structural, optical, photoluminescence and electric properties of a semiconductor material [Br(CH<sub>2</sub>)<sub>2</sub>N(CH<sub>3</sub>)<sub>3</sub>]<sub>2</sub>SnBr<sub>6</sub>.
RSC advances, 2025, 15, 40199-40208
7251156 CIFC8 H12 Co N12 O10P 1 21/n 19.2929; 6.5584; 14.4252
90; 95.72; 90
874.79Fokin, Sergey V.; Tolstikov, Svyatoslav E.; Morozov, Vitaliy A.; Samsonenko, Arkady A.; Romanenko, Galina; Bogomyakov, Artem
Aqua and ammine 3d metal complexes with anion-radical of difurazanopyrazine
CrystEngComm, 2025
7251157 CIFC8 H12 Cu N16 O4P 1 21/n 18.3743; 10.4991; 9.5646
90; 108.107; 90
799.3Fokin, Sergey V.; Tolstikov, Svyatoslav E.; Morozov, Vitaliy A.; Samsonenko, Arkady A.; Romanenko, Galina; Bogomyakov, Artem
Aqua and ammine 3d metal complexes with anion-radical of difurazanopyrazine
CrystEngComm, 2025
7251158 CIFC8 H12 N12 Ni O10P 1 21/n 19.2553; 6.5752; 14.3428
90; 95.9; 90
868.21Fokin, Sergey V.; Tolstikov, Svyatoslav E.; Morozov, Vitaliy A.; Samsonenko, Arkady A.; Romanenko, Galina; Bogomyakov, Artem
Aqua and ammine 3d metal complexes with anion-radical of difurazanopyrazine
CrystEngComm, 2025
7251159 CIFC8 H12 N16 Ni O4P 1 21/n 18.3767; 11.2253; 9.2089
90; 111.999; 90
802.87Fokin, Sergey V.; Tolstikov, Svyatoslav E.; Morozov, Vitaliy A.; Samsonenko, Arkady A.; Romanenko, Galina; Bogomyakov, Artem
Aqua and ammine 3d metal complexes with anion-radical of difurazanopyrazine
CrystEngComm, 2025
7251160 CIFC23 H17 N OP b c a11.9255; 8.1437; 34.919
90; 90; 90
3391.25Yamada, Shinji; Akazawa, Rika; Chida, Moemi
Supramolecular dual-synthon in cocrystals of 1-azaanthracene and naphthols: cooperation between hydrogen bonds and cation–π interactions
CrystEngComm, 2025, 27, 7491-7497
7251161 CIFC36 H26 N2 O2P 1 21/c 112.8489; 12.3073; 8.3025
90; 95.371; 90
1307.15Yamada, Shinji; Akazawa, Rika; Chida, Moemi
Supramolecular dual-synthon in cocrystals of 1-azaanthracene and naphthols: cooperation between hydrogen bonds and cation–π interactions
CrystEngComm, 2025, 27, 7491-7497
7251162 CIFC36 H26 N2 O2P -17.1764; 14.0408; 26.7227
99.423; 97.13; 102.165
2561.3Yamada, Shinji; Akazawa, Rika; Chida, Moemi
Supramolecular dual-synthon in cocrystals of 1-azaanthracene and naphthols: cooperation between hydrogen bonds and cation–π interactions
CrystEngComm, 2025, 27, 7491-7497
7251163 CIFC36 H26 N2 OP 1 21/c 113.4906; 10.8297; 8.9753
90; 101.133; 90
1286.61Yamada, Shinji; Akazawa, Rika; Chida, Moemi
Supramolecular dual-synthon in cocrystals of 1-azaanthracene and naphthols: cooperation between hydrogen bonds and cation–π interactions
CrystEngComm, 2025, 27, 7491-7497
7251164 CIFC36 H26 N2 O2P 1 21/c 113.8579; 10.9972; 8.7947
90; 102.687; 90
1307.57Yamada, Shinji; Akazawa, Rika; Chida, Moemi
Supramolecular dual-synthon in cocrystals of 1-azaanthracene and naphthols: cooperation between hydrogen bonds and cation–π interactions
CrystEngComm, 2025, 27, 7491-7497
7251165 CIFC18 H21 F N3 O4.5C 1 2 128.512; 6.7261; 18.5315
90; 113.557; 90
3257.7Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251166 CIFC18 H21 F N3 O4.5C 1 2 128.099; 6.56; 18.2689
90; 113.434; 90
3089.7Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251167 CIFC18 H21 F N3 O4.5C 1 2 127.928; 6.4713; 18.1487
90; 113.447; 90
3009.2Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251168 CIFC18 H21 F N3 O4.5C 1 2 127.806; 6.4028; 18.0642
90; 113.52; 90
2948.9Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251169 CIFC18 H21 F N3 O4.5C 1 2 128.224; 6.6179; 18.353
90; 113.462; 90
3144.6Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251170 CIFC18 H21 F N3 O4.5C 1 2 128.753; 6.79; 18.636
90; 113.838; 90
3328Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251171 CIFC18 H20 F N3 O4C 1 2/c 130.251; 6.8318; 16.845
90; 105.15; 90
3360.3Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251172 CIFC18 H20 F N3 O4C 1 2/c 128.443; 6.0167; 15.7781
90; 102.951; 90
2631.5Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251173 CIFC18 H21 F N3 O4.5P 113.985; 6.0616; 17.534
81.661; 109.861; 79.082
1336.9Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251174 CIFC18 H21 F N3 O4.5C 1 2 127.878; 6.436; 18.107
90; 113.447; 90
2980.5Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251175 CIFC18 H20 F N3 O4C 1 2/c 128.697; 6.1346; 15.9813
90; 103.278; 90
2738.2Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251176 CIFC18 H21 F N3 O4.5C 1 2 127.562; 6.1945; 17.83
90; 113.823; 90
2784.8Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251177 CIFC18 H20 F N3 O4C 1 2/c 129.962; 6.6982; 16.738
90; 104.82; 90
3247.4Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251178 CIFC18 H21 F N3 O4.5C 1 2 128.1035; 6.5548; 18.263
90; 113.49; 90
3085.5Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251179 CIFC18 H20 F N3 O4C 1 2/c 129.63; 6.5439; 16.5404
90; 104.354; 90
3107Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251180 CIFC18 H21 F N3 O4.5C 1 2 127.717; 6.3111; 17.983
90; 113.633; 90
2881.9Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251181 CIFC18 H20 F N3 O4C 1 2/c 128.803; 6.1832; 16.0548
90; 103.372; 90
2781.8Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251182 CIFC18 H20 F N3 O4C 1 2/c 129.123; 6.3326; 16.2627
90; 103.781; 90
2912.9Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251183 CIFC18 H20 F N3 O4C 1 2/c 129.051; 6.299; 16.2226
90; 103.694; 90
2884.2Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251184 CIFC18 H21 F N3 O4.5C 1 2 127.834; 6.401; 18.072
90; 113.524; 90
2952.2Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251185 CIFC18 H20 F N3 O4C 1 2/c 129.425; 6.4513; 16.439
90; 104.14; 90
3026.1Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251186 CIFC18 H20 F N3 O4C 1 2/c 128.547; 6.0686; 15.8759
90; 103.121; 90
2678.5Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251187 CIFC18 H20 F N3 O4C 1 2/c 128.984; 6.2603; 16.1666
90; 103.6; 90
2851.2Gasol-Cardona, Julia; Ward, Martin R.; Comboni, Davide; Hanfland, Micheal; Scatena, Rebecca; Warren, Mark R.; Maloney, Andrew G. P.; Oswald, Iain D. H.
Pressure-induced phase behaviour and compressibility of the racemic and chiral solid forms, ofloxacin and levofloxacin
CrystEngComm, 2025, 27, 7662-7676
7251188 CIFC11 H18 Br4 Cd N2 OP -18.1969; 9.9913; 11.1769
96.179; 96.375; 104.189
873.27Li, Jia-Peng; Yuan, Li; Li, Ping; Wu, Ming; Xie, Yong-Tai; Lei, Xiao-Wu; Jing, Zhi-Hong; Gong, Zhongliang
Zero-dimensional organic–inorganic hybrid cadmium halides with broadband blue light emission
CrystEngComm, 2025, 27, 7348-7357
7251189 CIFC10 H15 Br4 Cd F N2P 1 21/c 18.1636; 21.034; 9.962
90; 102.756; 90
1668.39Li, Jia-Peng; Yuan, Li; Li, Ping; Wu, Ming; Xie, Yong-Tai; Lei, Xiao-Wu; Jing, Zhi-Hong; Gong, Zhongliang
Zero-dimensional organic–inorganic hybrid cadmium halides with broadband blue light emission
CrystEngComm, 2025, 27, 7348-7357
7251190 CIFC16 H13 N2 O3 SP 1 21/c 17.374; 12.4855; 15.6727
90; 102.702; 90
1407.6Dong, 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
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
7251192 CIFC24 H24 N2 O8 S2P 1 21/n 17.2167; 15.0373; 11.0377
90; 90.978; 90
1197.6Dong, 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
7251193 CIFC4 H14 Br4 Cd N2P 1 21 17.958; 7.807; 19.79
90; 94.813; 90
1225.2Ma, Li; Wen, Jinrong; Liu, Zhanqiang; Hou, Jingshan; Miao, Xuyan; Fang, Yongzheng; Huang, Yanwei; Zhang, Ganghua
Non-centrosymmetric phase of [C4N2H14][CdBr4] for Solar-Blind Ultraviolet Detection
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
7251195 CIFC28 H32 N2 O3P -18.1693; 9.2052; 16.684
96.026; 95.209; 102.224
1211.1de Meester, Joséphine; Shemchuk, Oleksii; Collard, Laurent; Wouters, Johan; Robeyns, Koen; Leyssens, Tom
Solvent selection as a major determinant of chiral resolution outcomes: The BINOL-DACH case study
CrystEngComm, 2025
7251196 CIFC26 H28 N2 O2P 1 21/c 18.1707; 29.731; 9.0449
90; 101.667; 90
2151.8de Meester, Joséphine; Shemchuk, Oleksii; Collard, Laurent; Wouters, Johan; Robeyns, Koen; Leyssens, Tom
Solvent selection as a major determinant of chiral resolution outcomes: The BINOL-DACH case study
CrystEngComm, 2025
7251197 CIFC27 H32 N2 O3P -110.2697; 11.14; 11.3987
108.518; 101.58; 101.228
1163.5de Meester, Joséphine; Shemchuk, Oleksii; Collard, Laurent; Wouters, Johan; Robeyns, Koen; Leyssens, Tom
Solvent selection as a major determinant of chiral resolution outcomes: The BINOL-DACH case study
CrystEngComm, 2025
7251198 CIFC32 H34 N2 O2C 2 2 2112.3993; 14.0194; 15.3719
90; 90; 90
2672.1de Meester, Joséphine; Shemchuk, Oleksii; Collard, Laurent; Wouters, Johan; Robeyns, Koen; Leyssens, Tom
Solvent selection as a major determinant of chiral resolution outcomes: The BINOL-DACH case study
CrystEngComm, 2025
7251199 CIFC26 H28 N2 O2P 21 21 219.85511; 15.3092; 28.292
90; 90; 90
4268.52de Meester, Joséphine; Shemchuk, Oleksii; Collard, Laurent; Wouters, Johan; Robeyns, Koen; Leyssens, Tom
Solvent selection as a major determinant of chiral resolution outcomes: The BINOL-DACH case study
CrystEngComm, 2025
7251200 CIFC110 H132 N8 O12P 110.3936; 11.2508; 20.951
87.176; 89.274; 76.533
2379.7de Meester, Joséphine; Shemchuk, Oleksii; Collard, Laurent; Wouters, Johan; Robeyns, Koen; Leyssens, Tom
Solvent selection as a major determinant of chiral resolution outcomes: The BINOL-DACH case study
CrystEngComm, 2025
7251201 CIFC3 H2 F5 N OC 1 2/c 121.7871; 5.11704; 10.0754
90; 98.14; 90
1111.94Uran, Erik; Lozinšek, Matic
Hydrogen-bonded salt cocrystals of xenon difluoride and protonated perfluoroamides
CrystEngComm, 2025
7251202 CIFC4 H3 As F13 N OP 1 21/c 16.17592; 7.94187; 21.7914
90; 96.014; 90
1062.95Uran, Erik; Lozinšek, Matic
Hydrogen-bonded salt cocrystals of xenon difluoride and protonated perfluoroamides
CrystEngComm, 2025
7251203 CIFC4 H3 As F15 N O XeP n n a8.62011; 35.5418; 8.7191
90; 90; 90
2671.31Uran, Erik; Lozinšek, Matic
Hydrogen-bonded salt cocrystals of xenon difluoride and protonated perfluoroamides
CrystEngComm, 2025
7251204 CIFC4 H2 F7 N OP -15.11713; 5.27137; 12.7768
95.467; 91.89; 105.584
329.848Uran, Erik; Lozinšek, Matic
Hydrogen-bonded salt cocrystals of xenon difluoride and protonated perfluoroamides
CrystEngComm, 2025
7251205 CIFC2 H3 As F9 N OP 1 21/c 19.8191; 7.90095; 20.5015
90; 98.6498; 90
1572.42Uran, Erik; Lozinšek, Matic
Hydrogen-bonded salt cocrystals of xenon difluoride and protonated perfluoroamides
CrystEngComm, 2025
7251206 CIFC4 H7 As F12 N2 O3P n m a11.5349; 14.0649; 7.78994
90; 90; 90
1263.82Uran, Erik; Lozinšek, Matic
Hydrogen-bonded salt cocrystals of xenon difluoride and protonated perfluoroamides
CrystEngComm, 2025
7251207 CIFC2 H3 As F11 N O XeP 1 21/n 17.41785; 9.84875; 14.90113
90; 99.4517; 90
1073.85Uran, Erik; Lozinšek, Matic
Hydrogen-bonded salt cocrystals of xenon difluoride and protonated perfluoroamides
CrystEngComm, 2025
7251208 CIFC8 H5 As F20 N2 O2P -15.32051; 10.45222; 16.1017
90.574; 90.876; 103.04
872.157Uran, Erik; Lozinšek, Matic
Hydrogen-bonded salt cocrystals of xenon difluoride and protonated perfluoroamides
CrystEngComm, 2025
7251209 CIFC4 H5 As F12 N2 O2P -15.2815; 10.1517; 12.4911
108.936; 93.107; 102.904
611.63Uran, Erik; Lozinšek, Matic
Hydrogen-bonded salt cocrystals of xenon difluoride and protonated perfluoroamides
CrystEngComm, 2025
7251210 CIFC3 H3 As F11 N OP c c n8.12957; 25.2768; 9.34322
90; 90; 90
1919.93Uran, Erik; Lozinšek, Matic
Hydrogen-bonded salt cocrystals of xenon difluoride and protonated perfluoroamides
CrystEngComm, 2025
7251211 CIFC3 H3 As F13 N O XeA e a 28.67561; 31.0125; 8.65174
90; 90; 90
2327.77Uran, Erik; Lozinšek, Matic
Hydrogen-bonded salt cocrystals of xenon difluoride and protonated perfluoroamides
CrystEngComm, 2025
7251212 CIFC46 H37 Cl2 N3 S2P 1 21/c 112.1499; 10.8322; 28.141
90; 94.231; 90
3693.5Trollip, Danica B.; Barton, Benita; Caira, Mino R.; Hosten, Eric Cyriel
Chloro-containing host compounds with fused tricyclic moieties and diamino linkers: host ability and affinity behaviour in pyridine/methylpyridines
CrystEngComm, 2025
7251213 CIFC45 H35 Cl2 N3 S2P 1 21/c 111.031; 11.772; 28.132
90; 92.86; 90
3648.6Trollip, Danica B.; Barton, Benita; Caira, Mino R.; Hosten, Eric Cyriel
Chloro-containing host compounds with fused tricyclic moieties and diamino linkers: host ability and affinity behaviour in pyridine/methylpyridines
CrystEngComm, 2025
7251214 CIFC86 H67 Cl4 N5 S4P -111.2571; 23.2434; 29.357
113.227; 94.356; 90.072
7034.3Trollip, Danica B.; Barton, Benita; Caira, Mino R.; Hosten, Eric Cyriel
Chloro-containing host compounds with fused tricyclic moieties and diamino linkers: host ability and affinity behaviour in pyridine/methylpyridines
CrystEngComm, 2025
7251215 CIFC52 H44 Cl2 N4 O2P 1 21/c 110.284; 25.5527; 7.8072
90; 97.384; 90
2034.59Trollip, Danica B.; Barton, Benita; Caira, Mino R.; Hosten, Eric Cyriel
Chloro-containing host compounds with fused tricyclic moieties and diamino linkers: host ability and affinity behaviour in pyridine/methylpyridines
CrystEngComm, 2025
7251216 CIFC52 H44 Cl2 N4 O2P 1 21/c 110.1122; 25.8871; 7.8505
90; 96.923; 90
2040.09Trollip, Danica B.; Barton, Benita; Caira, Mino R.; Hosten, Eric Cyriel
Chloro-containing host compounds with fused tricyclic moieties and diamino linkers: host ability and affinity behaviour in pyridine/methylpyridines
CrystEngComm, 2025
7251217 CIFC50 H40 Cl2 N4 O2P 1 21/c 110.2394; 25.2702; 7.8761
90; 97.0302; 90
2022.63Trollip, Danica B.; Barton, Benita; Caira, Mino R.; Hosten, Eric Cyriel
Chloro-containing host compounds with fused tricyclic moieties and diamino linkers: host ability and affinity behaviour in pyridine/methylpyridines
CrystEngComm, 2025
7251218 CIFC52 H44 Cl2 N4 O2P 1 21/c 114.8825; 11.6416; 24.0763
90; 98.279; 90
4127.9Trollip, Danica B.; Barton, Benita; Caira, Mino R.; Hosten, Eric Cyriel
Chloro-containing host compounds with fused tricyclic moieties and diamino linkers: host ability and affinity behaviour in pyridine/methylpyridines
CrystEngComm, 2025
7251219 CIFC86 H67 Cl4 N5 S4P 1 21/n 127.4379; 11.5895; 44.419
90; 95.0705; 90
14069.6Trollip, Danica B.; Barton, Benita; Caira, Mino R.; Hosten, Eric Cyriel
Chloro-containing host compounds with fused tricyclic moieties and diamino linkers: host ability and affinity behaviour in pyridine/methylpyridines
CrystEngComm, 2025
7251220 CIFC27 H26 N2 OP 4313.5803; 13.5803; 11.6172
90; 90; 90
2142.5Saha, Subhajit; Bag, Soumya Ranjan; Akhir, Abdul; Saxena, Deepanshi; Maitra, Rahul; Chopra, Sidharth; Jana, Chandan K.
Metal-free stereoselective C(sp3)–H indolation of N-heterocycles to potent antimicrobial non-canonical tryp–pro hybrids
Green Chemistry, 2026, 28, 365-374
7251221 CIFC26 H24 N2 O2P 1 21 112.203; 7.0304; 12.614
90; 103.755; 90
1051.1Saha, Subhajit; Bag, Soumya Ranjan; Akhir, Abdul; Saxena, Deepanshi; Maitra, Rahul; Chopra, Sidharth; Jana, Chandan K.
Metal-free stereoselective C(sp3)–H indolation of N-heterocycles to potent antimicrobial non-canonical tryp–pro hybrids
Green Chemistry, 2026, 28, 365-374
7251222 CIFC28 H26 N2P 1 21/n 110.2031; 18.048; 12.5014
90; 109.1; 90
2175.3Saha, Subhajit; Bag, Soumya Ranjan; Akhir, Abdul; Saxena, Deepanshi; Maitra, Rahul; Chopra, Sidharth; Jana, Chandan K.
Metal-free stereoselective C(sp3)–H indolation of N-heterocycles to potent antimicrobial non-canonical tryp–pro hybrids
Green Chemistry, 2026, 28, 365-374
7251223 CIFC28 H26 N2 O2P 1 21/c 19.1088; 10.6818; 23.1277
90; 95.527; 90
2239.83Saha, Subhajit; Bag, Soumya Ranjan; Akhir, Abdul; Saxena, Deepanshi; Maitra, Rahul; Chopra, Sidharth; Jana, Chandan K.
Metal-free stereoselective C(sp3)–H indolation of N-heterocycles to potent antimicrobial non-canonical tryp–pro hybrids
Green Chemistry, 2026, 28, 365-374
7251224 CIFC26 H19 N OP 1 21/n 19.8144; 8.2022; 22.949
90; 100.027; 90
1819.2Yang, Shaoxiong; Zhu, Yanren; Pu, Enfan; Jiang, Piaopiao; Li, Xiong; Zhang, Hongbin; Chen, Jingbo
Linear paired electrolysis enabled dearomative [3 + 2] cycloadditions of indoles and benzofurans with vinyl azides
Green Chemistry, 2026, 28, 343-350
7251225 CIFC27 H26 N2 O2C 1 2/c 123.3054; 9.0717; 21.5229
90; 111.995; 90
4219.2Yang, Shaoxiong; Zhu, Yanren; Pu, Enfan; Jiang, Piaopiao; Li, Xiong; Zhang, Hongbin; Chen, Jingbo
Linear paired electrolysis enabled dearomative [3 + 2] cycloadditions of indoles and benzofurans with vinyl azides
Green Chemistry, 2026, 28, 343-350
7251226 CIFC22 H23 Br N2 O2P 1 21/c 110.7771; 15.1534; 12.5418
90; 105.628; 90
1972.48Yang, Shaoxiong; Zhu, Yanren; Pu, Enfan; Jiang, Piaopiao; Li, Xiong; Zhang, Hongbin; Chen, Jingbo
Linear paired electrolysis enabled dearomative [3 + 2] cycloadditions of indoles and benzofurans with vinyl azides
Green Chemistry, 2026, 28, 343-350
7251227 CIFC20 H19 N OP 1 21/c 118.0371; 10.3994; 17.8291
90; 117.232; 90
2973.62Yang, Shaoxiong; Zhu, Yanren; Pu, Enfan; Jiang, Piaopiao; Li, Xiong; Zhang, Hongbin; Chen, Jingbo
Linear paired electrolysis enabled dearomative [3 + 2] cycloadditions of indoles and benzofurans with vinyl azides
Green Chemistry, 2026, 28, 343-350
7251228 CIFC54 H58 Br2 Cu2 N10 O15P -114.0326; 15.3151; 15.7791
102.979; 109.334; 107.627
2843.7Kumari, Pratima; Kumar, Aman; Kataria, Ramesh; Kaushik, Navin Kumar; Ahmed, Mukhtar; Ansari, Azaj; Ekta,; Brahma, Mettle; Maruthi, Mulaka; Babu, Yangala Sudheer; Singh, Bijender; Kumar, Vinod
Synthesis, characterization and biological studies of pyrazole-linked Schiff bases and their copper(ii) complexes as potential therapeutics
RSC Advances, 2025, 15, 42299-42314
7251229 CIFC19 H26 Cl F6 N2 P Ru SP 21 21 219.907; 13.111; 18.3887
90; 90; 90
2388.52Bhunya, Debasis; Datta, Riya; Maity, Ribhu; Saha, Alipe; Sen, Sujata; Brandao, Paula; Pattanayak, Satyajit; Maity, Tithi; Sarkar, Keka; Samanta, Bidhan Chandra
Design and synthesis of bioactive Ru(ii) complexes: antibacterial activity, biocompatibility and biomolecular binding
RSC Advances, 2025, 15, 42573-42587
7251230 CIFC84 H56 In6 O36 P4P 1 21/c 115.407; 13.1276; 20.156
90; 109.181; 90
3850.4Lv, Hong-Juan; Zhai, Yunhui; Qu, Yingjuan; Xue, Min; Wang, Gang; Yuan, Yang; Yuan, Wenyu
Construction of indium–organic frameworks with flu-topology for efficient acetylene separation
CrystEngComm, 2025, 27, 7734-7742
7251231 CIFC17 H9 Cd2 O13P -110.0673; 12.1755; 12.6195
65.462; 87.164; 73.987
1348.78Zhao, Tian-Yi; Gao, Qian; Gao, Shu-Man; Chen, Zhen; Zhang, Wen-Jing; Fan, Wen-Jie; Liu, Hailong; Guo, Chunsheng; Zhang, Dong-Mei; Zhang, Xia
Synthesis, Structures and Cr 2 O 7 2-Fluorescent Sensing Properties of Novel Zn(Ⅱ)/Cd(Ⅱ) Metal-Organic Frameworks with Diverse N/O-Donor Ligands
CrystEngComm, 2025
7251232 CIFC54 H54 Cd3 N6 O24P 1 21/n 111.8343; 18.3219; 13.3714
90; 95.26; 90
2887.07Zhao, Tian-Yi; Gao, Qian; Gao, Shu-Man; Chen, Zhen; Zhang, Wen-Jing; Fan, Wen-Jie; Liu, Hailong; Guo, Chunsheng; Zhang, Dong-Mei; Zhang, Xia
Synthesis, Structures and Cr 2 O 7 2-Fluorescent Sensing Properties of Novel Zn(Ⅱ)/Cd(Ⅱ) Metal-Organic Frameworks with Diverse N/O-Donor Ligands
CrystEngComm, 2025
7251233 CIFC64 H44 N10 O16 Zn3C 1 2/c 127.672; 10.6034; 24.2857
90; 123.232; 90
5960.5Zhao, Tian-Yi; Gao, Qian; Gao, Shu-Man; Chen, Zhen; Zhang, Wen-Jing; Fan, Wen-Jie; Liu, Hailong; Guo, Chunsheng; Zhang, Dong-Mei; Zhang, Xia
Synthesis, Structures and Cr 2 O 7 2-Fluorescent Sensing Properties of Novel Zn(Ⅱ)/Cd(Ⅱ) Metal-Organic Frameworks with Diverse N/O-Donor Ligands
CrystEngComm, 2025
7251234 CIFC56 H44 N10 O16 Zn3C 1 2/c 129.269; 9.8306; 22.037
90; 116.089; 90
5694.7Zhao, Tian-Yi; Gao, Qian; Gao, Shu-Man; Chen, Zhen; Zhang, Wen-Jing; Fan, Wen-Jie; Liu, Hailong; Guo, Chunsheng; Zhang, Dong-Mei; Zhang, Xia
Synthesis, Structures and Cr 2 O 7 2-Fluorescent Sensing Properties of Novel Zn(Ⅱ)/Cd(Ⅱ) Metal-Organic Frameworks with Diverse N/O-Donor Ligands
CrystEngComm, 2025
7251235 CIFC112 H128 N24 O24P 21 21 218.791; 16.407; 8.6453
90; 90; 90
2665.4Dosanjh, Ramandeep; Patterson, Adam; Harris, Joe; Wilson, Claire; Gutmann, Matthias J.; Collier, Paul; Hyde, Tim; Johnson, Timothy; York, Andy; Parker, Stewart F.; Lennon, David
Spectroscopic investigations of a pharmaceutical solid form analogue: pyrimethanil L-tartrate hemi-cocrystal
Physical Chemistry Chemical Physics, 2025
7251236 CIFC28 H32 N6 O6P 21 21 216.6004; 18.6805; 8.7346
90; 90; 90
2708.6Dosanjh, Ramandeep; Patterson, Adam; Harris, Joe; Wilson, Claire; Gutmann, Matthias J.; Collier, Paul; Hyde, Tim; Johnson, Timothy; York, Andy; Parker, Stewart F.; Lennon, David
Spectroscopic investigations of a pharmaceutical solid form analogue: pyrimethanil L-tartrate hemi-cocrystal
Physical Chemistry Chemical Physics, 2025
7251237 CIFC16 H25 N19 O14P -14.8568; 7.9049; 18.9454
79.632; 87.383; 77.432
698.33Jiang, Xiu'e; Xu, Zeyu; Fan, Mingren; Wang, Ruihui; Wang, Yi; Zhang, Qinghua
Synthesis of energetic materials derived from hydroxynitropyrazine
CrystEngComm, 2026, 28, 163-168
7251238 CIFC4 H9 Li N4 Na O11P -17.8258; 8.446; 10.152
90.324; 100.963; 116.811
584.7Jiang, Xiu'e; Xu, Zeyu; Fan, Mingren; Wang, Ruihui; Wang, Yi; Zhang, Qinghua
Synthesis of energetic materials derived from hydroxynitropyrazine
CrystEngComm, 2026, 28, 163-168
7251239 CIFC20 H15 K9 N20 O38P -18.3085; 16.2606; 18.1267
73.099; 88.41; 86.483
2338.63Jiang, Xiu'e; Xu, Zeyu; Fan, Mingren; Wang, Ruihui; Wang, Yi; Zhang, Qinghua
Synthesis of energetic materials derived from hydroxynitropyrazine
CrystEngComm, 2026, 28, 163-168
7251240 CIFC24 H20 B2 Cl2 F8 N2P b c n35.6136; 7.6852; 9.4614
90; 90; 90
2589.56Parashar, Ranjeev Kumar; Kandpal, Suchita; Kamal, Aditya; Bansal, Love; Gupta, Kirti; Kumar, Rajesh; Mondal, Prakash Chandra
Exploring the Roles of Counterions in Redox-active Viologen on Electrochromic Performance
Physical Chemistry Chemical Physics, 2025
7251241 CIFC28 H20 Cl2 F12 N4 O8 S4C 1 2/c 127.2732; 10.8116; 14.096
90; 113.345; 90
3816.2Parashar, Ranjeev Kumar; Kandpal, Suchita; Kamal, Aditya; Bansal, Love; Gupta, Kirti; Kumar, Rajesh; Mondal, Prakash Chandra
Exploring the Roles of Counterions in Redox-active Viologen on Electrochromic Performance
Physical Chemistry Chemical Physics, 2025
7251242 CIFC24 H20 Cl4.07 N2 O8.87P -19.2172; 9.4319; 17.52
76.18; 86.065; 60.771
1288.63Parashar, Ranjeev Kumar; Kandpal, Suchita; Kamal, Aditya; Bansal, Love; Gupta, Kirti; Kumar, Rajesh; Mondal, Prakash Chandra
Exploring the Roles of Counterions in Redox-active Viologen on Electrochromic Performance
Physical Chemistry Chemical Physics, 2025
7251243 CIFC25 H43 Cl P2 SeP 1 21/n 16.6637; 19.2509; 22.2228
90; 95.852; 90
2835.9Aghion, Iulia-Andreea; Septelean, Raluca A.; Lucaci, David; Moraru, Ionut-Tudor; Soran, Albert P.; Ciocan, Catalin C.; Licarete, Emilia; Banciu, Manuela; Nemes, Gabriela
Synthesis and coordination ability of the first phosphavinyl(selenoxo)phosphorane: an electronic story
RSC Advances, 2025, 15, 43426-43435
7251244 CIFC26 H45 Cl5 P2 Pd SeP n m a9.6344; 13.6183; 25.1598
90; 90; 90
3301.1Aghion, Iulia-Andreea; Septelean, Raluca A.; Lucaci, David; Moraru, Ionut-Tudor; Soran, Albert P.; Ciocan, Catalin C.; Licarete, Emilia; Banciu, Manuela; Nemes, Gabriela
Synthesis and coordination ability of the first phosphavinyl(selenoxo)phosphorane: an electronic story
RSC Advances, 2025, 15, 43426-43435
7251245 CIFC21 H21 N3 O5P 31 2 19.5132; 9.5132; 39.0933
90; 90; 120
3063.98Zhang, Guangshuai; Chen, Xin; Liu, Yan; Peng, Rui; Xu, Mengwei; Yan, Si; Xiao, Jin; Liu, Zishu; Min, Qing; Liao, Gang; Wang, Xiaoji; Qin, Shuanglin
NaHMDS/B(C6F5)3-promoted diastereoselective Friedel–Crafts alkylation of indoles/pyrroles with N-tert-butanesulfinylimines: towards the asymmetric synthesis of bisindole alkaloid Calcicamide B
RSC Advances, 2025, 15, 43421-43425
7251246 CIFC17 H18 Bi2 I8 N4 OP -17.5699; 9.652; 11.5436
76.552; 86.66; 84.383
815.82Hrizi, Chakib; Hamdouni, Monia; Essid, Marwa; Nouiri, Mourad; Khatyr, Abderrahim; Knorr, Michael; Viau, Lydie; Schmidt, Annika; Strohmann, Carsten; Chaabouni, Slaheddine
Extending lead-free organic–inorganic semiconducting materials to new polymeric structures: 2,2′-bipyridinium iodoantimonate and quinoxalinium iodobismuthate
RSC Advances, 2025, 15, 43523-43541
7251247 CIFC10 H9 I4 N2 SbC 1 c 112.2685; 18.2626; 7.5924
90; 91.864; 90
1700.21Hrizi, Chakib; Hamdouni, Monia; Essid, Marwa; Nouiri, Mourad; Khatyr, Abderrahim; Knorr, Michael; Viau, Lydie; Schmidt, Annika; Strohmann, Carsten; Chaabouni, Slaheddine
Extending lead-free organic–inorganic semiconducting materials to new polymeric structures: 2,2′-bipyridinium iodoantimonate and quinoxalinium iodobismuthate
RSC Advances, 2025, 15, 43523-43541
7251248 CIFCa8.61 Cd0.69 La0.82 O28 P7R 3 c :H10.4631; 10.4631; 37.42078
90; 90; 120
3547.84Sipina, Elena V.; Zhukovskaya, Evgeniya S.; Morozov, Vladimir A.; Stefanovich, Sergey Yu.; Grebenev, Vadim V.; Belik, Alexei A.; Lazoryak, Bogdan I.; Deyneko, Dina V.
β-Ca3(PO4)2-related structure and dielectric properties of Ca8CdLa(PO4)7
CrystEngComm, 2026, 28, 143-151
7251249 CIFC54 H124 Co2 Cu3 N24 O14P 1 21/m 111.834; 29.952; 12.453
90; 114.598; 90
4013.4Zhang, Yang-Lu; Cai, Meng-Tan; Chen, Yi; Shen, Fuxing; Yang, Jiong; Zhu, Junlun; Shao, Dong
Magnetic and electrical properties of a cyanide-bridged CoCu₃ cluster featuring square pyramidal Cu(II) centers
CrystEngComm, 2025
7251250 CIFC19 H19 Cl N4 O4P -17.4735; 9.0284; 14.908
99.521; 91.777; 107.572
942.24Kedra, Karolina; Dąbrowa, Kajetan; Gajek, Arkadiusz; CEBORSKA, MAGDALENA
Novel pyrimethamine salts with isomeric dihydroxybenzoic acids: crystallization and characterization
CrystEngComm, 2025
7251251 CIFC20 H23 B0 Cl N4 O5P -17.3072; 11.7178; 13.0913
99.716; 95.622; 105.755
1051.06Kedra, Karolina; Dąbrowa, Kajetan; Gajek, Arkadiusz; CEBORSKA, MAGDALENA
Novel pyrimethamine salts with isomeric dihydroxybenzoic acids: crystallization and characterization
CrystEngComm, 2025
7251252 CIFC19 H21 Cl N4 O5P -18.6158; 10.2919; 11.9567
70.718; 78.374; 80.575
974.8Kedra, Karolina; Dąbrowa, Kajetan; Gajek, Arkadiusz; CEBORSKA, MAGDALENA
Novel pyrimethamine salts with isomeric dihydroxybenzoic acids: crystallization and characterization
CrystEngComm, 2025
7251253 CIFC40 H44 Cl2 N8 O9P -19.2777; 14.0027; 16.4264
78.593; 80.51; 85.005
2059.94Kedra, Karolina; Dąbrowa, Kajetan; Gajek, Arkadiusz; CEBORSKA, MAGDALENA
Novel pyrimethamine salts with isomeric dihydroxybenzoic acids: crystallization and characterization
CrystEngComm, 2025
7251254 CIFC21 H17 F6 N OP 1 21/n 19.1569; 22.3534; 9.6077
90; 109.638; 90
1852.19Wang, Bin; Li, Zekun; Cao, Hua
Rearrangement-driven divergent synthesis: a metal-free tandem annulation for CF3-functionalized 1-(aminomethyl)naphthalen-2-ols and 1-(2-naphthyl)azetidines
Green Chemistry, 2025, 27, 15074-15080
7251255 CIFC21 H20 F3 N OP 1 21/n 19.5424; 19.5291; 10.0245
90; 111.692; 90
1735.82Wang, Bin; Li, Zekun; Cao, Hua
Rearrangement-driven divergent synthesis: a metal-free tandem annulation for CF3-functionalized 1-(aminomethyl)naphthalen-2-ols and 1-(2-naphthyl)azetidines
Green Chemistry, 2025, 27, 15074-15080
7251256 CIFC15 H14 F3 N O2P 1 21/c 15.49673; 20.9321; 23.4394
90; 92.345; 90
2694.63Wang, Bin; Li, Zekun; Cao, Hua
Rearrangement-driven divergent synthesis: a metal-free tandem annulation for CF3-functionalized 1-(aminomethyl)naphthalen-2-ols and 1-(2-naphthyl)azetidines
Green Chemistry, 2025, 27, 15074-15080
7251257 CIFC17 H16 N4 Ni O4.17P -17.7152; 7.9573; 14.2571
91.217; 104.774; 97.6
837.52Zaworotko, Michael; Singh, Bharti; He, Tao
Crystal engineering of Nickel(II) coordination networks sustained by aliphatic dicarboxylate linker ligands
CrystEngComm, 2025
7251258 CIFC19 H18 N3 Ni O6P -19.225; 9.566; 11.7477
70.798; 79.692; 75.831
943.73Zaworotko, Michael; Singh, Bharti; He, Tao
Crystal engineering of Nickel(II) coordination networks sustained by aliphatic dicarboxylate linker ligands
CrystEngComm, 2025
7251259 CIFC18 H22 N4 Ni O6P -15.2255; 9.0139; 11.0579
108.563; 94.7; 104.557
470.4Zaworotko, Michael; Singh, Bharti; He, Tao
Crystal engineering of Nickel(II) coordination networks sustained by aliphatic dicarboxylate linker ligands
CrystEngComm, 2025
7251260 CIFC28 H20.4 N10 O2.2 S2 ZnP -19.2371; 13.0112; 14.2113
115.986; 93.532; 108.249
1418Anisimov, Aleksei A.; Bovkunova, Anna; Dubasova, Ekaterina V.; Gontcharenko , Victoria E.; Taydakov, Ilya V.; Bazhina, Evgeniya S.; Eremenko, Igor Leonidovich; Ananyev, Ivan V.
Metal Coordination-Driven Photochromism in Schiff bases incorporating 1,2,4-triazole and hydroxyphenyl moieties
CrystEngComm, 2025
7251261 CIFC20 H20 Cl2 N8 O4 ZnP -16.3811; 13.3652; 15.4291
114.694; 90.702; 101.967
1162.3Anisimov, Aleksei A.; Bovkunova, Anna; Dubasova, Ekaterina V.; Gontcharenko , Victoria E.; Taydakov, Ilya V.; Bazhina, Evgeniya S.; Eremenko, Igor Leonidovich; Ananyev, Ivan V.
Metal Coordination-Driven Photochromism in Schiff bases incorporating 1,2,4-triazole and hydroxyphenyl moieties
CrystEngComm, 2025
7251262 CIFC22 H20 N10 O4 S2 ZnC 1 2 126.234; 6.6881; 7.4495
90; 95.128; 90
1301.8Anisimov, Aleksei A.; Bovkunova, Anna; Dubasova, Ekaterina V.; Gontcharenko , Victoria E.; Taydakov, Ilya V.; Bazhina, Evgeniya S.; Eremenko, Igor Leonidovich; Ananyev, Ivan V.
Metal Coordination-Driven Photochromism in Schiff bases incorporating 1,2,4-triazole and hydroxyphenyl moieties
CrystEngComm, 2025
7251263 CIFC127 H70 Au13 Cl8 F72 P7P -116.4484; 18.2904; 32.9756
82.175; 89.595; 67.909
9096.2Wu, Shen; Tsukuda, Tatsuya; Takano, Shinjiro
An icosahedral Au13 nanocluster with three adjacent chlorides on opposite poles catalyses hydroamination of phenylacetylene
Physical Chemistry Chemical Physics, 2025
7251264 CIFC126 H68 Au13 Br6 F72 P7P -116.5165; 18.4289; 32.773
82.0364; 88.9806; 67.5128
9121.3Wu, Shen; Tsukuda, Tatsuya; Takano, Shinjiro
An icosahedral Au13 nanocluster with three adjacent chlorides on opposite poles catalyses hydroamination of phenylacetylene
Physical Chemistry Chemical Physics, 2025
7251265 CIFC128.5 H73 Au13 Cl5 F72 I6 P7P -119.2272; 31.163; 32.096
82.1696; 87.1604; 78.7233
18679Wu, Shen; Tsukuda, Tatsuya; Takano, Shinjiro
An icosahedral Au13 nanocluster with three adjacent chlorides on opposite poles catalyses hydroamination of phenylacetylene
Physical Chemistry Chemical Physics, 2025
7251266 CIFC14 H15 I N2 O4P b c n19.6028; 6.5055; 25.387
90; 90; 90
3237.5Yu, Cong; Wang, Liwei; Bu, Xiaotong; Liao, Hui; Gao, Meng
Direct Electrocatalytic O-O Coupling for Modular Synthesis of Aza-cyclic Peroxides from Paired Oxygen Donors
Green Chemistry, 2025
7251267 CIFC14 H17 B N2 O4P 1 21/n 112.055; 7.2431; 18.7813
90; 104.353; 90
1588.71Yu, Cong; Wang, Liwei; Bu, Xiaotong; Liao, Hui; Gao, Meng
Direct Electrocatalytic O-O Coupling for Modular Synthesis of Aza-cyclic Peroxides from Paired Oxygen Donors
Green Chemistry, 2025
7251268 CIFC5 H12 Cl2 La N O7P b c n9.45; 15.87; 16.42
90; 90; 90
2463Celik, Ecem; LeMagueres, Pierre; Reinheimer, Eric W.; Carter, Korey Prescott; Forbes, Tori
Mechanochemical Synthesis and Micro-Electron Diffraction Analysis of Rare Earth-Aminopolycarboxylate Coordination Compounds
CrystEngComm, 2025
7251269 CIFC10 H14 La N2 O9P b c a6.62; 14.49; 25.63
90; 90; 90
2459Celik, Ecem; LeMagueres, Pierre; Reinheimer, Eric W.; Carter, Korey Prescott; Forbes, Tori
Mechanochemical Synthesis and Micro-Electron Diffraction Analysis of Rare Earth-Aminopolycarboxylate Coordination Compounds
CrystEngComm, 2025
7251270 CIFC38 H38 B2 Cu F8 N12 O2P -19.9469; 15.0114; 15.5126
71.776; 88.392; 81.732
2176.89Guelfi, Massimo; Taddei, Marco; Bresciani, Giulio
Stepwise single-crystal-to-single-crystal phase transition in copper-based coordination polymers triggered by solvent release
CrystEngComm, 2025
7251271 CIFC38 H38 B2 Cu F8 N12 O2P -17.5279; 10.0007; 15.0093
87.693; 80.356; 82.071
1103.18Guelfi, Massimo; Taddei, Marco; Bresciani, Giulio
Stepwise single-crystal-to-single-crystal phase transition in copper-based coordination polymers triggered by solvent release
CrystEngComm, 2025
7251272 CIFC36 H30 B2 Cu F8 N12P -17.7551; 10.0259; 12.7358
84.026; 84.231; 84.57
976.32Guelfi, Massimo; Taddei, Marco; Bresciani, Giulio
Stepwise single-crystal-to-single-crystal phase transition in copper-based coordination polymers triggered by solvent release
CrystEngComm, 2025
7251273 CIFC37 H34 B2 Cu F8 N12 OP -17.7119; 9.8289; 27.118
94.875; 94.077; 97.335
2024.3Guelfi, Massimo; Taddei, Marco; Bresciani, Giulio
Stepwise single-crystal-to-single-crystal phase transition in copper-based coordination polymers triggered by solvent release
CrystEngComm, 2025
7251274 CIFC40 H Co9 Ge8 N40 Na2 Nb32 O138P -115.028; 17.2493; 23.372
92.648; 99.053; 114.473
5403.6Jin, Xinrong; Li, Jin-Yang; Wang, Yong-Jiang; Sun, Yan-Qiong; Li, Xin-Xiong; Zheng, Shou-Tian
Boosting alkaline hydrogen evolution via cobalt functionalization of organic-inorganic hybrid germanoniobate electrocatalysts
CrystEngComm, 2025
7251275 CIFC10 H49 Ge4 N10 Na4 Nb16 O71P -113.8461; 14.2158; 21.6549
90.428; 99.138; 98.546
4159.5Jin, Xinrong; Li, Jin-Yang; Wang, Yong-Jiang; Sun, Yan-Qiong; Li, Xin-Xiong; Zheng, Shou-Tian
Boosting alkaline hydrogen evolution via cobalt functionalization of organic-inorganic hybrid germanoniobate electrocatalysts
CrystEngComm, 2025
7251276 CIFC60 H52 Ag6 Co2 I11 N13R -3 :H14.4809; 14.4809; 31.006
90; 90; 120
5630.8Xie, Shu-Yue; Liu, Ming-Hui; Wang, Ning; Zhang, Xi-Meng; Wang, Shen-Hao; Yang, Yan; Li, Jun; Zhang, Bo
Two semiconductive haloargentates with metal-complex cations: Crystal structures, band gaps, photocurrent responses and theoretical investigations
CrystEngComm, 2025
7251277 CIFC60 H52 Ag6 Br11 N13 Ni2R -3 :H14.0354; 14.0354; 30.393
90; 90; 120
5185.1Xie, Shu-Yue; Liu, Ming-Hui; Wang, Ning; Zhang, Xi-Meng; Wang, Shen-Hao; Yang, Yan; Li, Jun; Zhang, Bo
Two semiconductive haloargentates with metal-complex cations: Crystal structures, band gaps, photocurrent responses and theoretical investigations
CrystEngComm, 2025
7251278 CIFC7 H27 N20 O8C 1 2/c 121.17; 4.5087; 23.576
90; 103.79; 90
2185.4Yanna, Wang; Yang, Xiaoming; Li, Xinrui; Zhao, Jun; Wang, Qi; Zhang, Tonglai; Li, Zhimin
Nitrogen-Rich Energetic Salts of 5,5'-Dinitramino-3,3'-Methylene-1H-1,2,4-Bistriazolate: powerful alliance towards good thermal stability and high performance
CrystEngComm, 2025
7251279 CIFC5 H9 N11 O5P 1 21/n 14.279; 8.6368; 30.854
90; 92.692; 90
1139.01Yanna, Wang; Yang, Xiaoming; Li, Xinrui; Zhao, Jun; Wang, Qi; Zhang, Tonglai; Li, Zhimin
Nitrogen-Rich Energetic Salts of 5,5'-Dinitramino-3,3'-Methylene-1H-1,2,4-Bistriazolate: powerful alliance towards good thermal stability and high performance
CrystEngComm, 2025
7251280 CIFC22 H27 N3 OP -15.821; 11.178; 16.211
72.8; 79.81; 75.36
968.9Thakur, Jyoti Swarup; Dash, Omkar; Bhale, Nagesh A.; Mondal, Pradip Kumar; Dikundwar, Amol Gopalrao; Polentarutti, Maurizio; Nayak, Susanta K.
Structural and computational study of reversibly photo switchable (E)-4-((4-alkoxyphenyl)diazenyl)benzonitrile based liquid crystals
CrystEngComm, 2025
7251281 CIFC23 H29 N3 OP 1 21/c 15.797; 7.406; 46.464
90; 93.23; 90
1991.7Thakur, Jyoti Swarup; Dash, Omkar; Bhale, Nagesh A.; Mondal, Pradip Kumar; Dikundwar, Amol Gopalrao; Polentarutti, Maurizio; Nayak, Susanta K.
Structural and computational study of reversibly photo switchable (E)-4-((4-alkoxyphenyl)diazenyl)benzonitrile based liquid crystals
CrystEngComm, 2025
7251282 CIFC16 H15 N3 OP -15.95; 18.537; 19.114
73.39; 87.85; 88.91
2018.7Thakur, Jyoti Swarup; Dash, Omkar; Bhale, Nagesh A.; Mondal, Pradip Kumar; Dikundwar, Amol Gopalrao; Polentarutti, Maurizio; Nayak, Susanta K.
Structural and computational study of reversibly photo switchable (E)-4-((4-alkoxyphenyl)diazenyl)benzonitrile based liquid crystals
CrystEngComm, 2025
7251283 CIFC20 H23 N3 OP 1 21/n 15.818; 7.441; 40.745
90; 92.78; 90
1761.8Thakur, Jyoti Swarup; Dash, Omkar; Bhale, Nagesh A.; Mondal, Pradip Kumar; Dikundwar, Amol Gopalrao; Polentarutti, Maurizio; Nayak, Susanta K.
Structural and computational study of reversibly photo switchable (E)-4-((4-alkoxyphenyl)diazenyl)benzonitrile based liquid crystals
CrystEngComm, 2025
7251284 CIFC19 H21 N3 OP 1 21/n 15.812; 7.468; 37.455
90; 93.01; 90
1623.5Thakur, Jyoti Swarup; Dash, Omkar; Bhale, Nagesh A.; Mondal, Pradip Kumar; Dikundwar, Amol Gopalrao; Polentarutti, Maurizio; Nayak, Susanta K.
Structural and computational study of reversibly photo switchable (E)-4-((4-alkoxyphenyl)diazenyl)benzonitrile based liquid crystals
CrystEngComm, 2025
7251285 CIFC24 H31 N3 OP 1 21/c 15.811; 7.367; 49.55
90; 93.1; 90
2118.1Thakur, Jyoti Swarup; Dash, Omkar; Bhale, Nagesh A.; Mondal, Pradip Kumar; Dikundwar, Amol Gopalrao; Polentarutti, Maurizio; Nayak, Susanta K.
Structural and computational study of reversibly photo switchable (E)-4-((4-alkoxyphenyl)diazenyl)benzonitrile based liquid crystals
CrystEngComm, 2025
7251286 CIFC31 H21 F21 O5 S TeP -112.3302; 12.3606; 13.6476
85.327; 64.419; 83.563
1863.02Groslambert, Loic; Padilla-Hernandez, Andres; Hasija, Avantika; Aubert, Emmanuel; Pale, Patrick; Mamane, Victor
Supramolecular Assemblies Involving Triaryltelluronium Cations: Combining Chalcogen Bonding, Hydrogen Bonding and Lone Pair–pi Interactions
CrystEngComm, 2025
7251287 CIFC72 H53 B F42 O4 TeP -119.5618; 20.8276; 21.5393
97.224; 105.154; 112.516
7569.6Groslambert, Loic; Padilla-Hernandez, Andres; Hasija, Avantika; Aubert, Emmanuel; Pale, Patrick; Mamane, Victor
Supramolecular Assemblies Involving Triaryltelluronium Cations: Combining Chalcogen Bonding, Hydrogen Bonding and Lone Pair–pi Interactions
CrystEngComm, 2025
7251288 CIFC62 H29 B Cl2 F42 N2 TeP -114.99; 16.789; 17.126
108.699; 107.411; 107.874
3487Groslambert, Loic; Padilla-Hernandez, Andres; Hasija, Avantika; Aubert, Emmanuel; Pale, Patrick; Mamane, Victor
Supramolecular Assemblies Involving Triaryltelluronium Cations: Combining Chalcogen Bonding, Hydrogen Bonding and Lone Pair–pi Interactions
CrystEngComm, 2025
7251289 CIFC64 H45 B F42 O4 S4 TeP 112.5599; 12.6907; 14.1026
76.029; 75.037; 64.109
1932.1Groslambert, Loic; Padilla-Hernandez, Andres; Hasija, Avantika; Aubert, Emmanuel; Pale, Patrick; Mamane, Victor
Supramolecular Assemblies Involving Triaryltelluronium Cations: Combining Chalcogen Bonding, Hydrogen Bonding and Lone Pair–pi Interactions
CrystEngComm, 2025
7251290 CIFC64 H45 B F42 O4 S4 TeP 1 21/n 114.3825; 31.2001; 17.7186
90; 108.908; 90
7521.9Groslambert, Loic; Padilla-Hernandez, Andres; Hasija, Avantika; Aubert, Emmanuel; Pale, Patrick; Mamane, Victor
Supramolecular Assemblies Involving Triaryltelluronium Cations: Combining Chalcogen Bonding, Hydrogen Bonding and Lone Pair–pi Interactions
CrystEngComm, 2025
7251291 CIFC61 H27 B Cl2 F42 N2 TeP -114.7696; 16.7718; 17.1031
109.129; 108.099; 107.353
3406.3Groslambert, Loic; Padilla-Hernandez, Andres; Hasija, Avantika; Aubert, Emmanuel; Pale, Patrick; Mamane, Victor
Supramolecular Assemblies Involving Triaryltelluronium Cations: Combining Chalcogen Bonding, Hydrogen Bonding and Lone Pair–pi Interactions
CrystEngComm, 2025
7251292 CIFC72 H45 B Cl2 F42 N3 TeP -113.4842; 16.5143; 17.9535
93.388; 94.153; 98.039
3938.5Groslambert, Loic; Padilla-Hernandez, Andres; Hasija, Avantika; Aubert, Emmanuel; Pale, Patrick; Mamane, Victor
Supramolecular Assemblies Involving Triaryltelluronium Cations: Combining Chalcogen Bonding, Hydrogen Bonding and Lone Pair–pi Interactions
CrystEngComm, 2025
7251293 CIFC72 H56 B Cl F42 N3 O6 Te en lv so tP -113.0176; 15.0572; 22.0361
95.134; 94.794; 100.996
4200.5Groslambert, Loic; Padilla-Hernandez, Andres; Hasija, Avantika; Aubert, Emmanuel; Pale, Patrick; Mamane, Victor
Supramolecular Assemblies Involving Triaryltelluronium Cations: Combining Chalcogen Bonding, Hydrogen Bonding and Lone Pair–pi Interactions
CrystEngComm, 2025
7251294 CIFC68 H33 B Cl4 F42 N4 TeP b c a17.7129; 23.8886; 36.3698
90; 90; 90
15389.4Groslambert, Loic; Padilla-Hernandez, Andres; Hasija, Avantika; Aubert, Emmanuel; Pale, Patrick; Mamane, Victor
Supramolecular Assemblies Involving Triaryltelluronium Cations: Combining Chalcogen Bonding, Hydrogen Bonding and Lone Pair–pi Interactions
CrystEngComm, 2025
7251295 CIFC64 H33 B F42 N4 TeP 1 21/c 138.275; 17.6108; 20.7058
90; 94.238; 90
13918.7Groslambert, Loic; Padilla-Hernandez, Andres; Hasija, Avantika; Aubert, Emmanuel; Pale, Patrick; Mamane, Victor
Supramolecular Assemblies Involving Triaryltelluronium Cations: Combining Chalcogen Bonding, Hydrogen Bonding and Lone Pair–pi Interactions
CrystEngComm, 2025
7251296 CIFC36 H53.5 N4 Ni2 O19.75P 1 21/c 19.841; 19.441; 23.234
90; 98.01; 90
4402Sun, Ao-Na; Dong, Fu-Wan; Chen, Yi; Zhang, Si-Chen; Liu, Rui-Han; Zhu, Junlun; Shao, Dong
Guest water-induced reversible regulation of proton conduction in a two-dimensional nickel(II) coordination polymer
CrystEngComm, 2025
7251297 CIFC36 H46.25 N4 Ni2 O16.12C 1 c 19.9528; 19.424; 23.595
90; 99.347; 90
4500.9Sun, Ao-Na; Dong, Fu-Wan; Chen, Yi; Zhang, Si-Chen; Liu, Rui-Han; Zhu, Junlun; Shao, Dong
Guest water-induced reversible regulation of proton conduction in a two-dimensional nickel(II) coordination polymer
CrystEngComm, 2025
7251298 CIFC36 H53.5 N4 Ni2 O19.75P 1 21/c 19.87; 19.429; 23.223
90; 98.06; 90
4409Sun, Ao-Na; Dong, Fu-Wan; Chen, Yi; Zhang, Si-Chen; Liu, Rui-Han; Zhu, Junlun; Shao, Dong
Guest water-induced reversible regulation of proton conduction in a two-dimensional nickel(II) coordination polymer
CrystEngComm, 2025
7251299 CIFC80 H64 N32 O24 V8 Zn4C 1 2 119.1; 18.388; 13.743
90; 90.43; 90
4827Zhu, Maochun; Bai, Xue; Yang, Yanli; Zhang, Ange; Wang, Siyue; Sun, Chengyu; Lu, Ying; Li, Bin; Liu, Shuxia
The stepwise construction of polyoxovanadate-based Zn-MOF nanoparticles with Lewis acid sites for the one-pot synthesis of N-heterocycles in air
Green Chemistry, 2025
7251300 CIFC80 H66 N32 O29 V8 Zn8A e a 220.1731; 20.1804; 27.4319
90; 90; 90
11167.6Zhu, Maochun; Bai, Xue; Yang, Yanli; Zhang, Ange; Wang, Siyue; Sun, Chengyu; Lu, Ying; Li, Bin; Liu, Shuxia
The stepwise construction of polyoxovanadate-based Zn-MOF nanoparticles with Lewis acid sites for the one-pot synthesis of N-heterocycles in air
Green Chemistry, 2025
7251301 CIFC10 H20 Cl2 N2P b c a13.2264; 10.8785; 16.7754
90; 90; 90
2413.7Mulliri, Kleni; Meier, Kris; Feuchter, Johanna-Dorothea; Javor, Sacha; Andrade Meirelles, Matheus; Reymond, Jean-Louis
Diversifying the Triquinazine Scaffold of a Janus Kinase Inhibitor
RSC Medicinal Chemistry, 2025
7251302 CIFC16 H23 N5 O2 SC 1 2/c 115.34716; 11.19722; 20.29496
90; 98.8741; 90
3445.85Mulliri, Kleni; Meier, Kris; Feuchter, Johanna-Dorothea; Javor, Sacha; Andrade Meirelles, Matheus; Reymond, Jean-Louis
Diversifying the Triquinazine Scaffold of a Janus Kinase Inhibitor
RSC Medicinal Chemistry, 2025
7251303 CIFC23 H27 N5P -17.89197; 8.29233; 15.5755
88.6463; 79.6474; 84.935
998.76Mulliri, Kleni; Meier, Kris; Feuchter, Johanna-Dorothea; Javor, Sacha; Andrade Meirelles, Matheus; Reymond, Jean-Louis
Diversifying the Triquinazine Scaffold of a Janus Kinase Inhibitor
RSC Medicinal Chemistry, 2025
7251304 CIFC16 H29 N5 O5P -110.3008; 10.3514; 10.8884
61.817; 77.117; 83.188
997.48Mulliri, Kleni; Meier, Kris; Feuchter, Johanna-Dorothea; Javor, Sacha; Andrade Meirelles, Matheus; Reymond, Jean-Louis
Diversifying the Triquinazine Scaffold of a Janus Kinase Inhibitor
RSC Medicinal Chemistry, 2025
7251305 CIFC19 H25 N O5P -112.32883; 12.61335; 13.40303
65.3764; 76.8583; 86.5176
1843.76Mulliri, Kleni; Meier, Kris; Feuchter, Johanna-Dorothea; Javor, Sacha; Andrade Meirelles, Matheus; Reymond, Jean-Louis
Diversifying the Triquinazine Scaffold of a Janus Kinase Inhibitor
RSC Medicinal Chemistry, 2025
7251306 CIFC20 H30 N2 O2P -19.73159; 10.58664; 10.70354
78.4669; 74.0757; 68.5821
981.04Mulliri, Kleni; Meier, Kris; Feuchter, Johanna-Dorothea; Javor, Sacha; Andrade Meirelles, Matheus; Reymond, Jean-Louis
Diversifying the Triquinazine Scaffold of a Janus Kinase Inhibitor
RSC Medicinal Chemistry, 2025
7251307 CIFC17 H20 N6 OP 1 21/n 18.2112; 18.3624; 10.9157
90; 93.184; 90
1643.3Mulliri, Kleni; Meier, Kris; Feuchter, Johanna-Dorothea; Javor, Sacha; Andrade Meirelles, Matheus; Reymond, Jean-Louis
Diversifying the Triquinazine Scaffold of a Janus Kinase Inhibitor
RSC Medicinal Chemistry, 2025
7251308 CIFC30 H41 N3P 1 21/c 110.39323; 18.5344; 6.83259
90; 91.9405; 90
1315.42Mulliri, Kleni; Meier, Kris; Feuchter, Johanna-Dorothea; Javor, Sacha; Andrade Meirelles, Matheus; Reymond, Jean-Louis
Diversifying the Triquinazine Scaffold of a Janus Kinase Inhibitor
RSC Medicinal Chemistry, 2025
7251309 CIFC17 H21 Cl N6 OP 19.50207; 9.90958; 10.51714
117.907; 91.6054; 92.5887
872.9Mulliri, Kleni; Meier, Kris; Feuchter, Johanna-Dorothea; Javor, Sacha; Andrade Meirelles, Matheus; Reymond, Jean-Louis
Diversifying the Triquinazine Scaffold of a Janus Kinase Inhibitor
RSC Medicinal Chemistry, 2025
7251310 CIFC8 H14 Cl5 N2 SbP 1 21/n 110.8365; 11.8067; 12.0281
90; 106.92; 90
1472.3Alibi, Amin; Elleuch, Nour; Oueslati, Abderrazek; Shova, Sergiu; Boujelbene, Mohamed
Synthesis, optical features, and electrical properties of a new antimony-based hybrid halide (C8H14N2)[SbCl5]
RSC Advances, 2025, 15, 45840-45854
7251311 CIFC13 H15 Cu N3 O6P 1 21/n 18.5673; 10.4935; 16.3022
90; 97.043; 90
1454.52Khan, Md. Adnan; Shruti, Sonal; Sengupta, Swaraj; Khan, Sahanwaj; Bhardwaj, Prabhakar; Kumar, Pankaj; Naskar, Subhendu
Water-soluble binuclear aquo Cu(ii) complex with an amide ligand as an electrocatalyst for the OER, HER and CO2RR
RSC Advances, 2025, 15, 46425-46433
7251312 CIFC13 H15 N3 O5P -18.3624; 8.5232; 9.6931
92.749; 92.29; 96.721
684.61Khan, Md. Adnan; Shruti, Sonal; Sengupta, Swaraj; Khan, Sahanwaj; Bhardwaj, Prabhakar; Kumar, Pankaj; Naskar, Subhendu
Water-soluble binuclear aquo Cu(ii) complex with an amide ligand as an electrocatalyst for the OER, HER and CO2RR
RSC Advances, 2025, 15, 46425-46433
7251313 CIFC17 H13 N O3P 1 21/n 110.0247; 10.2858; 13.4724
90; 110.611; 90
1300.25Miwa, Marino; Ito, Akitaka
Fluorescent solvatochromism and nonfluorescence processes of charge-transfer-type molecules with a 4-nitrophenyl moiety
RSC Advances, 2025, 15, 46297-46307
7251314 CIFC17 H14 OP 1 21/c 111.5001; 17.6022; 5.9565
90; 94.087; 90
1202.69Miwa, Marino; Ito, Akitaka
Fluorescent solvatochromism and nonfluorescence processes of charge-transfer-type molecules with a 4-nitrophenyl moiety
RSC Advances, 2025, 15, 46297-46307
7251315 CIFC52 H99 N30 O36I 428.306; 28.306; 18.617
90; 90; 90
14916Rincón, David A; Zaorska, Ewelina; Malinska, Maura
Halogenated <i>N</i>-phenylpiperazine and 2-(piperazin-1-yl)pyrimidine as novel cucurbit[7]uril guests: experimental and computational insights into supramolecular binding.
RSC advances, 2025, 15, 45555-45572
7251316 CIFC52 H87 Cl2 F2 N30 O30I 428.6126; 28.6126; 18.3038
90; 90; 90
14985Rincón, David A; Zaorska, Ewelina; Malinska, Maura
Halogenated <i>N</i>-phenylpiperazine and 2-(piperazin-1-yl)pyrimidine as novel cucurbit[7]uril guests: experimental and computational insights into supramolecular binding.
RSC advances, 2025, 15, 45555-45572
7251317 CIFC50 H71 N32 Na3.5 O35P n n 228.9179; 26.6083; 10.629
90; 90; 90
8178.5Rincón, David A; Zaorska, Ewelina; Malinska, Maura
Halogenated <i>N</i>-phenylpiperazine and 2-(piperazin-1-yl)pyrimidine as novel cucurbit[7]uril guests: experimental and computational insights into supramolecular binding.
RSC advances, 2025, 15, 45555-45572
7251318 CIFC73 H182 Cl F N44 O74C 2 2 2132.4607; 39.283; 20.2199
90; 90; 90
25783.5Rincón, David A; Zaorska, Ewelina; Malinska, Maura
Halogenated <i>N</i>-phenylpiperazine and 2-(piperazin-1-yl)pyrimidine as novel cucurbit[7]uril guests: experimental and computational insights into supramolecular binding.
RSC advances, 2025, 15, 45555-45572
7251319 CIFC36 H30 Cl2 N2 O6P 1 21/n 115.6728; 8.5913; 23.4511
90; 92.606; 90
3154.42George, Gary C.; Owens, Drew; Osbourn, Damon M.; Hutchins, Kristin M.; Groeneman, Ryan
Heating enables solid-state motion and improves the yield of a [2 + 2] cycloaddition reaction within an organic cocrystal
CrystEngComm, 2025
7251320 CIFC36 H30 Cl2 N2 O6P 1 21/n 115.6977; 8.6067; 23.4697
90; 92.652; 90
3167.49George, Gary C.; Owens, Drew; Osbourn, Damon M.; Hutchins, Kristin M.; Groeneman, Ryan
Heating enables solid-state motion and improves the yield of a [2 + 2] cycloaddition reaction within an organic cocrystal
CrystEngComm, 2025
7251321 CIFC36 H30 Cl2 N2 O6P 1 21/n 115.7987; 8.6606; 23.5163
90; 92.823; 90
3213.74George, Gary C.; Owens, Drew; Osbourn, Damon M.; Hutchins, Kristin M.; Groeneman, Ryan
Heating enables solid-state motion and improves the yield of a [2 + 2] cycloaddition reaction within an organic cocrystal
CrystEngComm, 2025
7251322 CIFC36 H30 Cl2 N2 O6P 1 21/n 115.727; 8.6245; 23.4866
90; 92.696; 90
3182.14George, Gary C.; Owens, Drew; Osbourn, Damon M.; Hutchins, Kristin M.; Groeneman, Ryan
Heating enables solid-state motion and improves the yield of a [2 + 2] cycloaddition reaction within an organic cocrystal
CrystEngComm, 2025
7251323 CIFC36 H30 Cl2 N2 O6P 1 21/n 115.7598; 8.6427; 23.5008
90; 92.75; 90
3197.29George, Gary C.; Owens, Drew; Osbourn, Damon M.; Hutchins, Kristin M.; Groeneman, Ryan
Heating enables solid-state motion and improves the yield of a [2 + 2] cycloaddition reaction within an organic cocrystal
CrystEngComm, 2025
7251324 CIFC19 H24 N2 O5P 1 21/c 112.136; 9.124; 17.679
90; 99.308; 90
1931.8Natarajan, Architha; Karuppannan, Srinivasan
Discovery of a Novel Acetone Hemisolvate of Metacetamol via Swift Cooling Crystallization
CrystEngComm, 2025
7251325 CIFC14 H10 Cl F5P -16.5505; 7.319; 14.688
89.116; 102.483; 94.488
685.43Bear, Joseph C.; Cockcroft, Jeremy Karl; Rosu-Finsen, Alexander; Williams, Jeffrey Huw
Exploring non-covalent interactions in binary aromatic complexes
CrystEngComm, 2025
7251326 CIFC14 H10 Cl2 F4P -16.462; 7.4574; 15.1315
90.38; 100.429; 94.132
715.13Bear, Joseph C.; Cockcroft, Jeremy Karl; Rosu-Finsen, Alexander; Williams, Jeffrey Huw
Exploring non-covalent interactions in binary aromatic complexes
CrystEngComm, 2025
7251327 CIFC14 H10 Cl F5P -16.2099; 7.4687; 7.9874
109.801; 99.549; 95.567
339Bear, Joseph C.; Cockcroft, Jeremy Karl; Rosu-Finsen, Alexander; Williams, Jeffrey Huw
Exploring non-covalent interactions in binary aromatic complexes
CrystEngComm, 2025
7251328 CIFC10 H5 F5 IP -16.0419; 8.9855; 9.989
74.629; 89.584; 89.675
522.88Bear, Joseph C.; Cockcroft, Jeremy Karl; Rosu-Finsen, Alexander; Williams, Jeffrey Huw
Exploring non-covalent interactions in binary aromatic complexes
CrystEngComm, 2025
7251329 CIFC14 H10 Br2 F4C 1 2/m 18.4576; 8.3594; 9.8748
90; 92.357; 90
697.56Bear, Joseph C.; Cockcroft, Jeremy Karl; Rosu-Finsen, Alexander; Williams, Jeffrey Huw
Exploring non-covalent interactions in binary aromatic complexes
CrystEngComm, 2025
7251330 CIFC12 H6 F4 I2C 1 2/m 18.6866; 7.1907; 10.5364
90; 90.058; 90
658.13Bear, Joseph C.; Cockcroft, Jeremy Karl; Rosu-Finsen, Alexander; Williams, Jeffrey Huw
Exploring non-covalent interactions in binary aromatic complexes
CrystEngComm, 2025
7251331 CIFC14 H10 Cl F5P -16.1383; 7.4411; 7.9224
111.378; 99.662; 95.159
327.65Bear, Joseph C.; Cockcroft, Jeremy Karl; Rosu-Finsen, Alexander; Williams, Jeffrey Huw
Exploring non-covalent interactions in binary aromatic complexes
CrystEngComm, 2025
7251332 CIFC14 H10 Br F5P 1 21/n 19.0813; 15.2034; 9.8653
90; 99.229; 90
1344.44Bear, Joseph C.; Cockcroft, Jeremy Karl; Rosu-Finsen, Alexander; Williams, Jeffrey Huw
Exploring non-covalent interactions in binary aromatic complexes
CrystEngComm, 2025
7251333 CIFC14 H10 Cl2 F4P -16.3455; 7.5012; 7.7599
109.37; 98.59; 90.299
343.95Bear, Joseph C.; Cockcroft, Jeremy Karl; Rosu-Finsen, Alexander; Williams, Jeffrey Huw
Exploring non-covalent interactions in binary aromatic complexes
CrystEngComm, 2025
7251334 CIFC14 H10 F4 I2C 1 2/m 18.514; 8.5541; 10.2442
90; 93.45; 90
744.73Bear, Joseph C.; Cockcroft, Jeremy Karl; Rosu-Finsen, Alexander; Williams, Jeffrey Huw
Exploring non-covalent interactions in binary aromatic complexes
CrystEngComm, 2025
7251335 CIFC14 H10 Cl2 F4P 1 1 21/n14.83539; 7.90142; 5.98834
90; 90; 96.4553
697.507Bear, Joseph C.; Cockcroft, Jeremy Karl; Rosu-Finsen, Alexander; Williams, Jeffrey Huw
Exploring non-covalent interactions in binary aromatic complexes
CrystEngComm, 2025
7251336 CIFC7 H9 N9 O4 SP 1 21/c 118.0728; 9.942; 7.1151
90; 93.425; 90
1276.16Stebletsova, Irina; Larin, Alexander; Vinogradov, Dmitry B.; Pivkina, Alla N.; Leonov, Nikita E.; Gazieva, Galina A.; Fershtat, Leonid L.
New thermally stable and friction-insensitive nitrogen-rich salts: a synergy of 1,2,4-triazole, furoxan and hydroxytetrazole motifs
CrystEngComm, 2025
7251337 CIFC6 H8 N12 O3C 1 c 13.83694; 17.9329; 16.51337
90; 94.2871; 90
1133.06Stebletsova, Irina; Larin, Alexander; Vinogradov, Dmitry B.; Pivkina, Alla N.; Leonov, Nikita E.; Gazieva, Galina A.; Fershtat, Leonid L.
New thermally stable and friction-insensitive nitrogen-rich salts: a synergy of 1,2,4-triazole, furoxan and hydroxytetrazole motifs
CrystEngComm, 2025
7251338 CIFC5 H5 K2 N9 O5P -16.9975; 8.944; 11.0111
66.363; 86.447; 75.934
611.9Stebletsova, Irina; Larin, Alexander; Vinogradov, Dmitry B.; Pivkina, Alla N.; Leonov, Nikita E.; Gazieva, Galina A.; Fershtat, Leonid L.
New thermally stable and friction-insensitive nitrogen-rich salts: a synergy of 1,2,4-triazole, furoxan and hydroxytetrazole motifs
CrystEngComm, 2025
7251339 CIFC5 H3 N9 O3C 1 2/c 118.3967; 7.1759; 13.5983
90; 110.355; 90
1683.05Stebletsova, Irina; Larin, Alexander; Vinogradov, Dmitry B.; Pivkina, Alla N.; Leonov, Nikita E.; Gazieva, Galina A.; Fershtat, Leonid L.
New thermally stable and friction-insensitive nitrogen-rich salts: a synergy of 1,2,4-triazole, furoxan and hydroxytetrazole motifs
CrystEngComm, 2025
7251340 CIFC12 H10 N2 O2 SP n a 2119.4454; 5.3607; 10.9087
90; 90; 90
1137.13Pavić, Luka; Miočić, Filip; Razum, Marta; Sarjanović, Josipa; Pisk, Jana
From structure to function: tunable electrical and catalytic properties in rare Mo(vi)-thiophene-2-carboxylic acid hydrazone complexes obtained mechanochemically
RSC Advances, 2025, 15, 46194-46206
7251341 CIFC15 H16 Mo N2 O6 SP 1 21/c 17.7429; 10.6417; 21.2775
90; 91.132; 90
1752.87Pavić, Luka; Miočić, Filip; Razum, Marta; Sarjanović, Josipa; Pisk, Jana
From structure to function: tunable electrical and catalytic properties in rare Mo(vi)-thiophene-2-carboxylic acid hydrazone complexes obtained mechanochemically
RSC Advances, 2025, 15, 46194-46206
7251342 CIFC13 H12 Mo N2 O5 SP b c n14.8458; 7.2875; 26.5865
90; 90; 90
2876.36Pavić, Luka; Miočić, Filip; Razum, Marta; Sarjanović, Josipa; Pisk, Jana
From structure to function: tunable electrical and catalytic properties in rare Mo(vi)-thiophene-2-carboxylic acid hydrazone complexes obtained mechanochemically
RSC Advances, 2025, 15, 46194-46206
7251343 CIFBe Cd F4 H8 O4C 1 2/c 19.4891; 6.3751; 10.7541
90; 105.248; 90
627.66Charkin, D. O.; Kireev, V. E.; Banaru, A. M.; Kompanchenko, A. A.; Tananaev, I. G.; Aksenov, S. M.
When sulfate, selenate, and fluoroberyllate are not isostructural analogs: the case of Cd[BeF4]·4H2O and (C2H8N2)[Cd(H2O)6][BeF4]2
CrystEngComm, 2025, 27, 6926-6933
7251344 CIFC2 H22 Be2 Cd F8 N2 O6P 1 21/n 18.2702; 7.0248; 13.162
90; 101.71; 90
748.75Charkin, D. O.; Kireev, V. E.; Banaru, A. M.; Kompanchenko, A. A.; Tananaev, I. G.; Aksenov, S. M.
When sulfate, selenate, and fluoroberyllate are not isostructural analogs: the case of Cd[BeF4]·4H2O and (C2H8N2)[Cd(H2O)6][BeF4]2
CrystEngComm, 2025, 27, 6926-6933
7251345 CIFC76 H55 Br5 N12 Ni2 O5P 1 21 111.6985; 21.9295; 14.1729
90; 106.199; 90
3491.6Maniyampara, Pramod Kumar; M, BHAGIYALAKSHMI; Kurup, Prathapachandra M. R.; Potti, Manoj Easwaran; Damodaran, Krishna K.; Maheswaran , Sithambaresan; Hussain, Firasat
Nickel(II) Complexes of Halogen-Containing NNO Donor Aroylhydrazones as Potential Putative Binders against SARS Cov-2 M pro
CrystEngComm, 2025
7251346 CIFC36.29 H25.85 Br2 N8.15 Ni O2.71P -110.3827; 13.1468; 13.822
71.199; 80.71; 68.42
1658.86Maniyampara, Pramod Kumar; M, BHAGIYALAKSHMI; Kurup, Prathapachandra M. R.; Potti, Manoj Easwaran; Damodaran, Krishna K.; Maheswaran , Sithambaresan; Hussain, Firasat
Nickel(II) Complexes of Halogen-Containing NNO Donor Aroylhydrazones as Potential Putative Binders against SARS Cov-2 M pro
CrystEngComm, 2025
7251347 CIFC38 H27 Br2 Cl N6 Ni O2P 1 21/n 111.7229; 21.9885; 14.3111
90; 105.77; 90
3550.1Maniyampara, Pramod Kumar; M, BHAGIYALAKSHMI; Kurup, Prathapachandra M. R.; Potti, Manoj Easwaran; Damodaran, Krishna K.; Maheswaran , Sithambaresan; Hussain, Firasat
Nickel(II) Complexes of Halogen-Containing NNO Donor Aroylhydrazones as Potential Putative Binders against SARS Cov-2 M pro
CrystEngComm, 2025
7251348 CIFC38 H26 Br2 N6 Ni O2P 1 21/n 110.3969; 22.1306; 14.8113
90; 104.593; 90
3298Maniyampara, Pramod Kumar; M, BHAGIYALAKSHMI; Kurup, Prathapachandra M. R.; Potti, Manoj Easwaran; Damodaran, Krishna K.; Maheswaran , Sithambaresan; Hussain, Firasat
Nickel(II) Complexes of Halogen-Containing NNO Donor Aroylhydrazones as Potential Putative Binders against SARS Cov-2 M pro
CrystEngComm, 2025
7251349 CIFC36 H25 Br2 N9 Ni O5P 1 21/n 111.6612; 22.5022; 14.1199
90; 105.387; 90
3572.3Maniyampara, Pramod Kumar; M, BHAGIYALAKSHMI; Kurup, Prathapachandra M. R.; Potti, Manoj Easwaran; Damodaran, Krishna K.; Maheswaran , Sithambaresan; Hussain, Firasat
Nickel(II) Complexes of Halogen-Containing NNO Donor Aroylhydrazones as Potential Putative Binders against SARS Cov-2 M pro
CrystEngComm, 2025
7251350 CIFC38 H27 Br2 N7 Ni O5P 1 21/n 111.839; 22.1899; 14.4233
90; 107.183; 90
3620Maniyampara, Pramod Kumar; M, BHAGIYALAKSHMI; Kurup, Prathapachandra M. R.; Potti, Manoj Easwaran; Damodaran, Krishna K.; Maheswaran , Sithambaresan; Hussain, Firasat
Nickel(II) Complexes of Halogen-Containing NNO Donor Aroylhydrazones as Potential Putative Binders against SARS Cov-2 M pro
CrystEngComm, 2025
7251351 CIFC10 H6 N2 O4 S2P 1 21/n 17.4513; 11.4497; 12.7532
90; 90.562; 90
1087.99Zhang, Xin; Kotoulas, Konstantinos T.; Bandaranayake, P.M. Anuththaara; Chathumalee, Dilani; Ehsan, Nuha; Huddleston, Patrick R.; Wallis, John D.; Perry, Carole Celia
Azothiophene-Based Molecular Switches: Influence of Substituent Position and Solvent Environment on Photophysical Behaviour
Physical Chemistry Chemical Physics, 2025
7251352 CIFC12 H10 N2 O4 S2P 1 21/n 19.0514; 7.63966; 9.7827
90; 104.546; 90
654.79Zhang, Xin; Kotoulas, Konstantinos T.; Bandaranayake, P.M. Anuththaara; Chathumalee, Dilani; Ehsan, Nuha; Huddleston, Patrick R.; Wallis, John D.; Perry, Carole Celia
Azothiophene-Based Molecular Switches: Influence of Substituent Position and Solvent Environment on Photophysical Behaviour
Physical Chemistry Chemical Physics, 2025
7251353 CIFC12 H10 N2 O4 S2P -13.87346; 13.8361; 13.9032
61.541; 87.776; 87.828
654.43Zhang, Xin; Kotoulas, Konstantinos T.; Bandaranayake, P.M. Anuththaara; Chathumalee, Dilani; Ehsan, Nuha; Huddleston, Patrick R.; Wallis, John D.; Perry, Carole Celia
Azothiophene-Based Molecular Switches: Influence of Substituent Position and Solvent Environment on Photophysical Behaviour
Physical Chemistry Chemical Physics, 2025
7251354 CIFCa3 Ge3 O9P -17.2858; 7.5501; 8.1252
103.497; 94.404; 90.088
433.241Zhang, Hengyuan; Wu, Jipeng; Ma, Yidong; Chen, Feifei; Zhao, Xian
Single-Crystal Ca₃Ge₃O₉ Calcium Germanate: Structure, Thermal and Optical Properties from Experiment and First-Principles
CrystEngComm, 2025
7251355 CIFC78 H105 I33 N12 O4 Sb4C 1 2 116.9204; 14.3689; 29.1546
90; 105.236; 90
6839.1Shentseva, Irina; Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maksim Nailyevich; Adonin, Sergey A.
New iodine-rich Group 15 iodometalates(III): self-assembly of metal halide anions and polyiodides into supramolecular architectures via I···I contacts
CrystEngComm, 2025
7251356 CIFC78 H105 Bi4 I33 N12 O4C 1 2/c 116.913; 14.4492; 56.667
90; 91.534; 90
13843Shentseva, Irina; Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maksim Nailyevich; Adonin, Sergey A.
New iodine-rich Group 15 iodometalates(III): self-assembly of metal halide anions and polyiodides into supramolecular architectures via I···I contacts
CrystEngComm, 2025
7251357 CIFC38 H44 Cl4 Dy2 N8 O4P -111.1619; 11.1679; 11.4098
86.868; 60.809; 75.3
1196.98Zhong, Fu-Hui; Liu, Chen-Yang; Zheng, Xiao-Yue; Cao, Chen; Peng, Yan; Hu, Zhao-Bo; Liu, Sui-Jun; Wen, He-Rui
Base and Anion Regulated Synthesis of Dysprosium Compounds
CrystEngComm, 2025
7251358 CIFC40 H42 Dy2 F12 N8 O16 S4P -18.3012; 12.6353; 14.2845
68.395; 83.588; 75.922
1350.77Zhong, Fu-Hui; Liu, Chen-Yang; Zheng, Xiao-Yue; Cao, Chen; Peng, Yan; Hu, Zhao-Bo; Liu, Sui-Jun; Wen, He-Rui
Base and Anion Regulated Synthesis of Dysprosium Compounds
CrystEngComm, 2025
7251359 CIFC18 H18 Dy N7 O9P 1 21/n 18.999; 15.0419; 17.1711
90; 95.888; 90
2312.1Zhong, Fu-Hui; Liu, Chen-Yang; Zheng, Xiao-Yue; Cao, Chen; Peng, Yan; Hu, Zhao-Bo; Liu, Sui-Jun; Wen, He-Rui
Base and Anion Regulated Synthesis of Dysprosium Compounds
CrystEngComm, 2025
7251360 CIFC26 H22 F6 N2 O2P -19.5617; 10.833; 11.9272
96.483; 106.465; 99.458
1151.9Akhtar, Nasim; Lekanne Deprez, Siebe; Jayawardana, Senuri G.; Davis, Macallister; Fonseca Guerra, Célia; García-López, Víctor
From amides to thioamides: understanding enhanced anion binding in acyclic receptors
RSC Advances, 2025, 15, 46908-46913
7251361 CIFC30 H28 Cl0 N2 O2P 1 21/n 19.5813; 27.725; 9.8074
90; 114.246; 90
2375.4Akhtar, Nasim; Lekanne Deprez, Siebe; Jayawardana, Senuri G.; Davis, Macallister; Fonseca Guerra, Célia; García-López, Víctor
From amides to thioamides: understanding enhanced anion binding in acyclic receptors
RSC Advances, 2025, 15, 46908-46913
7251362 CIFC12 H9 Cl F N O3P -17.1404; 8.9074; 9.3379
72.15; 81.114; 85.545
558.25Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar
Exploring weak noncovalent interactions in a few halo-substituted quinolones.
RSC advances, 2025, 15, 37216-37225
7251363 CIFC14 H13 Cl F N O3P -19.0561; 9.0599; 9.325
69.818; 69.854; 71.629
657.2Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar
Exploring weak noncovalent interactions in a few halo-substituted quinolones.
RSC advances, 2025, 15, 37216-37225
7251364 CIFC14 H19 Cl F N O6P -17.8889; 9.0771; 12.3827
99.027; 97.434; 107.192
821.95Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar
Exploring weak noncovalent interactions in a few halo-substituted quinolones.
RSC advances, 2025, 15, 37216-37225
7251365 CIFC11 H7 Cl F N O3P -17.1789; 8.4907; 9.3255
73.107; 71.053; 76.278
507.98Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar
Exploring weak noncovalent interactions in a few halo-substituted quinolones.
RSC advances, 2025, 15, 37216-37225
7251366 CIFC13 H11 Cl F N O3P 1 21/c 111.992; 25.5932; 8.1786
90; 91.831; 90
2508.8Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar
Exploring weak noncovalent interactions in a few halo-substituted quinolones.
RSC advances, 2025, 15, 37216-37225
7251367 CIFC14 H15 Cl F N O4P 1 21/c 14.3523; 15.2232; 22.9957
90; 92.056; 90
1522.6Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar
Exploring weak noncovalent interactions in a few halo-substituted quinolones.
RSC advances, 2025, 15, 37216-37225
7251368 CIFC15 H15 Cl F N O3P 1 21/n 110.4187; 11.4345; 12.6311
90; 101.018; 90
1477Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar
Exploring weak noncovalent interactions in a few halo-substituted quinolones.
RSC advances, 2025, 15, 37216-37225
7251369 CIFC13 H11 Cl F N O3P -18.2284; 8.97; 9.4084
69.237; 74.254; 69.76
600.4Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar
Exploring weak noncovalent interactions in a few halo-substituted quinolones.
RSC advances, 2025, 15, 37216-37225
7251370 CIFC10 H5 Cl F N O3P 1 21/n 16.291; 8.2326; 17.968
90; 97.441; 90
922.7Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar
Exploring weak noncovalent interactions in a few halo-substituted quinolones.
RSC advances, 2025, 15, 37216-37225
7251371 CIFC15 H11 Cl F N4 O3P 1 21/n 18.8502; 20.148; 9.0629
90; 108.764; 90
1530.2Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar
Exploring weak noncovalent interactions in a few halo-substituted quinolones.
RSC advances, 2025, 15, 37216-37225
7251372 CIFC15 H14 Cl4 F N O3P 1 21/n 17.2079; 27.556; 9.2363
90; 92.329; 90
1833Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar
Exploring weak noncovalent interactions in a few halo-substituted quinolones.
RSC advances, 2025, 15, 37216-37225
7251373 CIFC16 H17 Cl F N O3P 1 21/c 110.2295; 16.2593; 9.9934
90; 113.612; 90
1523Kumar, Satyanand; Kumar, Ravi; Mishra, Rakesh K.; Awasthi, Satish Kumar
Exploring weak noncovalent interactions in a few halo-substituted quinolones.
RSC advances, 2025, 15, 37216-37225
7251374 CIFC39 H28 N2 SeP 1 21/c 110.967; 26.809; 9.828
90; 96.41; 90
2871.5Issac, Jerome; Priyadharsan, R. Rameshbabu; Chidambaranathan, Kamalanathan; Karthikeyan, Subramanian; Moon, Dohyun; Anthony, Savarimuthu Philip; Madhu, Vedichi
Phenyl selenoxide functionalized TPA/TPE π-conjugated imidazo[1,2-<i>a</i>]pyridine: a fluorescent probe for the selective detection of water in organic solvents.
RSC advances, 2025, 15, 44205-44212
7251375 CIFC28 H26 N2 O4C 1 2/c 132.7304; 4.4327; 32.3534
90; 96.961; 90
4659.4Tanbakouchian, Zahra; Zolfigol, Mohammad Ali; Tonekaboni, Maryam-Sadat; Kozakiewicz-Piekarz, Anna; Bikas, Rahman
Regioselective Cu(i)-catalyzed intramolecular hydroacylation and dimerization of propargylarylaldehydes.
RSC advances, 2025, 15, 44254-44259
7251376 CIFC11 H14 N2 O2 SP 1 21 15.8421; 9.9787; 10.4247
90; 101.544; 90
595.43Shandu, Malibongwe P.; Ngwenya, Andile R.; Lamola, Jairus L.; Moshapo, Paseka T.
Base-mediated three-component system for the synthesis of <i>S</i>-substituted <i>N</i>-acyl ureas.
RSC advances, 2025, 15, 44246-44251
7251377 CIFC6 H8 As N O3P 1 21 17.24314; 6.13919; 8.70641
90; 101.075; 90
379.938Balmohammadi, Yaser; Metry, Eduardo; Malaspina, Lorraine A.; Cametti, Georgia; Nakamura, Yuiga; Grabowsky, Simon
Interplay between geometry, electron density, and polarizability of the controversial drug atoxyl in crystal and biological environments
RSC Advances, 2025, 15, 46749-46760
7251378 CIFC6 H8 As N O3P 1 21 17.24488; 6.14439; 8.7053
90; 101.106; 90
380.262Balmohammadi, Yaser; Metry, Eduardo; Malaspina, Lorraine A.; Cametti, Georgia; Nakamura, Yuiga; Grabowsky, Simon
Interplay between geometry, electron density, and polarizability of the controversial drug atoxyl in crystal and biological environments
RSC Advances, 2025, 15, 46749-46760
7251379 CIFC6 H8 As N O3P 1 21 17.23374; 6.13187; 8.69579
90; 101.094; 90
378.505Balmohammadi, Yaser; Metry, Eduardo; Malaspina, Lorraine A.; Cametti, Georgia; Nakamura, Yuiga; Grabowsky, Simon
Interplay between geometry, electron density, and polarizability of the controversial drug atoxyl in crystal and biological environments
RSC Advances, 2025, 15, 46749-46760
7251380 CIFC6 H8 As N O3P 1 21 17.243; 6.13597; 8.70648
90; 101.07; 90
379.741Balmohammadi, Yaser; Metry, Eduardo; Malaspina, Lorraine A.; Cametti, Georgia; Nakamura, Yuiga; Grabowsky, Simon
Interplay between geometry, electron density, and polarizability of the controversial drug atoxyl in crystal and biological environments
RSC Advances, 2025, 15, 46749-46760
7251381 CIFC6 H8 As N O3P 1 21 17.24395; 6.13599; 8.70666
90; 101.071; 90
379.799Balmohammadi, Yaser; Metry, Eduardo; Malaspina, Lorraine A.; Cametti, Georgia; Nakamura, Yuiga; Grabowsky, Simon
Interplay between geometry, electron density, and polarizability of the controversial drug atoxyl in crystal and biological environments
RSC Advances, 2025, 15, 46749-46760
7251382 CIFC6 H8 As N O3P 1 21 17.23467; 6.13615; 8.69951
90; 101.04; 90
379.051Balmohammadi, Yaser; Metry, Eduardo; Malaspina, Lorraine A.; Cametti, Georgia; Nakamura, Yuiga; Grabowsky, Simon
Interplay between geometry, electron density, and polarizability of the controversial drug atoxyl in crystal and biological environments
RSC Advances, 2025, 15, 46749-46760
7251383 CIFC6 H8 As N O3P 1 21 17.24136; 6.13653; 8.70452
90; 101.074; 90
379.599Balmohammadi, Yaser; Metry, Eduardo; Malaspina, Lorraine A.; Cametti, Georgia; Nakamura, Yuiga; Grabowsky, Simon
Interplay between geometry, electron density, and polarizability of the controversial drug atoxyl in crystal and biological environments
RSC Advances, 2025, 15, 46749-46760
7251384 CIFC62 H58 Cu F6 N4 O8 PP -114.7809; 14.8375; 15.4905
115.129; 114.546; 92.324
2698.9Cetin, M. Mustafa; Mazumdar, Arindam; Cordes, David B.; Fidan, Vahap Gazi; Yang, Zhen; Mayer, Michael F.
Rotaxane synthesis via a dynamic [2]catenane-ring-opening, axle-cleaving double cross metathesis
RSC Advances, 2025, 15, 47117-47127
7251385 CIFC62 H58 Cu F6 N4 O8 PP 1 21/c 116.7265; 7.8498; 43.035
90; 96.345; 90
5615.9Cetin, M. Mustafa; Mazumdar, Arindam; Cordes, David B.; Fidan, Vahap Gazi; Yang, Zhen; Mayer, Michael F.
Rotaxane synthesis via a dynamic [2]catenane-ring-opening, axle-cleaving double cross metathesis
RSC Advances, 2025, 15, 47117-47127
7251386 CIFC16 H14 N4 O4P b c n12.68; 11.488; 20.223
90; 90; 90
2946Junior, Ronaldo Gonçalves de Freitas; Duarte, Vitor; Almeida, Leonardo R.; Santana Wenceslau, Patricia Rafaella; Aquino, Gilberto Benedito; Valverde, Clodoaldo; Napolitano, Hamilton
Comprehensive Structural Insights into Nitro-Substituted Azines as Potential Antioxidant Additives for Biodiesel
CrystEngComm, 2025
7251387 CIFC15 H13 N3 O2P -19.324; 9.384; 9.575
105.669; 105.283; 116.786
643.68Junior, Ronaldo Gonçalves de Freitas; Duarte, Vitor; Almeida, Leonardo R.; Santana Wenceslau, Patricia Rafaella; Aquino, Gilberto Benedito; Valverde, Clodoaldo; Napolitano, Hamilton
Comprehensive Structural Insights into Nitro-Substituted Azines as Potential Antioxidant Additives for Biodiesel
CrystEngComm, 2025
7251388 CIFC19 H22 Cl N3 O6 SP 21 21 215.0757; 19.3352; 20.7883
90; 90; 90
2040.2Nomnganga, Yamkela; Oluwole, David O.; Venter, Gerhard A.; Benyei, Attila; Bathori, Nikoletta B.
Exploring Desolvation-Driven Polymorph Formation via Multicomponent Crystals of Furosemide
CrystEngComm, 2025
7251389 CIFC19 H20 Cl N3 O5 SP 1 21/n 114.1621; 9.6366; 14.7725
90; 100.799; 90
1980.37Nomnganga, Yamkela; Oluwole, David O.; Venter, Gerhard A.; Benyei, Attila; Bathori, Nikoletta B.
Exploring Desolvation-Driven Polymorph Formation via Multicomponent Crystals of Furosemide
CrystEngComm, 2025
7251390 CIFC17 H18 Cl N3 O6 SP -15.2827; 11.54; 16.446
69.81; 85.87; 79.15
924.1Nomnganga, Yamkela; Oluwole, David O.; Venter, Gerhard A.; Benyei, Attila; Bathori, Nikoletta B.
Exploring Desolvation-Driven Polymorph Formation via Multicomponent Crystals of Furosemide
CrystEngComm, 2025
7251391 CIFC18 H18 Cl N3 O5 SP -18.4206; 10.9902; 12.1116
63.633; 70.787; 78.213
946.08Nomnganga, Yamkela; Oluwole, David O.; Venter, Gerhard A.; Benyei, Attila; Bathori, Nikoletta B.
Exploring Desolvation-Driven Polymorph Formation via Multicomponent Crystals of Furosemide
CrystEngComm, 2025
7251392 CIFC18 H18 Cl N3 O5 SP -17.2607; 11.1014; 12.511
107.297; 91.11; 101.344
940.75Nomnganga, Yamkela; Oluwole, David O.; Venter, Gerhard A.; Benyei, Attila; Bathori, Nikoletta B.
Exploring Desolvation-Driven Polymorph Formation via Multicomponent Crystals of Furosemide
CrystEngComm, 2025
7251393 CIFC8 H19 N O8P 1 21/c 117.7514; 5.68736; 13.0019
90; 110.823; 90
1226.91Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar
Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms
CrystEngComm, 2026
7251394 CIFC15 H15 Cl N2 O7P -18.3098; 9.6361; 10.8666
96.5031; 106.955; 101.119
803.26Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar
Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms
CrystEngComm, 2026
7251395 CIFC11 H17 N3 O6P -15.5781; 9.1736; 25.93
91.052; 92.193; 90.552
1325.6Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar
Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms
CrystEngComm, 2026
7251396 CIFC15 H14 N2 O5 SP c a 2114.34; 13.802; 14.671
90; 90; 90
2904Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar
Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms
CrystEngComm, 2026
7251397 CIFC20 H26 N2 O11P 1 21/c 112.3917; 11.7324; 14.9593
90; 100.549; 90
2138.09Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar
Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms
CrystEngComm, 2026
7251398 CIFC9 H10 N O4P -16.6096; 7.0278; 11.2902
72.9234; 74.834; 69.87
463.1Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar
Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms
CrystEngComm, 2026
7251399 CIFC20 H38 N2 O16P -18.6376; 9.5114; 15.9873
79.9178; 80.8899; 88.4671
1276.85Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar
Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms
CrystEngComm, 2026
7251400 CIFC16 H36 N2 O15C 1 2/c 130.203; 5.6916; 14.254
90; 99.433; 90
2417.2Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar
Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms
CrystEngComm, 2026
7251401 CIFC8 H9 N O2P n a 2113.6402; 8.6125; 6.3343
90; 90; 90
744.13Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar
Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms
CrystEngComm, 2026
7251402 CIFC13 H13 N3 O6P -15.8889; 10.2677; 11.2466
102.25; 93.673; 91.141
662.79Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar
Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms
CrystEngComm, 2026
7251403 CIFC36 H60.19 N3 O16.6P -17.5263; 12.781; 21.505
77.876; 88.418; 79.491
1988.5Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar
Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms
CrystEngComm, 2026
7251404 CIFC24 H12 Br4 N2P b c a10.524; 15.0537; 27.8
90; 90; 90
4404.2Li, Linjie; Shang, Yunyi; Gao, Yujia; Zhang, Yanfeng; Xu, Chao; Zhang, Qichun; Wang, Hui
Metal-free and visible photons for the dehydrogenative N-N coupling of amines: Powerful methods to optoelectronic materials
Green Chemistry, 2026
7251405 CIFC70 H64 N8 O8P 1 21/n 115.695; 11.5619; 18.283
90; 106.336; 90
3183.8Tharmalingam, Balamurugan; Sukhanov, Andrey A.; Pei, Yuying; Sambucari, Greta; Ramos, Talita; Zhao, Jianzhang; Voronkova, Violeta K.; Di Donato, Mariangela
Long-lived charge separated states in spiro-compact rhodamine–naphthalenediimide D–A–D systems: synthesis and time-resolved optical and electron paramagnetic resonance spectroscopic studies
Physical Chemistry Chemical Physics, 2026
7251406 CIFC76 H74 N9 O8P -112.294; 13.387; 20.532
86.872; 87.845; 83.021
3347.5Tharmalingam, Balamurugan; Sukhanov, Andrey A.; Pei, Yuying; Sambucari, Greta; Ramos, Talita; Zhao, Jianzhang; Voronkova, Violeta K.; Di Donato, Mariangela
Long-lived charge separated states in spiro-compact rhodamine–naphthalenediimide D–A–D systems: synthesis and time-resolved optical and electron paramagnetic resonance spectroscopic studies
Physical Chemistry Chemical Physics, 2026
7251407 CIFC5 H9 N3 O3P -14.1764; 7.4068; 12.223
90.144; 97.506; 91.316
374.76Raičević, Vidak; Radulović, Niko S.; Banić, Nemanja; Leovac, Vukadin M.; Rodić, Marko V.
Competing hydrogen bonding and acyclic π-stacking between hydrogen-bridged quasi-rings in Z- and E-methyl pyruvate semicarbazone: a quantitative interaction energy analysis
CrystEngComm, 2025, 27, 7721-7733
7251408 CIFC5 H9 N3 O3F d d 236.4109; 23.9057; 7.0463
90; 90; 90
6133.3Raičević, Vidak; Radulović, Niko S.; Banić, Nemanja; Leovac, Vukadin M.; Rodić, Marko V.
Competing hydrogen bonding and acyclic π-stacking between hydrogen-bridged quasi-rings in Z- and E-methyl pyruvate semicarbazone: a quantitative interaction energy analysis
CrystEngComm, 2025, 27, 7721-7733
7251409 CIFC22 H18 Cl N O4C 1 2/c 118.08322; 8.31078; 25.0348
90; 102.731; 90
3669.87Bundulis, Arturs; Leduskrasts, Kaspars; Sapne, Anete
Fifth-order nonlinear optical properties of through space charge transfer pyridinium salt
RSC Advances, 2025, 15, 48109-48115
7251410 CIFC11 H11.7 N O5.35 PbP 1 21/n 111.635; 6.5838; 17.079
90; 91.82; 90
1307.6Cao, Shilin; Zhao, Yubin; Yao, Gengyang; Gao, Peiwei; Shi, Xiaofeng
Study on the mechanism of morphology regulation of Pb-based MOFs and catalytic thermal decomposition mechanism of energetic materials
CrystEngComm, 2025
7251411 CIFC21 H20 O4P 1 21/c 14.6803; 40.269; 9.2487
90; 96.433; 90
1732.1Ahamed , Riyaaz; Bhowmik, Aritra; Mishra, Manish Kumar; Ghosh, Soumyajit
Dual-Responsive Benzylidene Indanone Crystals: Mechanical Flexibility Coupled with Reversible Acidochromism
CrystEngComm, 2026
7251412 CIFC19 H17 O4P 1 21/c 14.8459; 35.354; 9.1074
90; 97.576; 90
1546.7Ahamed , Riyaaz; Bhowmik, Aritra; Mishra, Manish Kumar; Ghosh, Soumyajit
Dual-Responsive Benzylidene Indanone Crystals: Mechanical Flexibility Coupled with Reversible Acidochromism
CrystEngComm, 2026
7251413 CIFC16 H16 Cl F4 I2 NC 1 c 112.7903; 23.181; 7.0725
90; 99.762; 90
2066.58Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251414 CIFC18 H22 F4 I3 N OP b c a23.0021; 8.6231; 23.1475
90; 90; 90
4591.3Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251415 CIFC34 H35 Br2 F8 I4 N3C 1 2/c 126.159; 7.2696; 24.852
90; 119.486; 90
4113.9Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251416 CIFC38 H32 F12 I8 N2P 1 21/c 112.3208; 13.9375; 14.1774
90; 92.1318; 90
2432.87Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251417 CIFC70 H64 Br4 F20 I10 N4P 1 21/c 114.5552; 13.2366; 24.2904
90; 107.012; 90
4475Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251418 CIFC98 H128 F12 I14 N8P -112.1906; 14.759; 18.6646
112.829; 103.557; 91.009
2986.7Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251419 CIFC34 H35 Cl2 F8 I4 N3C 1 2/c 125.683; 7.3274; 24.0892
90; 118.023; 90
4001.8Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251420 CIFC16 H16 Br F4 I2 NC 1 c 112.8977; 23.6266; 7.0656
90; 98.959; 90
2126.8Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251421 CIFC19 H22 Cl F4 I2 N OP 1 21/n 17.4201; 16.9744; 18.5377
90; 101.019; 90
2291.8Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251422 CIFC49 H49 Cl6 F12 I6 N3C 1 2 122.5735; 13.3979; 21.0751
90; 90.252; 90
6373.8Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251423 CIFC54 H48 Br3 F16 I8 N3P n a 2122.1473; 23.2966; 13.1846
90; 90; 90
6802.7Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251424 CIFC33 H34 Cl2 F8 I6 N2C 1 2/c 126.7504; 7.3621; 25.775
90; 121.075; 90
4347.6Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251425 CIFC66 H67 F16 I12 N5C 1 2/c 126.8437; 7.2678; 25.9199
90; 121.183; 90
4326.2Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251426 CIFC73 H82 F16 I12 N4 O3P 1 21 114.9831; 13.9458; 22.4748
90; 91.27; 90
4695Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251427 CIFC33 H33 Cl3 F8 I6 N2P 1 21/n 113.4764; 13.9493; 23.8493
90; 91.016; 90
4482.6Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251428 CIFC33 H35 F8 I7 N2P 31 2 113.715; 13.715; 20.275
90; 90; 120
3302.8Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251429 CIFC19 H24 F4 I3 N OP -18.6413; 11.6873; 12.0058
93.193; 98.928; 90.425
1195.8Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251430 CIFC17 H20 F4 I3 N OP b c a8.6736; 22.6193; 22.768
90; 90; 90
4466.9Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251431 CIFC19 H22 Br F4 I2 N OP 1 21/c 17.4179; 17.5166; 18.5531
90; 101.397; 90
2363.2Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251432 CIFC70 H64 F20 I14 N4P 1 21/c 114.6943; 13.2754; 24.9791
90; 106.903; 90
4662.2Peloquin, Andrew J.; Pelendage, Lahiruni; Alapati, Srikar; Hanks, Timothy; McMillen, Colin; Pennington, William
When Halogen Bonding Isn't Enough: Solvation Behavior in Cocrystals of Benzyltrimethylammonium Halides and 1,4-Diiodotetrafluorobenzene
CrystEngComm, 2025
7251433 CIFC29 H20 Cl2 Cu2 N2 O7P 21 21 2112.8851; 13.6763; 14.8823
90; 90; 90
2622.57Pantelis, Konstantinos; Alexandropoulos, Dimitris I.; Escuer, Albert; Kostakis, George E.; Stamatatos, Theocharis C.
A Preformed 1‐D {CuII2}n Helical Chain as Precursor to a Decanuclear 0-D {CuII8MnII2} Cluster: Synthesis, Structure and Magnetism
CrystEngComm, 2026
7251434 CIFC369 H266 Cl24 Cu24 Mn6 N40.5 O90.25C 1 2/c 177.1822; 16.6415; 29.2589
90; 100.799; 90
36915.4Pantelis, Konstantinos; Alexandropoulos, Dimitris I.; Escuer, Albert; Kostakis, George E.; Stamatatos, Theocharis C.
A Preformed 1‐D {CuII2}n Helical Chain as Precursor to a Decanuclear 0-D {CuII8MnII2} Cluster: Synthesis, Structure and Magnetism
CrystEngComm, 2026
7251435 CIFC36 H33 Cl Cu N3 O4 P2P 1 21/n 113.1077; 19.8491; 13.2457
90; 96.073; 90
3426.9Mao, Zhen; Li, Hai-Jian; He, Xue; Liu, Sui-Jun; Wen, He-Rui; He, Li-Hua; Chen, Jing-Lin
Tricolor reversible luminescence switching of a mechano-/vapo-chromic mononuclear Cu(i) complex
CrystEngComm, 2026, 28, 1877-1882
7251436 CIFC39 H39 Cl Cu N3 O5 P2I 1 2/a 120.8314; 17.0911; 22.858
90; 105.845; 90
7828.9Mao, Zhen; Li, Hai-Jian; He, Xue; Liu, Sui-Jun; Wen, He-Rui; He, Li-Hua; Chen, Jing-Lin
Tricolor reversible luminescence switching of a mechano-/vapo-chromic mononuclear Cu(i) complex
CrystEngComm, 2026, 28, 1877-1882
7251437 CIFC14 H8 N2 O8P -15.074; 5.261; 12.385
90.1; 97.94; 95.82
325.71Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R.
Conformational preferences of diimide-based dicarboxylate species and their coordination polymers
CrystEngComm, 2026, 28, 736-747
7251438 CIFC18.33 H19.09 Mn N3.44 O10.94C 1 2/c 131.934; 4.75; 29.072
90; 99.72; 90
4346.5Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R.
Conformational preferences of diimide-based dicarboxylate species and their coordination polymers
CrystEngComm, 2026, 28, 736-747
7251439 CIFC20 H20 Ca N4 O10P 1 21/c 113.425; 17.687; 9.629
90; 91.03; 90
2286Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R.
Conformational preferences of diimide-based dicarboxylate species and their coordination polymers
CrystEngComm, 2026, 28, 736-747
7251440 CIFC16 H14 N2 O9C 1 2 120.7529; 5.6389; 16.0661
90; 118.704; 90
1649.07Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R.
Conformational preferences of diimide-based dicarboxylate species and their coordination polymers
CrystEngComm, 2026, 28, 736-747
7251441 CIFC18 H16 N2 O8P -15.7316; 6.1988; 12.473
85.726; 80.66; 81.607
432.01Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R.
Conformational preferences of diimide-based dicarboxylate species and their coordination polymers
CrystEngComm, 2026, 28, 736-747
7251442 CIFC18.45 H19.38 N3.48 O10.98 ZnC 1 2/c 132.04; 4.74; 29.17
90; 99.52; 90
4369Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R.
Conformational preferences of diimide-based dicarboxylate species and their coordination polymers
CrystEngComm, 2026, 28, 736-747
7251443 CIFC38 H34 Co2 N6 O18P 1 21 18.635; 20.581; 12.07
90; 101.8; 90
2099.7Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R.
Conformational preferences of diimide-based dicarboxylate species and their coordination polymers
CrystEngComm, 2026, 28, 736-747
7251444 CIFC20 H20 Mn N4 O10P -19.88; 10.14; 13.57
84.31; 71.44; 63.63
1153.2Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R.
Conformational preferences of diimide-based dicarboxylate species and their coordination polymers
CrystEngComm, 2026, 28, 736-747
7251445 CIFC20 H20 Co N4 O10P -19.6362; 10.1021; 13.5166
84.244; 71.817; 63.4
1116.56Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R.
Conformational preferences of diimide-based dicarboxylate species and their coordination polymers
CrystEngComm, 2026, 28, 736-747
7251446 CIFC17 H13 Cd N3 O9P 21 21 214.79; 15.013; 25.31
90; 90; 90
1820.1Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R.
Conformational preferences of diimide-based dicarboxylate species and their coordination polymers
CrystEngComm, 2026, 28, 736-747
7251447 CIFC20 H20 Cd N4 O10P -14.973; 9.0826; 12.8166
91.128; 92.195; 94.386
576.63Cao, Winnie; Glascott, Bianca K.; Izgorodina, Ekaterina I.; Turner, David R.
Conformational preferences of diimide-based dicarboxylate species and their coordination polymers
CrystEngComm, 2026, 28, 736-747
7251448 CIFC208 H258 Ag6 N16 O28 S16 Ti6P -121.765; 21.8911; 26.7368
70.548; 77.185; 87.923
11702.9Han, Qian; Wang, Xiao-Wei; Zhu, Hong-Yan; Li, Lan-Yan; Yu, Wei-Dong; Liu, Chao
Anchored Ag+ sites on a thiacalix[4]arene-stabilized Ti-oxo cluster enable efficient CO2-to-CO electroreduction
CrystEngComm, 2026, 28, 806-811
7251449 CIFC76 H104 N4 O12 S4 Ti2P 1 21/n 112.8614; 13.3481; 23.7581
90; 91.259; 90
4077.7Han, Qian; Wang, Xiao-Wei; Zhu, Hong-Yan; Li, Lan-Yan; Yu, Wei-Dong; Liu, Chao
Anchored Ag+ sites on a thiacalix[4]arene-stabilized Ti-oxo cluster enable efficient CO2-to-CO electroreduction
CrystEngComm, 2026, 28, 806-811
7251450 CIFC22 H22 N2 O4P -15.9187; 8.0533; 10.5862
99.782; 96.732; 102.517
479.17Hill, Max T.; Birch-Machin, Mark A.; Sellars, Jonathan D.; Waddell, Paul G.
Four polymorphic structures of a symmetric azo dye
CrystEngComm, 2026, 28, 1781-1790
7251451 CIFC22 H22 N2 O4P 1 21/c 113.4185; 9.8231; 7.2136
90; 90.961; 90
950.7Hill, Max T.; Birch-Machin, Mark A.; Sellars, Jonathan D.; Waddell, Paul G.
Four polymorphic structures of a symmetric azo dye
CrystEngComm, 2026, 28, 1781-1790
7251452 CIFC22 H22 N2 O4P 21 21 213.9172; 9.6395; 50.1648
90; 90; 90
1894.22Hill, Max T.; Birch-Machin, Mark A.; Sellars, Jonathan D.; Waddell, Paul G.
Four polymorphic structures of a symmetric azo dye
CrystEngComm, 2026, 28, 1781-1790
7251453 CIFC11 H13 N O2P n a 2122.6748; 8.4634; 5.3937
90; 90; 90
1035.08Hill, Max T.; Birch-Machin, Mark A.; Sellars, Jonathan D.; Waddell, Paul G.
Four polymorphic structures of a symmetric azo dye
CrystEngComm, 2026, 28, 1781-1790
7251454 CIFC11 H11 N O4P -16.9802; 8.0029; 10.9422
69.905; 72.221; 68.201
521.8Hill, Max T.; Birch-Machin, Mark A.; Sellars, Jonathan D.; Waddell, Paul G.
Four polymorphic structures of a symmetric azo dye
CrystEngComm, 2026, 28, 1781-1790
7251455 CIFC22 H22 N2 O4P 1 21 18.8556; 10.0594; 21.7173
90; 98.001; 90
1915.79Hill, Max T.; Birch-Machin, Mark A.; Sellars, Jonathan D.; Waddell, Paul G.
Four polymorphic structures of a symmetric azo dye
CrystEngComm, 2026, 28, 1781-1790
7251456 CIFC73 H76 Br2 O10C 1 c 111.3658; 25.1078; 22.8023
90; 104.364; 90
6303.7Almoaeen, Randa Abd; Vinodh, Mickey; Alipour, Fatemeh H.; Al-Azemi, Talal F.
Influence of crystallization solvents on the crystal structures and supramolecular assemblies of a [2]naphthyl-extended pillar[6]arene
CrystEngComm, 2026, 28, 1331-1338
7251457 CIFC71 H72 Br2 O10C 1 2/c 111.1392; 25.2833; 22.6009
90; 103.461; 90
6190.4Almoaeen, Randa Abd; Vinodh, Mickey; Alipour, Fatemeh H.; Al-Azemi, Talal F.
Influence of crystallization solvents on the crystal structures and supramolecular assemblies of a [2]naphthyl-extended pillar[6]arene
CrystEngComm, 2026, 28, 1331-1338
7251458 CIFC106 H128 Br4 O12C 1 2/c 139.404; 10.6754; 24.3659
90; 107.392; 90
9781Almoaeen, Randa Abd; Vinodh, Mickey; Alipour, Fatemeh H.; Al-Azemi, Talal F.
Influence of crystallization solvents on the crystal structures and supramolecular assemblies of a [2]naphthyl-extended pillar[6]arene
CrystEngComm, 2026, 28, 1331-1338
7251459 CIFC102 H120 Br4 O12C 1 2/c 138.7491; 10.4816; 23.9295
90; 107.054; 90
9291.7Almoaeen, Randa Abd; Vinodh, Mickey; Alipour, Fatemeh H.; Al-Azemi, Talal F.
Influence of crystallization solvents on the crystal structures and supramolecular assemblies of a [2]naphthyl-extended pillar[6]arene
CrystEngComm, 2026, 28, 1331-1338
7251460 CIFC22 H34 Cl2 N4 OP 1 21/c 17.3871; 17.4215; 18.6866
90; 100.156; 90
2367.18Perry-Britton, Meabh K. S.; Du, Jessica J.; White, Nicholas G.
1D chains and an open 3D network from poly(diethylamidinium) cations and polycarboxylate anions
CrystEngComm, 2026, 28, 990-999
7251461 CIFC36 H40 N4 O4P -110.9536; 12.2674; 12.3465
92.853; 98.138; 105.889
1572.7Perry-Britton, Meabh K. S.; Du, Jessica J.; White, Nicholas G.
1D chains and an open 3D network from poly(diethylamidinium) cations and polycarboxylate anions
CrystEngComm, 2026, 28, 990-999
7251462 CIFC30 H36 N4 O4P n n a9.4959; 17.181; 23.879
90; 90; 90
3895.8Perry-Britton, Meabh K. S.; Du, Jessica J.; White, Nicholas G.
1D chains and an open 3D network from poly(diethylamidinium) cations and polycarboxylate anions
CrystEngComm, 2026, 28, 990-999
7251463 CIFC74 H80 N8 O8P b c n30.0803; 26.6383; 26.8475
90; 90; 90
21512.6Perry-Britton, Meabh K. S.; Du, Jessica J.; White, Nicholas G.
1D chains and an open 3D network from poly(diethylamidinium) cations and polycarboxylate anions
CrystEngComm, 2026, 28, 990-999
7251464 CIFC101 H100 N8 O16I 41/a :222.70732; 22.70732; 17.5665
90; 90; 90
9057.68Perry-Britton, Meabh K. S.; Du, Jessica J.; White, Nicholas G.
1D chains and an open 3D network from poly(diethylamidinium) cations and polycarboxylate anions
CrystEngComm, 2026, 28, 990-999
7251465 CIFC24 H28 N2 O3P 1 21 111.867; 5.9451; 14.816
90; 105.328; 90
1008.1Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar
Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies
CrystEngComm, 2026, 28, 1621-1635
7251466 CIFC34 H48 N2 O5P -18.159; 9.147; 23.118
84.592; 81.785; 68.743
1589.7Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar
Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies
CrystEngComm, 2026, 28, 1621-1635
7251467 CIFC28 H37 Cl N2 O5P -110.2784; 10.5283; 15.382
76.476; 85.972; 89.973
1614.2Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar
Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies
CrystEngComm, 2026, 28, 1621-1635
7251468 CIFC26 H32 N2 O5C 1 2/c 124.2682; 11.0691; 18.7201
90; 97.1082; 90
4990.1Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar
Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies
CrystEngComm, 2026, 28, 1621-1635
7251469 CIFC26 H35 N3 O4P -16.923; 9.5568; 20.6857
78.3703; 89.8695; 71.8961
1271.46Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar
Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies
CrystEngComm, 2026, 28, 1621-1635
7251470 CIFC24 H32 N2 O5P -16.721; 8.395; 21.299
80.462; 89.652; 80.149
1167.4Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar
Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies
CrystEngComm, 2026, 28, 1621-1635
7251471 CIFC26 H34 N2 O5P -17.072; 9.552; 20.43
78.051; 80.463; 69.442
1257.7Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar
Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies
CrystEngComm, 2026, 28, 1621-1635
7251472 CIFC28 H36 N2 O7P 1 21/n 117.796; 6.5459; 25.136
90; 109.131; 90
2766.4Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar
Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies
CrystEngComm, 2026, 28, 1621-1635
7251473 CIFC26 H33 Br N2 O5P n a 2128.4445; 9.0341; 10.3513
90; 90; 90
2660Doguparthi, Naga Prathyusha; Kanagavel, Manimurugan; Samreen, Sabiqa; Navya, Yaramala; Soujanya, Yarasi; Swain, Debasish; Nechipadappu, Sunil Kumar
Crystal engineering of the cystic fibrosis drug ivacaftor: salts, solvates and hydrate forms with solubility and stability studies
CrystEngComm, 2026, 28, 1621-1635
7251474 CIFC6 H4 Ag2 N4 O6 SI 1 2/a 17.201; 9.608; 15.507
90; 103.18; 90
1044.6Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa
Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly
CrystEngComm, 2026, 28, 1206-1214
7251475 CIFC20 H14 Ag Cl N4 O5 Se2P -13.814; 10.3541; 14.2499
92.62; 95.335; 94.139
558.06Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa
Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly
CrystEngComm, 2026, 28, 1206-1214
7251476 CIFC28 H22 Ag2 F12 N10 Sb2 Se4P 1 21/c 112.2862; 10.8853; 15.1578
90; 100.846; 90
1990.98Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa
Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly
CrystEngComm, 2026, 28, 1206-1214
7251477 CIFC44 H30 Ag2 Cl2 N10 O8 S4P -17.4983; 9.4191; 16.203
91.584; 90.423; 104.261
1108.6Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa
Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly
CrystEngComm, 2026, 28, 1206-1214
7251478 CIFC16 H16 Ag Cl N4 O4 Se2P -17.4239; 13.407; 20.291
107.42; 98.47; 93.08
1895.7Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa
Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly
CrystEngComm, 2026, 28, 1206-1214
7251479 CIFC6 H4 Ag2 N4 O6 SeI 1 2/a 17.1843; 9.6347; 15.7023
90; 102.367; 90
1061.67Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa
Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly
CrystEngComm, 2026, 28, 1206-1214
7251480 CIFC10 H6 Ag N3 O3 SeP 1 2/n 16.88; 12.017; 6.963
90; 117.27; 90
511.7Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa
Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly
CrystEngComm, 2026, 28, 1206-1214
7251481 CIFC14 H11 Ag B F4 N5 Se2P -17.8775; 10.6277; 12.0636
68.86; 88.968; 69.456
875.25Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa
Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly
CrystEngComm, 2026, 28, 1206-1214
7251482 CIFC12 H10 Ag B F4 N4 O S2P 1 21 16.9919; 11.3238; 10.4854
90; 106.456; 90
796.17Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa
Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly
CrystEngComm, 2026, 28, 1206-1214
7251483 CIFC14 H12 Ag N5 O3 Se2P -17.3648; 9.9357; 11.3068
96.414; 91.408; 104.754
793.87Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa
Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly
CrystEngComm, 2026, 28, 1206-1214
7251484 CIFC30 H18 Ag3 N9 O9 S3P 1 21/c 16.7953; 35.947; 13.5656
90; 101.474; 90
3247.5Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa
Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly
CrystEngComm, 2026, 28, 1206-1214
7251485 CIFC8 H10 Ag N3 O4 SeP b c a13.3558; 7.1039; 23.5974
90; 90; 90
2238.88Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa
Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly
CrystEngComm, 2026, 28, 1206-1214
7251486 CIFC16 H16 Ag N5 O3 Se2P 1 21/n 17.0765; 14.922; 17.437
90; 98.577; 90
1820.7Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa
Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly
CrystEngComm, 2026, 28, 1206-1214
7251487 CIFC28 H24 Ag2 N10 O6 Se4P 1 21/c 17.456; 21.169; 11.074
90; 109.36; 90
1649Alfuth, Jan; Chojnacki, Jarosław; Połoński, Tadeusz; Olszewska, Teresa
Structural diversity of supramolecular networks composed of 2,1,3-chalcogenadiazole silver(i) complexes: the role of chalcogen bonding in molecular self–assembly
CrystEngComm, 2026, 28, 1206-1214
7251488 CIFC17 H21 N3 O SP 1 21/n 112.7047; 8.0199; 16.4944
90; 105.648; 90
1618.33Joshi, Kirthi; Sangwan, Shruti; Jose, K. V. Jovan; Agarwal, Vipin.; Nangia, Ashwini K.
Solid-state conformations of pharmaceutical polymorphs in solution: validation and invalidation by NMR.
CrystEngComm, 2026, 28, 1339-1350
7251489 CIFC17 H21 N3 O SC 1 c 113.9971; 16.3389; 7.7318
90; 114.482; 90
1609.26Joshi, Kirthi; Sangwan, Shruti; Jose, K. V. Jovan; Agarwal, Vipin.; Nangia, Ashwini K.
Solid-state conformations of pharmaceutical polymorphs in solution: validation and invalidation by NMR.
CrystEngComm, 2026, 28, 1339-1350
7251490 CIFC17 H21 N3 O SP 21 21 217.325; 12.993; 16.832
90; 90; 90
1602Joshi, Kirthi; Sangwan, Shruti; Jose, K. V. Jovan; Agarwal, Vipin.; Nangia, Ashwini K.
Solid-state conformations of pharmaceutical polymorphs in solution: validation and invalidation by NMR.
CrystEngComm, 2026, 28, 1339-1350
7251491 CIFC12 H11 N9 O4 Zn2I 4/m12.8268; 12.8268; 25.8853
90; 90; 90
4258.8Bu, Qiyi; Zhang, Yushu; Wang, Li; Liu, Jiaqi; Wang, Yong; Li, Jinping
A triazolate-based MOF with amino-induced triazolate reorientation enabling pore-size regulation for CO2/CH4 separation
CrystEngComm, 2026, 28, 1485-1488
7251492 CIFC8 H18 O13 Pb Re2P 1 21/c 17.9684; 28.1002; 7.9792
90; 100.755; 90
1755.27Charkin, Dmitri; Grishaev, Vasili; Kireev, Vadim; Volkov, Sergey; Arsent'ev, Maxim; Vorobiev, Stepan; Gosteva, Alevtina; Kompanchenko, Alena; Khasanov, Kirill; Krzhizhanovskaya, Maria; Aksenov, Sergey; Petříček, Václav
The first lead perrhenate crown ether complex [Pb(12-crown-4)(H2O)(ReO4)2]: from rotation of the ReO4 tetrahedra in the (3 + 1)D space using constrained Legendre functions to rotation in the 3D space
CrystEngComm, 2026, 28, 1000-1007
7251493 CIFC13 H21 N2 O6P -17.8703; 9.391; 11.0106
72.161; 78.64; 84.085
758.69Zhang, Jing; Feng, Yi; Cao, Yun-Dong; Fan, Lin-Lin; Lv, Cai-Li; Cheng, Lei; Gao, Guang-Gang; Liu, Hong
Solvated pyromellitic acid-modified separator for stable lithium metal anodes and high-performance Li–S batteries
CrystEngComm, 2026, 28, 1135-1146
7251494 CIFC10 H11 F2 N OP 21 21 215.1128; 6.7751; 27.331
90; 90; 90
946.7Das, Prantika; Bhandary, Subhrajyoti; Mathew, Dona; Dutta, Arnab; Dhabhai, Kanu Priya; Seth, Saikat Kumar; Chopra, Deepak
Investigation of noncovalent interactions in organofluorine compounds with C–F bonds in different electronic environments
CrystEngComm, 2026, 28, 1494-1507
7251495 CIFC10 H11 F2 N OP -15.1799; 9.618; 10.442
81.822; 80.772; 74.442
492Das, Prantika; Bhandary, Subhrajyoti; Mathew, Dona; Dutta, Arnab; Dhabhai, Kanu Priya; Seth, Saikat Kumar; Chopra, Deepak
Investigation of noncovalent interactions in organofluorine compounds with C–F bonds in different electronic environments
CrystEngComm, 2026, 28, 1494-1507
7251496 CIFC10 H11 F2 N OP c a 2112.0624; 9.4612; 8.6588
90; 90; 90
988.18Das, Prantika; Bhandary, Subhrajyoti; Mathew, Dona; Dutta, Arnab; Dhabhai, Kanu Priya; Seth, Saikat Kumar; Chopra, Deepak
Investigation of noncovalent interactions in organofluorine compounds with C–F bonds in different electronic environments
CrystEngComm, 2026, 28, 1494-1507
7251497 CIFC20 H22 F4 N2 O2P 1 21/n 19.51; 11.0959; 19.198
90; 102.991; 90
1974Das, Prantika; Bhandary, Subhrajyoti; Mathew, Dona; Dutta, Arnab; Dhabhai, Kanu Priya; Seth, Saikat Kumar; Chopra, Deepak
Investigation of noncovalent interactions in organofluorine compounds with C–F bonds in different electronic environments
CrystEngComm, 2026, 28, 1494-1507
7251498 CIFC8 H13 N O6 SP 21 21 216.8391; 11.2218; 13.7253
90; 90; 90
1053.38García-Raso, Ángel; Rocha, Mariana; Terrón, Ángel; Fiol, Juan J.; López-Zafra, Adela; Rodríguez, Carlos A.; Vázquez-López, Ezequiel M.; Barceló-Oliver, Miquel; Frontera, Antonio
The crucial role of lattice water in directing supramolecular networks of deferiprone analogues: a combined X-ray and DFT study
CrystEngComm, 2026, 28, 951-961
7251499 CIFC22 H34 Cl2 Cu N6 O8P -18.1875; 8.7569; 9.8704
94.856; 103.393; 103.024
663.7García-Raso, Ángel; Rocha, Mariana; Terrón, Ángel; Fiol, Juan J.; López-Zafra, Adela; Rodríguez, Carlos A.; Vázquez-López, Ezequiel M.; Barceló-Oliver, Miquel; Frontera, Antonio
The crucial role of lattice water in directing supramolecular networks of deferiprone analogues: a combined X-ray and DFT study
CrystEngComm, 2026, 28, 951-961
7251500 CIFC7.33 H11.33 Cl0.67 N2 O2.33C 1 2/c 151.723; 7.3982; 13.4262
90; 97.297; 90
5096García-Raso, Ángel; Rocha, Mariana; Terrón, Ángel; Fiol, Juan J.; López-Zafra, Adela; Rodríguez, Carlos A.; Vázquez-López, Ezequiel M.; Barceló-Oliver, Miquel; Frontera, Antonio
The crucial role of lattice water in directing supramolecular networks of deferiprone analogues: a combined X-ray and DFT study
CrystEngComm, 2026, 28, 951-961
7251501 CIFC12 H17 N3 O6P -17.0597; 8.8765; 11.2263
89.195; 88.506; 68.574
654.65García-Raso, Ángel; Rocha, Mariana; Terrón, Ángel; Fiol, Juan J.; López-Zafra, Adela; Rodríguez, Carlos A.; Vázquez-López, Ezequiel M.; Barceló-Oliver, Miquel; Frontera, Antonio
The crucial role of lattice water in directing supramolecular networks of deferiprone analogues: a combined X-ray and DFT study
CrystEngComm, 2026, 28, 951-961
7251502 CIFC10 H10 Br2 Cl5 I2 N2 SbP 1 21/n 114.9208; 7.0913; 20.9159
90; 97.395; 90
2194.66Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maxim N.; Novikov, Alexander S.; Adonin, Sergey A.
Supramolecular diiodo-chlorometalates(iii) of group 15 elements with halogen-substituted pyridiniums: an interplay of cation⋯anion and I2⋯halometalate halogen bonds
CrystEngComm, 2026, 28, 1197-1205

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