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COD ID	Links	Formula	Space group	Cell parameters	Cell volume	Bibliography
7246872	CIF	C9 H11 Cl N4 Se	P 1 2/c 1	11.922; 6.546; 14.62 90; 108.226; 90	1083.7	Artemjev, Alexey A.; Kubasov, Alexey S.; Kuznetsov, Maxim L.; Grudova, Mariya V.; Khrustalev, Victor N.; Kritchenkov, Andreii S.; Tskhovrebov, Alexander G. Mechanistic investigation of 1,3-dipolar cycloaddition between bifunctional 2-pyridylselenyl reagents and nitriles including reactions with cyanamides CrystEngComm, 2023, 25, 3691-3701
7246873	CIF	C8 H10 Cl N3 O4 Se	P -1	6.8384; 9.403; 10.236 67.561; 74.848; 70.534	566.7	Artemjev, Alexey A.; Kubasov, Alexey S.; Kuznetsov, Maxim L.; Grudova, Mariya V.; Khrustalev, Victor N.; Kritchenkov, Andreii S.; Tskhovrebov, Alexander G. Mechanistic investigation of 1,3-dipolar cycloaddition between bifunctional 2-pyridylselenyl reagents and nitriles including reactions with cyanamides CrystEngComm, 2023, 25, 3691-3701
7246874	CIF	C16 H12 Cl N3 Se	P 41	7.811; 7.811; 23.699 90; 90; 90	1445.9	Artemjev, Alexey A.; Kubasov, Alexey S.; Kuznetsov, Maxim L.; Grudova, Mariya V.; Khrustalev, Victor N.; Kritchenkov, Andreii S.; Tskhovrebov, Alexander G. Mechanistic investigation of 1,3-dipolar cycloaddition between bifunctional 2-pyridylselenyl reagents and nitriles including reactions with cyanamides CrystEngComm, 2023, 25, 3691-3701
7246875	CIF	C32 H30 B N3 Se	P 1 21/c 1	15.3881; 9.8662; 18.2499 90; 105.566; 90	2669.11	Artemjev, Alexey A.; Kubasov, Alexey S.; Kuznetsov, Maxim L.; Grudova, Mariya V.; Khrustalev, Victor N.; Kritchenkov, Andreii S.; Tskhovrebov, Alexander G. Mechanistic investigation of 1,3-dipolar cycloaddition between bifunctional 2-pyridylselenyl reagents and nitriles including reactions with cyanamides CrystEngComm, 2023, 25, 3691-3701
7246878	CIF	C18 H12 Ag B F4 N4 O4	C 1 2/c 1	9.8173; 12.9566; 14.7156 90; 101.124; 90	1836.64	Yousri, Amal; Haukka, Matti; Abu-Youssef, Morsy A. M.; Salah Ayoup, Mohammed; Ismail, Magda M. F.; El Menofy, Nagwan G.; Soliman, Saied M.; Barakat, Assem; Amombo Noa, Francoise M.; Öhrström, Lars Synthesis, structure diversity, and antimicrobial studies of Ag(i) complexes with quinoline-type ligands CrystEngComm, 2023, 25, 3922-3930
7246879	CIF	C10 H8 Ag B F4 N2 O	C 1 2/c 1	10.048; 16.8535; 14.5843 90; 98.505; 90	2442.6	Yousri, Amal; Haukka, Matti; Abu-Youssef, Morsy A. M.; Salah Ayoup, Mohammed; Ismail, Magda M. F.; El Menofy, Nagwan G.; Soliman, Saied M.; Barakat, Assem; Amombo Noa, Francoise M.; Öhrström, Lars Synthesis, structure diversity, and antimicrobial studies of Ag(i) complexes with quinoline-type ligands CrystEngComm, 2023, 25, 3922-3930
7246880	CIF	C12 H14 N2 O2	P b c a	7.5657; 11.619; 25.402 90; 90; 90	2233	Lazić, Anita; Radovanović, Lidija; Rogan, Jelena; Valentić, Nataša; Janjić, Goran; Đorđević, Ivana; Trišović, Nemanja Exploring the supramolecular profile of 5-phenylhydantoins CrystEngComm, 2023, 25, 3637-3654
7246881	CIF	C11 H12 N2 O2	P b c a	7.3489; 14.605; 19.983 90; 90; 90	2144.8	Lazić, Anita; Radovanović, Lidija; Rogan, Jelena; Valentić, Nataša; Janjić, Goran; Đorđević, Ivana; Trišović, Nemanja Exploring the supramolecular profile of 5-phenylhydantoins CrystEngComm, 2023, 25, 3637-3654
7246882	CIF	C11 H12 N2 O3	P 21 21 21	6.2259; 7.1884; 23.607 90; 90; 90	1056.5	Lazić, Anita; Radovanović, Lidija; Rogan, Jelena; Valentić, Nataša; Janjić, Goran; Đorđević, Ivana; Trišović, Nemanja Exploring the supramolecular profile of 5-phenylhydantoins CrystEngComm, 2023, 25, 3637-3654
7246883	CIF	C10 H11 N3 O5	P -1	6.8817; 8.3267; 10.789 83.96; 76.71; 70.02	565.2	Lazić, Anita; Radovanović, Lidija; Rogan, Jelena; Valentić, Nataša; Janjić, Goran; Đorđević, Ivana; Trišović, Nemanja Exploring the supramolecular profile of 5-phenylhydantoins CrystEngComm, 2023, 25, 3637-3654
7246884	CIF	C14 H18 Co N2 O5	C 1 2/c 1	10.812; 18.958; 7.114 90; 116.03; 90	1310.3	Muthukumar, Pandi; Arunkumar, Gunasekaran; Pannipara, Mehboobali; Al-Sehemi, Abdullah G.; Moon, Dohyun; Anthony, Savarimuthu Philip Water coordinated Co-MOFs with 1D/2D network structure and highly enhanced electrocatalytic OER activity CrystEngComm, 2023, 25, 4058-4063
7246885	CIF	C18 H14 Co N2 O5	P 1 21/n 1	9.655; 16.355; 11.069 90; 110.97; 90	1632.1	Muthukumar, Pandi; Arunkumar, Gunasekaran; Pannipara, Mehboobali; Al-Sehemi, Abdullah G.; Moon, Dohyun; Anthony, Savarimuthu Philip Water coordinated Co-MOFs with 1D/2D network structure and highly enhanced electrocatalytic OER activity CrystEngComm, 2023, 25, 4058-4063
7246886	CIF	C6 N16	P c a 21	12.0754; 10.5591; 8.8651 90; 90; 90	1130.35	Leškovskis, Kristaps; Mishnev, Anatoly; Novosjolova, Irina; Krumm, Burkhard; Klapötke, Thomas M.; Turks, Māris 2,4,6,8-Tetraazidopyrimido[5,4-d]pyrimidine: a novel energetic binary compound CrystEngComm, 2023, 25, 3866-3869
7246887	CIF	C26 H28 Cl2 Co N4	I 41/a :2	17.0985; 17.0985; 42.1074 90; 90; 90	12310.5	Tella, Adedibu C.; Owalude, Samson O.; Ameen, Olanrewaju A.; Clayton, Hadley S.; Yusuph, Quadrat; Dembaremba, Tendai O.; Hosten, Eric C.; Ogunlaja, Adeniyi S. Synthesis, crystal structures and DFT studies of Co(ii) and Zn(ii) coordination polymers of terephthalate and 4,4′-trimethylenedipyridyl ligands for removal of dibenzothiophene from a model fuel oil CrystEngComm, 2023, 25, 3998-4010
7246888	CIF	C42 H42 N4 O11 Zn2	C 1 2/c 1	21.0837; 11.4677; 19.6425 90; 119.297; 90	4141.7	Tella, Adedibu C.; Owalude, Samson O.; Ameen, Olanrewaju A.; Clayton, Hadley S.; Yusuph, Quadrat; Dembaremba, Tendai O.; Hosten, Eric C.; Ogunlaja, Adeniyi S. Synthesis, crystal structures and DFT studies of Co(ii) and Zn(ii) coordination polymers of terephthalate and 4,4′-trimethylenedipyridyl ligands for removal of dibenzothiophene from a model fuel oil CrystEngComm, 2023, 25, 3998-4010
7246889	CIF	C28 H29 Cl N10 O7	P -1	7.1842; 14.4765; 15.9555 68.871; 78.281; 79.368	1504.29	Wang, Zhi-Qing; Dai, Xia-Lin; Gu, Dai-Lin; Wu, Chao; Lu, Tong-Bu; Long, Xiang-Tian; Chen, Jia-Mei Cocrystallization of lenvatinib and temozolomide to improve the performance in terms of stability, dissolution, and tabletability CrystEngComm, 2023, 25, 4189-4198
7246890	CIF	C24 H40 Mn3 Mo12 N8 O66 P8	P -1	12.0309; 13.9974; 14.7291 103.276; 106.729; 110.009	2078.4	Wang, Jinling; Liu, Xiaohui; Chang, Zhihan; Xu, Na; Wang, Xiuli Two new manganese-based phosphomolybdate compounds as electrochemical sensors for the highly sensitive trace determination of heavy metal Cr(vi) ions CrystEngComm, 2023, 25, 3953-3958
7246891	CIF	C24 H34 Mn3 Mo12 N8 O66 P8	P -1	11.944; 13.794; 14.6825 102.637; 106; 110.82	2033.94	Wang, Jinling; Liu, Xiaohui; Chang, Zhihan; Xu, Na; Wang, Xiuli Two new manganese-based phosphomolybdate compounds as electrochemical sensors for the highly sensitive trace determination of heavy metal Cr(vi) ions CrystEngComm, 2023, 25, 3953-3958
7246892	CIF	C26 H29 Cl N4 O6 Zn	C 1 c 1	11.976; 9.343; 21.923 90; 97.91; 90	2429.7	Guo, Runzhong; Liu, Yuchen; Wang, Zhibin; Wang, Haiying; Liu, Huiyan Anion-dependent dynamic structure and tunable luminescence of Zn-MOFs with carboxyphenyl-terpyridine ligands CrystEngComm, 2023, 25, 4157-4166
7246893	CIF	C78 H79 Cl1.5 N13 O16.7 Zn3	P 1 21/m 1	12.8121; 21.163; 15.335 90; 113.952; 90	3799.9	Guo, Runzhong; Liu, Yuchen; Wang, Zhibin; Wang, Haiying; Liu, Huiyan Anion-dependent dynamic structure and tunable luminescence of Zn-MOFs with carboxyphenyl-terpyridine ligands CrystEngComm, 2023, 25, 4157-4166
7246894	CIF	C77.78 H76.08 B F4 N13.89 O18.94 Zn3	P 1 21/n 1	15.521; 21.92; 23.657 90; 101.131; 90	7897	Guo, Runzhong; Liu, Yuchen; Wang, Zhibin; Wang, Haiying; Liu, Huiyan Anion-dependent dynamic structure and tunable luminescence of Zn-MOFs with carboxyphenyl-terpyridine ligands CrystEngComm, 2023, 25, 4157-4166
7246895	CIF	C78 H78 Cl N14 O23.11 Zn3	P 1 21/n 1	15.5019; 21.9566; 23.6652 90; 101.326; 90	7898	Guo, Runzhong; Liu, Yuchen; Wang, Zhibin; Wang, Haiying; Liu, Huiyan Anion-dependent dynamic structure and tunable luminescence of Zn-MOFs with carboxyphenyl-terpyridine ligands CrystEngComm, 2023, 25, 4157-4166
7246896	CIF	C H8 B9 I N2	C 1 c 1	16.2967; 6.5799; 11.8991 90; 126.545; 90	1025.08	Pietrzak, Anna; Carr, Michael J.; Kaszyński, Piotr Substituent effects on the [1-closo-CB9H10]− anion geometry: experimental and DFT studies CrystEngComm, 2023, 25, 3790-3798
7246897	CIF	C3 H15 B9 S	P -1	6.4442; 8.1244; 10.6645 85.078; 82.012; 74.701	532.62	Pietrzak, Anna; Carr, Michael J.; Kaszyński, Piotr Substituent effects on the [1-closo-CB9H10]− anion geometry: experimental and DFT studies CrystEngComm, 2023, 25, 3790-3798
7246898	CIF	C7 H16 B9 Cl2 N	P 1 21 1	9.9849; 14.325; 10.8831 90; 102.415; 90	1520.25	Pietrzak, Anna; Carr, Michael J.; Kaszyński, Piotr Substituent effects on the [1-closo-CB9H10]− anion geometry: experimental and DFT studies CrystEngComm, 2023, 25, 3790-3798
7246899	CIF	C6 H14 B9 N	P 1 21/c 1	10.1476; 10.8518; 13.7392 90; 130.476; 90	1150.87	Pietrzak, Anna; Carr, Michael J.; Kaszyński, Piotr Substituent effects on the [1-closo-CB9H10]− anion geometry: experimental and DFT studies CrystEngComm, 2023, 25, 3790-3798
7246900	CIF	C46 H110 B18 Br2 N10	P -1	9.0602; 16.8803; 22.9672 104.577; 92.623; 90.179	3395.56	Pietrzak, Anna; Carr, Michael J.; Kaszyński, Piotr Substituent effects on the [1-closo-CB9H10]− anion geometry: experimental and DFT studies CrystEngComm, 2023, 25, 3790-3798
7246901	CIF	C16 H18 O2 P S2 Tl	C 1 2/c 1	25.773; 7.57; 19.9962 90; 111.128; 90	3639	Firdoos, Tahira; Kumar, Pretam; Sharma, Nipunn; Gomila, Rosa M.; Frontera, Antonio; Sood, Puneet; Pandey, Sushil K. Thallium(i)phosphorodithioates containing intra- and intermolecular π-hole triel bonds CrystEngComm, 2023, 25, 3777-3789
7246902	CIF	C16 H18 O2 P S2 Tl	P 1 21/n 1	10.5578; 8.6342; 19.878 90; 101.343; 90	1776.65	Firdoos, Tahira; Kumar, Pretam; Sharma, Nipunn; Gomila, Rosa M.; Frontera, Antonio; Sood, Puneet; Pandey, Sushil K. Thallium(i)phosphorodithioates containing intra- and intermolecular π-hole triel bonds CrystEngComm, 2023, 25, 3777-3789
7246903	CIF	C12 H26 N2 O13 U	P 1 21/n 1	11.6052; 15.1797; 12.7681 90; 116.773; 90	2008.1	Thuéry, Pierre; Atoini, Youssef; Harrowfield, Jack Triple-armed aliphatic tricarboxylic acids as sources of ligands for uranyl ion: influence of bridgehead functionalization CrystEngComm, 2023, 25, 3904-3915
7246904	CIF	C9 H13 O9 P U	P 1 21/c 1	7.382; 23.3063; 8.5496 90; 113.584; 90	1348.07	Thuéry, Pierre; Atoini, Youssef; Harrowfield, Jack Triple-armed aliphatic tricarboxylic acids as sources of ligands for uranyl ion: influence of bridgehead functionalization CrystEngComm, 2023, 25, 3904-3915
7246905	CIF	C22 H38 N8 O21 U2	P 1 21 1	11.6822; 15.3912; 11.7959 90; 115.56; 90	1913.37	Thuéry, Pierre; Atoini, Youssef; Harrowfield, Jack Triple-armed aliphatic tricarboxylic acids as sources of ligands for uranyl ion: influence of bridgehead functionalization CrystEngComm, 2023, 25, 3904-3915
7246906	CIF	C40 H46 N6 Ni O23 U2	C 1 c 1	12.4106; 17.241; 23.5189 90; 102.782; 90	4907.7	Thuéry, Pierre; Atoini, Youssef; Harrowfield, Jack Triple-armed aliphatic tricarboxylic acids as sources of ligands for uranyl ion: influence of bridgehead functionalization CrystEngComm, 2023, 25, 3904-3915
7246907	CIF	C36 H64 Cu N6 O22 U2	P -1	11.3872; 11.5224; 12.7894 114.797; 98.3735; 110.77	1335.95	Thuéry, Pierre; Atoini, Youssef; Harrowfield, Jack Triple-armed aliphatic tricarboxylic acids as sources of ligands for uranyl ion: influence of bridgehead functionalization CrystEngComm, 2023, 25, 3904-3915
7246908	CIF	C40 H46 Cu N6 O23 U2	C 1 c 1	12.4847; 17.0888; 23.5455 90; 103.131; 90	4892.1	Thuéry, Pierre; Atoini, Youssef; Harrowfield, Jack Triple-armed aliphatic tricarboxylic acids as sources of ligands for uranyl ion: influence of bridgehead functionalization CrystEngComm, 2023, 25, 3904-3915
7246909	CIF	C29 H30 N O10 P U	P 1 21/c 1	11.4827; 14.2168; 17.799 90; 92.2934; 90	2903.31	Thuéry, Pierre; Atoini, Youssef; Harrowfield, Jack Triple-armed aliphatic tricarboxylic acids as sources of ligands for uranyl ion: influence of bridgehead functionalization CrystEngComm, 2023, 25, 3904-3915
7246910	CIF	C Na3 O8 P V	P 1 21/m 1	6.3646; 6.3135; 8.8975 90; 110.334; 90	335.25	Yakubovich, Olga; Kiriukhina, Galina; Simonov, Sergey; Volkov, Anatoly; Dimitrova, Olga Na3(VO)(PO4)(CO3): a synthetic member of the bradleyite phosphate carbonate family with a new type of crystal structure CrystEngComm, 2023, 25, 4024-4032
7246911	CIF	C10 H20 N4 O10 P3	P -1	9.641; 9.739; 11.262 97.39; 101.51; 113.55	924	Budzikur-Maciąg, Daria; Kinzhybalo, Vasyl; Ślepokura, Katarzyna Structural variety and dehydration in 3-aminopyridine–hypodiphosphoric acid–water system CrystEngComm, 2023, 25, 3826-3836
7246912	CIF	C5 H10 N2 O6 P2	P -1	7.327; 8.018; 9.174 113.48; 106.06; 90.3	470.9	Budzikur-Maciąg, Daria; Kinzhybalo, Vasyl; Ślepokura, Katarzyna Structural variety and dehydration in 3-aminopyridine–hypodiphosphoric acid–water system CrystEngComm, 2023, 25, 3826-3836
7246913	CIF	C20 H36 N8 O18 P6	P -1	8.001; 8.69; 13.612 79.88; 73.43; 84.7	892.1	Budzikur-Maciąg, Daria; Kinzhybalo, Vasyl; Ślepokura, Katarzyna Structural variety and dehydration in 3-aminopyridine–hypodiphosphoric acid–water system CrystEngComm, 2023, 25, 3826-3836
7246914	CIF	C15 H22 N6 O6 P2	P n a 21	12.014; 13.556; 12.259 90; 90; 90	1996.5	Budzikur-Maciąg, Daria; Kinzhybalo, Vasyl; Ślepokura, Katarzyna Structural variety and dehydration in 3-aminopyridine–hypodiphosphoric acid–water system CrystEngComm, 2023, 25, 3826-3836
7246915	CIF	C30 H48 N12 O14 P4	P 1 21/c 1	12.0257; 14.6592; 12.1537 90; 106.49; 90	2054.4	Budzikur-Maciąg, Daria; Kinzhybalo, Vasyl; Ślepokura, Katarzyna Structural variety and dehydration in 3-aminopyridine–hypodiphosphoric acid–water system CrystEngComm, 2023, 25, 3826-3836
7246916	CIF	C10 H20 N4 O10 P3	P -1	10.6024; 13.234; 13.848 73.1; 81.56; 81.96	1829.3	Budzikur-Maciąg, Daria; Kinzhybalo, Vasyl; Ślepokura, Katarzyna Structural variety and dehydration in 3-aminopyridine–hypodiphosphoric acid–water system CrystEngComm, 2023, 25, 3826-3836
7246917	CIF	C26 H12 N4 O	P 1 c 1	7.9325; 7.8534; 15.8599 90; 99.753; 90	973.75	Wang, Shuai; Xiang, Wenxin; Pan, Chen; Chen, Jinqiu; Li, Wenju; Zhang, Jing; Zhao, Jianfeng; Liu, Guangfeng Changes in piezochromic luminescence of a charge transfer complex subjected to grinding and isotropic compression CrystEngComm, 2023, 25, 3861-3865
7246918	CIF	C26 H12 N4 O	P -1	7.9376; 7.9412; 15.8417 93.49; 100.212; 92.313	979.59	Wang, Shuai; Xiang, Wenxin; Pan, Chen; Chen, Jinqiu; Li, Wenju; Zhang, Jing; Zhao, Jianfeng; Liu, Guangfeng Changes in piezochromic luminescence of a charge transfer complex subjected to grinding and isotropic compression CrystEngComm, 2023, 25, 3861-3865
7246919	CIF	C70 H64 Cl4 Cu2 N16 O12 S8	C 1 2/c 1	18.6359; 11.9828; 17.9652 90; 103.225; 90	3905.4	Lee, Hyeong-Hwan; Oh, Jihye; Lee, Shim Sung; Park, In-Hyeok Preparation of one-dimensional coordination polymers of a flexible tripyridyl disulfide with diverse topologies CrystEngComm, 2023, 25, 4033-4038
7246920	CIF	C19 H18 Ag F6 N4 P S2	P -1	8.0501; 12.563; 12.6704 68.686; 78.062; 89.674	1164.54	Lee, Hyeong-Hwan; Oh, Jihye; Lee, Shim Sung; Park, In-Hyeok Preparation of one-dimensional coordination polymers of a flexible tripyridyl disulfide with diverse topologies CrystEngComm, 2023, 25, 4033-4038
7246921	CIF	C18 H17 Ag Cl2 N4 O3 S2	P 1 21/n 1	7.9319; 23.068; 11.7359 90; 91.872; 90	2146.21	Lee, Hyeong-Hwan; Oh, Jihye; Lee, Shim Sung; Park, In-Hyeok Preparation of one-dimensional coordination polymers of a flexible tripyridyl disulfide with diverse topologies CrystEngComm, 2023, 25, 4033-4038
7246922	CIF	C18 H17 Ag Cl3 N3 O4 S2	P -1	9.8728; 10.2889; 10.9536 80.721; 87.251; 73.377	1052.22	Lee, Hyeong-Hwan; Oh, Jihye; Lee, Shim Sung; Park, In-Hyeok Preparation of one-dimensional coordination polymers of a flexible tripyridyl disulfide with diverse topologies CrystEngComm, 2023, 25, 4033-4038
7246923	CIF	C40 H43 N3 O7 Zn	C 1 c 1	13.2718; 9.2515; 27.958 90; 90.371; 90	3432.72	Hu, Hui; Zhang, Zhen-Wei; Zhang, Da-Shuai; Zhou, Xue; Ji, Hui; Zhang, Yong-Zheng; Deng, Yuchen; Geng, Longlong; Zhang, Xiuling; Lv, Chao; Wei, Rongmin; Wang, Jin-Hua Modulating the luminescent performances on blue-emitting coordination polymers via tuning the end-solvent molecules CrystEngComm, 2023, 25, 3896-3903
7246924	CIF	C34 H30 N2 O6 Zn	C 1 2/c 1	17.1162; 6.8868; 25.8217 90; 98.038; 90	3013.9	Hu, Hui; Zhang, Zhen-Wei; Zhang, Da-Shuai; Zhou, Xue; Ji, Hui; Zhang, Yong-Zheng; Deng, Yuchen; Geng, Longlong; Zhang, Xiuling; Lv, Chao; Wei, Rongmin; Wang, Jin-Hua Modulating the luminescent performances on blue-emitting coordination polymers via tuning the end-solvent molecules CrystEngComm, 2023, 25, 3896-3903
7246925	CIF	C38 H36 N2 O6 Zn	C 1 2/c 1	16.874; 6.9253; 28.607 90; 91.96; 90	3341	Hu, Hui; Zhang, Zhen-Wei; Zhang, Da-Shuai; Zhou, Xue; Ji, Hui; Zhang, Yong-Zheng; Deng, Yuchen; Geng, Longlong; Zhang, Xiuling; Lv, Chao; Wei, Rongmin; Wang, Jin-Hua Modulating the luminescent performances on blue-emitting coordination polymers via tuning the end-solvent molecules CrystEngComm, 2023, 25, 3896-3903
7246926	CIF	C37 H19 N O21 Zn4	P 1	9.867; 12.0062; 13.1276 115.459; 93.033; 91.808	1399.63	Zhang, Le-Tian; Fu, Zi-Xuan; Yin, Jia-Cheng; Liu, Ming; Zhang, Yin-Qiang; Lan, Lan; Li, Na; Bu, Xian-He UV and X-ray dual-induced photochromism in a benzophenone-based metal–organic framework for inkless erasable printing CrystEngComm, 2023, 25, 4019-4023
7246927	CIF	C37 H19 N O21 Zn4	P 1	9.8663; 11.9838; 13.1236 115.559; 93.042; 91.661	1395.54	Zhang, Le-Tian; Fu, Zi-Xuan; Yin, Jia-Cheng; Liu, Ming; Zhang, Yin-Qiang; Lan, Lan; Li, Na; Bu, Xian-He UV and X-ray dual-induced photochromism in a benzophenone-based metal–organic framework for inkless erasable printing CrystEngComm, 2023, 25, 4019-4023
7246928	CIF	C14 H33.52 Cl6 Mn N2	P -1	12.952; 13.4792; 15.8481 110.169; 113.276; 90.899	2348.4	Zhang, Yinan; Cai, Zhuoer; Zhang, Xinyi; Xiao, Shiyue; Liu, Xianmin; Zhao, Yingyi; Hua, Xiu-Ni; Sun, Baiwang Dielectric and optical properties of a new organic–inorganic hybrid phase transition material CrystEngComm, 2023, 25, 4284-4289
7246929	CIF	C14 H34 Cl6 Mn N2	P 42/n m c :2	9.2031; 9.2031; 14.662 90; 90; 90	1241.8	Zhang, Yinan; Cai, Zhuoer; Zhang, Xinyi; Xiao, Shiyue; Liu, Xianmin; Zhao, Yingyi; Hua, Xiu-Ni; Sun, Baiwang Dielectric and optical properties of a new organic–inorganic hybrid phase transition material CrystEngComm, 2023, 25, 4284-4289
7246930	CIF	C112 H84 Mn4 N16 O26	P n m a	37.455; 36.5541; 11.0255 90; 90; 90	15095.4	Yin, Jia-Ling; Yan, Qing-Qing; Liu, Yu-Xin; Yong, Guo-Ping From zero-dimensional metallomacrocycle to three-dimensional metal–organic frameworks mediated by solvent polarity: near-white light emissions and gas adsorption properties CrystEngComm, 2023, 25, 4435-4444
7246931	CIF	C28 H16 Mn N4 O4	P 1 21/c 1	11.4539; 25.379; 10.1811 90; 99.143; 90	2921.9	Yin, Jia-Ling; Yan, Qing-Qing; Liu, Yu-Xin; Yong, Guo-Ping From zero-dimensional metallomacrocycle to three-dimensional metal–organic frameworks mediated by solvent polarity: near-white light emissions and gas adsorption properties CrystEngComm, 2023, 25, 4435-4444
7246932	CIF	C50 H34 N2 O11 Zn2	P 1 21/c 1	33.5391; 13.3893; 12.2796 90; 98.383; 90	5455.4	Yin, Jia-Ling; Yan, Qing-Qing; Liu, Yu-Xin; Yong, Guo-Ping From zero-dimensional metallomacrocycle to three-dimensional metal–organic frameworks mediated by solvent polarity: near-white light emissions and gas adsorption properties CrystEngComm, 2023, 25, 4435-4444
7246933	CIF	C10 H11 N O4	P 1 n 1	9.5646; 3.7993; 13.5636 90; 106.084; 90	473.59	Gao, Lijie; Wang, Meng; Li, Shuyu; Chen, Kui; Zhou, Lina; Li, Xin; Wang, Na; Huang, Xin; Hao, Hongxun; Wang, Ting Real-time fluorescence visualization of the evaporation crystallization process based on the AIEE mechanism CrystEngComm, 2023, 25, 4064-4075
7246934	CIF	C10 H11 N O4	P 1 21/c 1	7.1188; 18.663; 7.959 90; 106.09; 90	1016	Gao, Lijie; Wang, Meng; Li, Shuyu; Chen, Kui; Zhou, Lina; Li, Xin; Wang, Na; Huang, Xin; Hao, Hongxun; Wang, Ting Real-time fluorescence visualization of the evaporation crystallization process based on the AIEE mechanism CrystEngComm, 2023, 25, 4064-4075
7246935	CIF	C29 H29 N2 O11.5 Zn2	P -1	9.3469; 9.976; 17.9902 79.743; 86.729; 67.295	1522.64	Xiao, Cheng-Yue; Deng, Xi-Ling; Wei, Zan-Bin; Yang, Shi-Yao Research on single-crystal-to-single-crystal photoaddition and extension of Schmidt's rule in topological chemistry CrystEngComm, 2023, 25, 3714-3717
7246936	CIF	C29 H27.8 N2 O10.9 Zn2	P -1	9.1845; 9.9874; 18.5249 79.721; 86.064; 68.155	1551.94	Xiao, Cheng-Yue; Deng, Xi-Ling; Wei, Zan-Bin; Yang, Shi-Yao Research on single-crystal-to-single-crystal photoaddition and extension of Schmidt's rule in topological chemistry CrystEngComm, 2023, 25, 3714-3717
7246937	CIF	C29 H29.8 N2 O11.9 Zn2	P -1	9.351; 9.9976; 18.0428 80.1; 87.289; 67.583	1535.78	Xiao, Cheng-Yue; Deng, Xi-Ling; Wei, Zan-Bin; Yang, Shi-Yao Research on single-crystal-to-single-crystal photoaddition and extension of Schmidt's rule in topological chemistry CrystEngComm, 2023, 25, 3714-3717
7246938	CIF	C29 H27.7 N2 O10.85 Zn2	P -1	8.717; 9.9589; 19.6815 78.835; 84.141; 69.71	1571.1	Xiao, Cheng-Yue; Deng, Xi-Ling; Wei, Zan-Bin; Yang, Shi-Yao Research on single-crystal-to-single-crystal photoaddition and extension of Schmidt's rule in topological chemistry CrystEngComm, 2023, 25, 3714-3717
7246949	CIF	C30 H19 Ag N16	P 1 21/c 1	14.312; 8.755; 25.39 90; 95.79; 90	3165	Kang, Hai-Peng; Zhou, Han-Chen; Tang, Xiong; Liu, Chang; Li, Yong-Hua; Zhang, Hao-Zhe; Su, Jian; Ferbinteanu, Marilena; Wu, Hua-Yu; Wang, Shi An AIE-active tetraphenylethene functionalized silver-tetrazolate coordination polymer for selective fluorescence sensing of explosives CrystEngComm, 2023, 25, 4231-4237
7246974	CIF	C20 H14 Cd N4 O8	P -1	4.9864; 10.0378; 10.0982 72.982; 83.424; 79.174	473.75	Andaloussi, Yassin H.; Bezrukov, Andrey A.; Sensharma, Debobroto; Zaworotko, Michael J. Supramolecular isomerism and structural flexibility in coordination networks sustained by cadmium rod building blocks. CrystEngComm, 2023, 25, 4175-4181
7246975	CIF	C20 H14 Cd N4 O8	P 1 21/c 1	4.9218; 18.328; 10.9159 90; 97.893; 90	975.36	Andaloussi, Yassin H.; Bezrukov, Andrey A.; Sensharma, Debobroto; Zaworotko, Michael J. Supramolecular isomerism and structural flexibility in coordination networks sustained by cadmium rod building blocks. CrystEngComm, 2023, 25, 4175-4181
7246976	CIF	C26 H28 Cd N6 O10	P 1 21/c 1	5.0968; 18.2442; 15.0256 90; 96.058; 90	1389.38	Andaloussi, Yassin H.; Bezrukov, Andrey A.; Sensharma, Debobroto; Zaworotko, Michael J. Supramolecular isomerism and structural flexibility in coordination networks sustained by cadmium rod building blocks. CrystEngComm, 2023, 25, 4175-4181
7246977	CIF	C20 H14 Cd N4 O8	P -1	5.0173; 9.6508; 11.4756 82.357; 79.568; 80.006	535.21	Andaloussi, Yassin H.; Bezrukov, Andrey A.; Sensharma, Debobroto; Zaworotko, Michael J. Supramolecular isomerism and structural flexibility in coordination networks sustained by cadmium rod building blocks. CrystEngComm, 2023, 25, 4175-4181
7246978	CIF	C29 H35.28 N5 O10.14	P 1 21 1	25.238; 4.988; 25.694 90; 116.13; 90	2904	Sori, Lorenzo; Pizzi, Andrea; Bergamaschi, Greta; Gori, Alessandro; Gautieri, Alfonso; Demitri, Nicola; Soncini, Monica; Metrangolo, Pierangelo Computation meets experiment: identification of highly efficient fibrillating peptides CrystEngComm, 2023, 25, 4503-4510
7246979	CIF	C30 H43 F1.5 N5 Na0.5 O13	P 1	9.475; 11.269; 17.688 81.39; 79.74; 78.24	1806.8	Sori, Lorenzo; Pizzi, Andrea; Bergamaschi, Greta; Gori, Alessandro; Gautieri, Alfonso; Demitri, Nicola; Soncini, Monica; Metrangolo, Pierangelo Computation meets experiment: identification of highly efficient fibrillating peptides CrystEngComm, 2023, 25, 4503-4510
7246980	CIF	C36 H51 F3 N7 O16.25	C 1 2 1	31.544; 9.474; 15.431 90; 92.44; 90	4607.3	Sori, Lorenzo; Pizzi, Andrea; Bergamaschi, Greta; Gori, Alessandro; Gautieri, Alfonso; Demitri, Nicola; Soncini, Monica; Metrangolo, Pierangelo Computation meets experiment: identification of highly efficient fibrillating peptides CrystEngComm, 2023, 25, 4503-4510
7246981	CIF	C31 H45 N5 O11	P 1 21 1	9.724; 33.662; 9.966 90; 90.87; 90	3261.8	Sori, Lorenzo; Pizzi, Andrea; Bergamaschi, Greta; Gori, Alessandro; Gautieri, Alfonso; Demitri, Nicola; Soncini, Monica; Metrangolo, Pierangelo Computation meets experiment: identification of highly efficient fibrillating peptides CrystEngComm, 2023, 25, 4503-4510
7246982	CIF	C63 H48 Co N12 O6	P 1 21/n 1	9.5155; 20.4042; 27.4702 90; 97.945; 90	5282.3	Luo, Rong; Xu, Cun-Gang; Yu, Hai-Jun; Wu, Rui-Xue; Lu, Peng; Fan, Yu-Hua; Shao, Feng A novel Co(ii)-based MOF with selective fluorescence as a turn-on sensor for biomarker methylmalonic acid CrystEngComm, 2023, 25, 4120-4125
7246996	CIF	Cs3 I8 O24 Ta	P 3 1 c	8.07743; 8.07743; 23.4262 90; 90; 120	1323.67	Belokoneva, Elena L.; Reutova, Olga V.; Dimitrova, Olga V.; Volkov, Anatoly S.; Stefanovich, Sergey Yu.; Maltsev, Victor V.; Vigasina, Marina F. New layered nonlinear optical iodate Cs3Ta(IO3)8: topology-symmetry analysis and structure prediction CrystEngComm, 2023, 25, 4364-4369
7247001	CIF	C14 H10 N2 S2	P 1 21/n 1	8.7734; 10.412; 14.03 90; 97.502; 90	1270.65	Lima, Priscila S. V.; Weimer, Gustavo H.; Oliveira, Leonardo P.; Souza, Helivaldo D. S.; Fiss, Gabriela F.; Bonacorso, Helio G.; Martins, Marcos A. P. Mesoionic compounds: the role of intermolecular interactions in their crystalline design CrystEngComm, 2023, 25, 4976-4991
7247002	CIF	C11 H10 F N3 O5	P 1 21/c 1	5.455; 14.57; 14.53 90; 96.13; 90	1148	Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar Trimorphic forms of 5-fluorocytosine–gentisic acid with enhanced hydration stability CrystEngComm, 2023, 25, 4199-4212
7247003	CIF	C11 H10 F N3 O5	P 1 21/c 1	3.715; 14.634; 22.239 90; 92.71; 90	1207.7	Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar Trimorphic forms of 5-fluorocytosine–gentisic acid with enhanced hydration stability CrystEngComm, 2023, 25, 4199-4212
7247004	CIF	C11 H10 F N3 O5	P 1 21/n 1	10.3556; 8.6408; 14.1363 90; 110.761; 90	1182.79	Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar Trimorphic forms of 5-fluorocytosine–gentisic acid with enhanced hydration stability CrystEngComm, 2023, 25, 4199-4212
7247005	CIF	C33 H20 Eu N3 O7	P -1	8.934; 11.4151; 13.698 83.066; 81.123; 83.439	1363.6	Arteaga, Ana; Lulich, Alice; Nyman, May; Surbella, Robert G. Designing scintillating coordination polymers using a dual-ligand synthetic approach CrystEngComm, 2023, 25, 4496-4502
7247006	CIF	C66 H48 Eu2 N6 O14	P -1	11.2602; 12.0576; 12.2932 78.341; 78.639; 63.154	1447.73	Arteaga, Ana; Lulich, Alice; Nyman, May; Surbella, Robert G. Designing scintillating coordination polymers using a dual-ligand synthetic approach CrystEngComm, 2023, 25, 4496-4502
7247007	CIF	C39 H24 Eu N3 O8	P 1 21/n 1	9.7558; 18.2307; 18.7616 90; 101.188; 90	3273.43	Arteaga, Ana; Lulich, Alice; Nyman, May; Surbella, Robert G. Designing scintillating coordination polymers using a dual-ligand synthetic approach CrystEngComm, 2023, 25, 4496-4502
7247008	CIF	C30 H32 Au3 N10 Nd O8	C 1 2/c 1	10.9554; 18.3762; 19.9036 90; 100.718; 90	3937.1	Brown, Matthew L.; Karpiuk, Thomas E.; Leznoff, Daniel B. Emissive lanthanide dicyanoaurate coordination polymers with 2,2′-bipyridine dioxide antenna groups and their hydration states CrystEngComm, 2023, 25, 4658-4668
7247009	CIF	C52 H56 Au6 N20 O20 Sm Tb	C 1 2/c 1	7.8419; 19.2528; 23.7526 90; 91.512; 90	3584.9	Brown, Matthew L.; Karpiuk, Thomas E.; Leznoff, Daniel B. Emissive lanthanide dicyanoaurate coordination polymers with 2,2′-bipyridine dioxide antenna groups and their hydration states CrystEngComm, 2023, 25, 4658-4668
7247010	CIF	C26 H28 Au3 N10 O10 Tb	C 1 2/c 1	7.8552; 19.264; 23.773 90; 91.419; 90	3596.3	Brown, Matthew L.; Karpiuk, Thomas E.; Leznoff, Daniel B. Emissive lanthanide dicyanoaurate coordination polymers with 2,2′-bipyridine dioxide antenna groups and their hydration states CrystEngComm, 2023, 25, 4658-4668
7247011	CIF	C30 H32 Au3 Ce N10 O8	C 1 2/c 1	10.854; 18.197; 19.849 90; 99.778; 90	3863.4	Brown, Matthew L.; Karpiuk, Thomas E.; Leznoff, Daniel B. Emissive lanthanide dicyanoaurate coordination polymers with 2,2′-bipyridine dioxide antenna groups and their hydration states CrystEngComm, 2023, 25, 4658-4668
7247012	CIF	C26 H28 Au3 N10 O10 Sm0.41 Tb0.59	C 1 2/c 1	7.8699; 19.2577; 23.7813 90; 91.485; 90	3603	Brown, Matthew L.; Karpiuk, Thomas E.; Leznoff, Daniel B. Emissive lanthanide dicyanoaurate coordination polymers with 2,2′-bipyridine dioxide antenna groups and their hydration states CrystEngComm, 2023, 25, 4658-4668
7247013	CIF	C26 H26 Au3 N10 Nd O9	P -1	7.958; 10.2731; 23.067 89.082; 85.457; 70.612	1773.2	Brown, Matthew L.; Karpiuk, Thomas E.; Leznoff, Daniel B. Emissive lanthanide dicyanoaurate coordination polymers with 2,2′-bipyridine dioxide antenna groups and their hydration states CrystEngComm, 2023, 25, 4658-4668
7247014	CIF	C26 H26 Au3 N10 O9 Sm0.79 Tb0.22	P -1	7.8884; 10.2453; 23.058 89.15; 85.419; 70.588	1751.8	Brown, Matthew L.; Karpiuk, Thomas E.; Leznoff, Daniel B. Emissive lanthanide dicyanoaurate coordination polymers with 2,2′-bipyridine dioxide antenna groups and their hydration states CrystEngComm, 2023, 25, 4658-4668
7247015	CIF	C30 H32 Au3 N10 O8 Sm	C 1 2/c 1	10.9102; 18.2189; 19.7594 90; 100.364; 90	3863.5	Brown, Matthew L.; Karpiuk, Thomas E.; Leznoff, Daniel B. Emissive lanthanide dicyanoaurate coordination polymers with 2,2′-bipyridine dioxide antenna groups and their hydration states CrystEngComm, 2023, 25, 4658-4668
7247016	CIF	C60 H64 Au6 N20 O16 Sm Tb	C 1 2/c 1	10.8731; 18.0339; 19.5988 90; 99.557; 90	3789.7	Brown, Matthew L.; Karpiuk, Thomas E.; Leznoff, Daniel B. Emissive lanthanide dicyanoaurate coordination polymers with 2,2′-bipyridine dioxide antenna groups and their hydration states CrystEngComm, 2023, 25, 4658-4668
7247017	CIF	C30 H32 Au3 Dy N10 O8	C 1 2/c 1	10.8792; 17.9625; 19.5519 90; 99.575; 90	3767.6	Brown, Matthew L.; Karpiuk, Thomas E.; Leznoff, Daniel B. Emissive lanthanide dicyanoaurate coordination polymers with 2,2′-bipyridine dioxide antenna groups and their hydration states CrystEngComm, 2023, 25, 4658-4668
7247018	CIF	C26 H28 Au3 Eu N10 O10	C 1 2/c 1	7.8704; 19.268; 23.801 90; 91.576; 90	3608	Brown, Matthew L.; Karpiuk, Thomas E.; Leznoff, Daniel B. Emissive lanthanide dicyanoaurate coordination polymers with 2,2′-bipyridine dioxide antenna groups and their hydration states CrystEngComm, 2023, 25, 4658-4668
7247019	CIF	C30 H32 Au3 N10 O8 Yb	C 1 2/c 1	10.8939; 17.908; 19.463 90; 99.59; 90	3743.9	Brown, Matthew L.; Karpiuk, Thomas E.; Leznoff, Daniel B. Emissive lanthanide dicyanoaurate coordination polymers with 2,2′-bipyridine dioxide antenna groups and their hydration states CrystEngComm, 2023, 25, 4658-4668
7247020	CIF	C26 H28 Au3 N10 O10 Yb	C 1 2/c 1	7.7711; 19.156; 23.765 90; 91.03; 90	3537.2	Brown, Matthew L.; Karpiuk, Thomas E.; Leznoff, Daniel B. Emissive lanthanide dicyanoaurate coordination polymers with 2,2′-bipyridine dioxide antenna groups and their hydration states CrystEngComm, 2023, 25, 4658-4668
7247021	CIF	C30 H32 Au3 N10 O8 Tb	C 1 2/c 1	10.887; 18.0157; 19.5884 90; 99.626; 90	3787.9	Brown, Matthew L.; Karpiuk, Thomas E.; Leznoff, Daniel B. Emissive lanthanide dicyanoaurate coordination polymers with 2,2′-bipyridine dioxide antenna groups and their hydration states CrystEngComm, 2023, 25, 4658-4668
7247022	CIF	C30 H32 Au3 Eu N10 O8	C 1 2/c 1	10.8683; 18.0285; 19.6168 90; 99.538; 90	3790.6	Brown, Matthew L.; Karpiuk, Thomas E.; Leznoff, Daniel B. Emissive lanthanide dicyanoaurate coordination polymers with 2,2′-bipyridine dioxide antenna groups and their hydration states CrystEngComm, 2023, 25, 4658-4668
7247024	CIF	C28 H23 N5 O	A e a 2	17.7843; 34.8725; 7.54963 90; 90; 90	4682.15	Sun, Xuancheng; Li, Chaoxiong; Meng, Xianggao; Wang, Dunjia; Zheng, Chunyang A highly thermal and pH-stable fluorescence sensor for rapid detection of Hg2+, Fe3+, and tetracycline in aqueous solutions CrystEngComm, 2023, 25, 4531-4538
7247025	CIF	C35 H24 Cd N6 O4	C 1 2/c 1	20.8701; 20.0485; 15.1301 90; 114.052; 90	5781	Sun, Xuancheng; Li, Chaoxiong; Meng, Xianggao; Wang, Dunjia; Zheng, Chunyang A highly thermal and pH-stable fluorescence sensor for rapid detection of Hg2+, Fe3+, and tetracycline in aqueous solutions CrystEngComm, 2023, 25, 4531-4538
7247026	CIF	Cs0.82 Fe1.62 Se2	I 4/m m m	3.9472; 3.9472; 15.2401 90; 90; 90	237.447	Faraonov, Maxim A.; Yudanova, Evgeniya I.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Troyanov, Sergey I.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Synthesis, structure and properties of coordination complexes of tin(ii) phthalocyanine and naphthalocyanine with transition metal fragments CrystEngComm, 2023, 25, 4620-4637
7247027	CIF	C52 H52 Fe N9 O4 Sn	P 1 21/n 1	12.575; 26.24; 14.684 90; 102.485; 90	4730.7	Faraonov, Maxim A.; Yudanova, Evgeniya I.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Troyanov, Sergey I.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Synthesis, structure and properties of coordination complexes of tin(ii) phthalocyanine and naphthalocyanine with transition metal fragments CrystEngComm, 2023, 25, 4620-4637
7247028	CIF	C95 H53 Cl8 Mo N16 O2 Sn2	P 1 21/n 1	16.45; 27.473; 18.743 90; 104.441; 90	8202.9	Faraonov, Maxim A.; Yudanova, Evgeniya I.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Troyanov, Sergey I.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Synthesis, structure and properties of coordination complexes of tin(ii) phthalocyanine and naphthalocyanine with transition metal fragments CrystEngComm, 2023, 25, 4620-4637
7247029	CIF	C70 H72 Cl5 Ir N10 Na O6 Sn	P 1 21 1	12.9659; 18.5545; 14.3959 90; 104.36; 90	3355.1	Faraonov, Maxim A.; Yudanova, Evgeniya I.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Troyanov, Sergey I.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Synthesis, structure and properties of coordination complexes of tin(ii) phthalocyanine and naphthalocyanine with transition metal fragments CrystEngComm, 2023, 25, 4620-4637
7247030	CIF	C46 H25 Cl2 N8 O3 Sn V	P -1	12.1076; 12.5476; 13.9976 99.14; 103.14; 109.704	1884.19	Faraonov, Maxim A.; Yudanova, Evgeniya I.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Troyanov, Sergey I.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Synthesis, structure and properties of coordination complexes of tin(ii) phthalocyanine and naphthalocyanine with transition metal fragments CrystEngComm, 2023, 25, 4620-4637
7247031	CIF	C101.5 H83 Cl5.5 N18 Na O6 Ru Sn2	C 1 2/c 1	36.653; 21.7587; 28.04 90; 120.978; 90	19173	Faraonov, Maxim A.; Yudanova, Evgeniya I.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Troyanov, Sergey I.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Synthesis, structure and properties of coordination complexes of tin(ii) phthalocyanine and naphthalocyanine with transition metal fragments CrystEngComm, 2023, 25, 4620-4637
7247032	CIF	C48 H35 Cl2 I2 Ir N8 Sn	P 1 21/n 1	14.8478; 12.6529; 23.7022 90; 91.224; 90	4451.86	Faraonov, Maxim A.; Yudanova, Evgeniya I.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Troyanov, Sergey I.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Synthesis, structure and properties of coordination complexes of tin(ii) phthalocyanine and naphthalocyanine with transition metal fragments CrystEngComm, 2023, 25, 4620-4637
7247033	CIF	C42 H31 Cl2 Ir N8 Sn	P 1 21/c 1	12.8043; 11.4261; 25.2186 90; 103.808; 90	3582.9	Faraonov, Maxim A.; Yudanova, Evgeniya I.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Troyanov, Sergey I.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Synthesis, structure and properties of coordination complexes of tin(ii) phthalocyanine and naphthalocyanine with transition metal fragments CrystEngComm, 2023, 25, 4620-4637
7247034	CIF	C45 H25 Cl3 Mo N8 O2 Sn	P -1	12.197; 12.7088; 13.9744 99.379; 104.646; 109.904	1895.3	Faraonov, Maxim A.; Yudanova, Evgeniya I.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Troyanov, Sergey I.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Synthesis, structure and properties of coordination complexes of tin(ii) phthalocyanine and naphthalocyanine with transition metal fragments CrystEngComm, 2023, 25, 4620-4637
7247035	CIF	C74 H69 Cl4 Co I2 Ir N8 Sn	P 1 21/c 1	22.3297; 12.2594; 26.799 90; 110.193; 90	6885.3	Faraonov, Maxim A.; Yudanova, Evgeniya I.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Troyanov, Sergey I.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Synthesis, structure and properties of coordination complexes of tin(ii) phthalocyanine and naphthalocyanine with transition metal fragments CrystEngComm, 2023, 25, 4620-4637
7247036	CIF	C91 H62 Cl4 Cr Ir4 N8 O11 Sn	P -1	16.1813; 14.7119; 37.959 109.856; 98.694; 95.271	8301.3	Faraonov, Maxim A.; Yudanova, Evgeniya I.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Troyanov, Sergey I.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Synthesis, structure and properties of coordination complexes of tin(ii) phthalocyanine and naphthalocyanine with transition metal fragments CrystEngComm, 2023, 25, 4620-4637
7247037	CIF	C69 H50 Cl2 Cr Ir4 N8 O11 Sn	P 1 21/n 1	16.9638; 19.8243; 19.9815 90; 96.196; 90	6680.43	Faraonov, Maxim A.; Yudanova, Evgeniya I.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Troyanov, Sergey I.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Synthesis, structure and properties of coordination complexes of tin(ii) phthalocyanine and naphthalocyanine with transition metal fragments CrystEngComm, 2023, 25, 4620-4637
7247038	CIF	C132 H120 Cl8 Fe2 K2 N20 O20 Sn2	P c a 21	22.7101; 14.5414; 39.6766 90; 90; 90	13102.7	Faraonov, Maxim A.; Yudanova, Evgeniya I.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Troyanov, Sergey I.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Synthesis, structure and properties of coordination complexes of tin(ii) phthalocyanine and naphthalocyanine with transition metal fragments CrystEngComm, 2023, 25, 4620-4637
7247046	CIF	C20 H24 Co N10 O4 S2	P -1	7.703; 9.477; 10.206 112.963; 102.917; 95.919	653.4	Wang, Sen; Xie, Fengxia; Zhang, Shiwen; Liang, Xiaoqiang; Gao, Qianhang; Chen, Yu; Zhang, Feng; Wen, Chen; Feng, Lei; Wan, Chengan Water-assisted proton conduction regulated by hydrophilic groups in metallo-hydrogen-bonded organic frameworks: “like-attracts-like” between hydrophilic groups and water molecules CrystEngComm, 2023, 25, 4701-4715
7247047	CIF	C38 H32 Co N18 S2	P -1	7.8166; 11.069; 11.929 72.386; 78.707; 80.019	957.5	Wang, Sen; Xie, Fengxia; Zhang, Shiwen; Liang, Xiaoqiang; Gao, Qianhang; Chen, Yu; Zhang, Feng; Wen, Chen; Feng, Lei; Wan, Chengan Water-assisted proton conduction regulated by hydrophilic groups in metallo-hydrogen-bonded organic frameworks: “like-attracts-like” between hydrophilic groups and water molecules CrystEngComm, 2023, 25, 4701-4715
7247048	CIF	C25 H23 N3 O3	P -1	8.5226; 10.0347; 12.5476 77.009; 81.678; 86.51	1034.17	Gogoi, Gayatri; Sarma, Rupam J. Effect of twisted molecular geometry on the solid-state emissions of an anthracene fluorophore CrystEngComm, 2023, 25, 4582-4591
7247049	CIF	C22 H18 N2 O3	P b c a	12.5066; 14.8096; 18.3306 90; 90; 90	3395.2	Gogoi, Gayatri; Sarma, Rupam J. Effect of twisted molecular geometry on the solid-state emissions of an anthracene fluorophore CrystEngComm, 2023, 25, 4582-4591
7247050	CIF	C44 H32 N4 O4	P -1	11.3394; 11.345; 14.9825 77.424; 86.116; 67.045	1731.9	Gogoi, Gayatri; Sarma, Rupam J. Effect of twisted molecular geometry on the solid-state emissions of an anthracene fluorophore CrystEngComm, 2023, 25, 4582-4591
7247051	CIF	C14 H15 F3 N2 O3 S	P -1	7.9976; 8.4028; 12.3149 75.304; 71.879; 81.037	758.14	Lohar, Vishal A.; Menon, Anila M.; Suresh, Ajay; Chopra, Deepak Role of mechanochemical synthesis in the crystal chemistry of leflunomide CrystEngComm, 2023, 25, 4779-4792
7247052	CIF	C16 H19 F3 N4 O2	P b c a	10.8564; 7.7062; 38.699 90; 90; 90	3237.6	Lohar, Vishal A.; Menon, Anila M.; Suresh, Ajay; Chopra, Deepak Role of mechanochemical synthesis in the crystal chemistry of leflunomide CrystEngComm, 2023, 25, 4779-4792
7247053	CIF	C4 H6 N4 O4	P 1 21/c 1	14.6222; 5.5787; 14.6298 90; 144.34; 90	695.7	Gaur, Ruchi Polymorphism in parabanic acid-urea cocrystals governed by supramolecular synthons: a comparative analysis CrystEngComm, 2023, 25, 4680-4689
7247054	CIF	C4 H6 N4 O4	P 1 21/c 1	6.78; 10.046; 10.579 90; 104.986; 90	696	Gaur, Ruchi Polymorphism in parabanic acid-urea cocrystals governed by supramolecular synthons: a comparative analysis CrystEngComm, 2023, 25, 4680-4689
7247055	CIF	C19 H22 F N3 O8	P -1	7.2373; 11.5245; 12.2725 70.605; 84.799; 76.466	938.61	Rapeenun, Peerapon; Nalaoh, Phattananawee; Promarak, Vinich; Flood, Adrian E. Improving aqueous solubility of ciprofloxacin: three different stoichiometric hydrated salt forms with oxalic acid CrystEngComm, 2023, 25, 4461-4469
7247056	CIF	C20 H23 F N3 O10	P -1	7.1349; 11.9568; 12.32 77.766; 89.132; 82.126	1017.4	Rapeenun, Peerapon; Nalaoh, Phattananawee; Promarak, Vinich; Flood, Adrian E. Improving aqueous solubility of ciprofloxacin: three different stoichiometric hydrated salt forms with oxalic acid CrystEngComm, 2023, 25, 4461-4469
7247057	CIF	C108 H118 F6 N18 O32	P -1	13.7549; 13.9237; 30.361 90.753; 93.648; 94.741	5782.1	Rapeenun, Peerapon; Nalaoh, Phattananawee; Promarak, Vinich; Flood, Adrian E. Improving aqueous solubility of ciprofloxacin: three different stoichiometric hydrated salt forms with oxalic acid CrystEngComm, 2023, 25, 4461-4469
7247058	CIF	C54 H54 F12 N6 O4	C 1 2/c 1	19.785; 18.079; 16.343 90; 115.629; 90	5270.6	Saied, Rajaa; Alves, Paula C.; Rijo, Patrícia; André, Vânia; Alves, Luis G. Novel cyclam multicomponent crystal forms: synthesis, characterization and antimicrobial activity CrystEngComm, 2023, 25, 5787-5795
7247059	CIF	C76 H96 N8 O12	P -1	10.8811; 11.1873; 16.516 70.972; 71.325; 85.357	1800	Saied, Rajaa; Alves, Paula C.; Rijo, Patrícia; André, Vânia; Alves, Luis G. Novel cyclam multicomponent crystal forms: synthesis, characterization and antimicrobial activity CrystEngComm, 2023, 25, 5787-5795
7247060	CIF	C52 H56 F6 N6 O4	P 1 21/n 1	15.7903; 16.4942; 19.737 90; 110.881; 90	4802.9	Saied, Rajaa; Alves, Paula C.; Rijo, Patrícia; André, Vânia; Alves, Luis G. Novel cyclam multicomponent crystal forms: synthesis, characterization and antimicrobial activity CrystEngComm, 2023, 25, 5787-5795
7247061	CIF	C40 H46 F6 N4 O6	P 1 21/n 1	10.352; 18.345; 20.704 90; 93.095; 90	3926.1	Saied, Rajaa; Alves, Paula C.; Rijo, Patrícia; André, Vânia; Alves, Luis G. Novel cyclam multicomponent crystal forms: synthesis, characterization and antimicrobial activity CrystEngComm, 2023, 25, 5787-5795
7247070	CIF	C24 H26 Br2 Cl2 Co2 N4 O2	P 1 21/c 1	9.8457; 10.6763; 14.355 90; 115.832; 90	1358.2	Luo, Tong-Kai; Zhong, Xiang; Zhang, Qing-Yun; Chen, Xiao-Feng; Xu, Hui; Peng, Yan; Liu, Sui-Jun; Hu, Zhao-Bo; Wen, He-Rui Effect of remote substituents and coordination anions on the magnetic properties of Co(ii) dimer complexes CrystEngComm, 2023, 25, 4873-4878
7247071	CIF	C28 H36 Cl2 Co2 N6 O2	P -1	7.3125; 9.9783; 11.6624 71.043; 80.28; 77.336	780.82	Luo, Tong-Kai; Zhong, Xiang; Zhang, Qing-Yun; Chen, Xiao-Feng; Xu, Hui; Peng, Yan; Liu, Sui-Jun; Hu, Zhao-Bo; Wen, He-Rui Effect of remote substituents and coordination anions on the magnetic properties of Co(ii) dimer complexes CrystEngComm, 2023, 25, 4873-4878
7247072	CIF	C68 H84 Br4 Co4 N8 O12	P 1 21/c 1	18.0168; 22.4384; 9.4282 90; 96.955; 90	3783.5	Luo, Tong-Kai; Zhong, Xiang; Zhang, Qing-Yun; Chen, Xiao-Feng; Xu, Hui; Peng, Yan; Liu, Sui-Jun; Hu, Zhao-Bo; Wen, He-Rui Effect of remote substituents and coordination anions on the magnetic properties of Co(ii) dimer complexes CrystEngComm, 2023, 25, 4873-4878
7247073	CIF	C38 H50 Co2 N6 O6	P -1	9.9504; 10.6442; 11.3733 96.093; 114.41; 108.736	998.14	Luo, Tong-Kai; Zhong, Xiang; Zhang, Qing-Yun; Chen, Xiao-Feng; Xu, Hui; Peng, Yan; Liu, Sui-Jun; Hu, Zhao-Bo; Wen, He-Rui Effect of remote substituents and coordination anions on the magnetic properties of Co(ii) dimer complexes CrystEngComm, 2023, 25, 4873-4878
7247089	CIF	C120 H120 Au4 Cl6 N8 O8	P -1	14.928; 18.059; 20.972 84.908; 76.202; 78.679	5379	Bardina, Elena E.; Makotchenko, Eugeniya V.; Birin, Kirill P.; Baidina, Iraida A.; Sukhikh, Taisiya S.; Novikov, Alexander S.; Gorbunova, Yulia G.; Tsivadze, Aslan Yu.; Gushchin, Artem L. Noncovalent interactions in gold(iii) tetrakis(4-butoxyphenyl)porphyrinate structures CrystEngComm, 2023, 25, 4755-4767
7247090	CIF	C60 H60 Au2 Cl4 N4 O4	P -1	16.7951; 17.6474; 19.8427 77.941; 82.828; 75.258	5546.1	Bardina, Elena E.; Makotchenko, Eugeniya V.; Birin, Kirill P.; Baidina, Iraida A.; Sukhikh, Taisiya S.; Novikov, Alexander S.; Gorbunova, Yulia G.; Tsivadze, Aslan Yu.; Gushchin, Artem L. Noncovalent interactions in gold(iii) tetrakis(4-butoxyphenyl)porphyrinate structures CrystEngComm, 2023, 25, 4755-4767
7247091	CIF	C124 H128 Au4 Cl6 N8 O12	P -1	14.437; 18.6296; 22.2485 82.428; 79.383; 77.623	5718.1	Bardina, Elena E.; Makotchenko, Eugeniya V.; Birin, Kirill P.; Baidina, Iraida A.; Sukhikh, Taisiya S.; Novikov, Alexander S.; Gorbunova, Yulia G.; Tsivadze, Aslan Yu.; Gushchin, Artem L. Noncovalent interactions in gold(iii) tetrakis(4-butoxyphenyl)porphyrinate structures CrystEngComm, 2023, 25, 4755-4767
7247096	CIF	C7 H6 N8 O6	P 21 21 21	5.2481; 14.898; 15.184 90; 90; 90	1187.2	Su, Dongshuai; Cai, Jinxiong; Yin, Ping; Pang, Siping Regioisomeric N–C functionalization of an asymmetric N-rich framework: a promising pathway to heat-resistant energetic materials CrystEngComm, 2023, 25, 4902-4906
7247097	CIF	C7 H6 N8 O6	P 1 21/c 1	8.638; 17.1; 8.705 90; 111.112; 90	1200	Su, Dongshuai; Cai, Jinxiong; Yin, Ping; Pang, Siping Regioisomeric N–C functionalization of an asymmetric N-rich framework: a promising pathway to heat-resistant energetic materials CrystEngComm, 2023, 25, 4902-4906
7247104	CIF	C40 H39 N2 O18.5	P -1	8.2694; 8.7155; 26.765 87.121; 85.505; 80.356	1894.5	Pan, Jia-Qi; Chen, Yun-Rui; Jia, Meng-Ze; Yao, Xin-Rong; Miao, Xiao-Li; Zhang, Jie The cooperation of charge transfer and electron transfer for manipulating photothermal behaviour of donor–acceptor co-crystals CrystEngComm, 2023, 25, 4968-4975
7247105	CIF	C28 H24 N2 O9	P 21 21 21	4.7835; 43.651; 11.3771 90; 90; 90	2375.6	Pan, Jia-Qi; Chen, Yun-Rui; Jia, Meng-Ze; Yao, Xin-Rong; Miao, Xiao-Li; Zhang, Jie The cooperation of charge transfer and electron transfer for manipulating photothermal behaviour of donor–acceptor co-crystals CrystEngComm, 2023, 25, 4968-4975
7247106	CIF	Al O7 P2	P 63 m c	5.1806; 5.1806; 12.8377 90; 90; 120	298.39	Hao, Yucheng; Zhang, Yang; Zhang, Yuying; Fu, Zixiang; Heng, Chunyang; Li, Junjie; You, Jiatian; Hu, Kunhong; Lin, Yuan; Li, Haijian A series of novel phosphites/phosphates with deep-ultraviolet cut-off edges from 0D polar to 3D non-polar architectures CrystEngComm, 2023, 25, 4864-4872
7247107	CIF	Al O5 P	P -1	6.8925; 7.1249; 8.6411 89.34; 67.136; 87.675	390.68	Hao, Yucheng; Zhang, Yang; Zhang, Yuying; Fu, Zixiang; Heng, Chunyang; Li, Junjie; You, Jiatian; Hu, Kunhong; Lin, Yuan; Li, Haijian A series of novel phosphites/phosphates with deep-ultraviolet cut-off edges from 0D polar to 3D non-polar architectures CrystEngComm, 2023, 25, 4864-4872
7247108	CIF	Al3 O19.5 P6	P 63/m	7.9101; 7.9101; 7.1057 90; 90; 120	385.04	Hao, Yucheng; Zhang, Yang; Zhang, Yuying; Fu, Zixiang; Heng, Chunyang; Li, Junjie; You, Jiatian; Hu, Kunhong; Lin, Yuan; Li, Haijian A series of novel phosphites/phosphates with deep-ultraviolet cut-off edges from 0D polar to 3D non-polar architectures CrystEngComm, 2023, 25, 4864-4872
7247109	CIF	Ca O3 P	P 43 21 2	6.692; 6.692; 13.0305 90; 90; 90	583.54	Hao, Yucheng; Zhang, Yang; Zhang, Yuying; Fu, Zixiang; Heng, Chunyang; Li, Junjie; You, Jiatian; Hu, Kunhong; Lin, Yuan; Li, Haijian A series of novel phosphites/phosphates with deep-ultraviolet cut-off edges from 0D polar to 3D non-polar architectures CrystEngComm, 2023, 25, 4864-4872
7247110	CIF	C17 H11 N S3	P 1 21/c 1	16.0602; 7.6455; 11.9152 90; 94.692; 90	1458.1	Nishimoto, Hiroshi; Kawase, Takeshi; Nishida, Jun-ichi Synthesis, crystal structures and semiconductor properties of 2-(thiopyran-4-ylidene)-1,3-benzodithioles with an aryl substituent CrystEngComm, 2023, 25, 4856-4863
7247111	CIF	C17 H11 N S3	P 21 21 21	6.1579; 7.5864; 31.1475 90; 90; 90	1455.1	Nishimoto, Hiroshi; Kawase, Takeshi; Nishida, Jun-ichi Synthesis, crystal structures and semiconductor properties of 2-(thiopyran-4-ylidene)-1,3-benzodithioles with an aryl substituent CrystEngComm, 2023, 25, 4856-4863
7247113	CIF	C16 H26 N2 O4	P -1	5.6474; 7.3558; 10.9693 108.023; 94.575; 99.275	423.55	Li, Chang; Wu, Di; Gao, Zhenguo; Chen, Wei Molecular simulation studies on the design of multicomponent sorbic acid crystals for tuning solubility CrystEngComm, 2023, 25, 4889-4901
7247114	CIF	C12 H14 N2 O3	P -1	4.0241; 7.3014; 20.0901 97.098; 92.087; 90.663	585.29	Li, Chang; Wu, Di; Gao, Zhenguo; Chen, Wei Molecular simulation studies on the design of multicomponent sorbic acid crystals for tuning solubility CrystEngComm, 2023, 25, 4889-4901
7247115	CIF	C11 H17 N3 O3	P 1 21/n 1	8.8238; 11.919; 11.9562 90; 95.671; 90	1251.29	Li, Chang; Wu, Di; Gao, Zhenguo; Chen, Wei Molecular simulation studies on the design of multicomponent sorbic acid crystals for tuning solubility CrystEngComm, 2023, 25, 4889-4901
7247116	CIF	C74 H78 Cl6 Fe4 N O60	C 1 2 1	27.4286; 17.9342; 15.0384 90; 133.511; 90	5365	Matsumoto, Daiki; Tanaka, Chiaki; Fujibayashi, Masaru; Nishihara, Sadafumi; Takahashi, Kiyonori; Nakamura, Takayoshi; Akutagawa, Tomoyuki; Masuya-Suzuki, Atsuko; Tsunashima, Ryo Crystallographic and dielectric studies of tetrahedral {NH4@Fe4} crystallized with halomethane molecules CrystEngComm, 2023, 25, 4793-4797
7247117	CIF	C74 H80 Cl4 Fe4 N O60	C 1 2 1	27.2657; 17.98779; 15.0294 90; 133.512; 90	5345.8	Matsumoto, Daiki; Tanaka, Chiaki; Fujibayashi, Masaru; Nishihara, Sadafumi; Takahashi, Kiyonori; Nakamura, Takayoshi; Akutagawa, Tomoyuki; Masuya-Suzuki, Atsuko; Tsunashima, Ryo Crystallographic and dielectric studies of tetrahedral {NH4@Fe4} crystallized with halomethane molecules CrystEngComm, 2023, 25, 4793-4797
7247118	CIF	C74 H80 Br4 Fe4 N O60	C 1 2 1	27.2902; 17.9198; 15.0346 90; 133.441; 90	5338.5	Matsumoto, Daiki; Tanaka, Chiaki; Fujibayashi, Masaru; Nishihara, Sadafumi; Takahashi, Kiyonori; Nakamura, Takayoshi; Akutagawa, Tomoyuki; Masuya-Suzuki, Atsuko; Tsunashima, Ryo Crystallographic and dielectric studies of tetrahedral {NH4@Fe4} crystallized with halomethane molecules CrystEngComm, 2023, 25, 4793-4797
7247119	CIF	C74 H78 Br6 Fe4 N O60	C 1 2 1	27.5848; 17.97775; 15.1052 90; 133.527; 90	5431.2	Matsumoto, Daiki; Tanaka, Chiaki; Fujibayashi, Masaru; Nishihara, Sadafumi; Takahashi, Kiyonori; Nakamura, Takayoshi; Akutagawa, Tomoyuki; Masuya-Suzuki, Atsuko; Tsunashima, Ryo Crystallographic and dielectric studies of tetrahedral {NH4@Fe4} crystallized with halomethane molecules CrystEngComm, 2023, 25, 4793-4797
7247122	CIF	C10 H22 K N5 O14 P2	P 21 21 21	6.452; 11.032; 28.638 90; 90; 90	2038.4	Kaszubowski, Oskar; Ślepokura, Katarzyna Structural aspects of dehydration and rehydration in the adenosine 5′-diphosphate (ADP)–potassium–water system CrystEngComm, 2023, 25, 4592-4603
7247123	CIF	C20 H41.5 K N10 O26.25 P4	P 21 21 2	26.352; 10.99; 6.7232 90; 90; 90	1947.1	Kaszubowski, Oskar; Ślepokura, Katarzyna Structural aspects of dehydration and rehydration in the adenosine 5′-diphosphate (ADP)–potassium–water system CrystEngComm, 2023, 25, 4592-4603
7247124	CIF	C10 H14 K N5 O10 P2	P 21 21 21	26.388; 10.285; 6.2377 90; 90; 90	1692.9	Kaszubowski, Oskar; Ślepokura, Katarzyna Structural aspects of dehydration and rehydration in the adenosine 5′-diphosphate (ADP)–potassium–water system CrystEngComm, 2023, 25, 4592-4603
7247125	CIF	C20 H41.5 K N10 O26.25 P4	P 21 21 21	25.939; 11.003; 13.505 90; 90; 90	3854.4	Kaszubowski, Oskar; Ślepokura, Katarzyna Structural aspects of dehydration and rehydration in the adenosine 5′-diphosphate (ADP)–potassium–water system CrystEngComm, 2023, 25, 4592-4603
7247126	CIF	C10 H18 K N5 O12 P2	P 21 21 2	28.31; 10.412; 6.2855 90; 90; 90	1852.7	Kaszubowski, Oskar; Ślepokura, Katarzyna Structural aspects of dehydration and rehydration in the adenosine 5′-diphosphate (ADP)–potassium–water system CrystEngComm, 2023, 25, 4592-4603
7247127	CIF	C20 H19 N3 O7	P 1 21/c 1	10.645; 21.957; 8.674 90; 91.131; 90	2027	Saraiva Costa, Wendell; Santiago de Oliveira, Yara; Ayala, Alejandro Pedro Polymorphism in cocrystals of metronidazole benzoate CrystEngComm, 2023, 25, 4716-4728
7247128	CIF	C15 H15 N3 O6	P b c a	7.2928; 17.0257; 25.6078 90; 90; 90	3179.6	Saraiva Costa, Wendell; Santiago de Oliveira, Yara; Ayala, Alejandro Pedro Polymorphism in cocrystals of metronidazole benzoate CrystEngComm, 2023, 25, 4716-4728
7247154	CIF	C15 H13 N O5	P -1	7.4176; 7.5344; 13.4049 94.585; 101.837; 115.88	647.36	Ejarque, Daniel; Calvet, Teresa; Font-Bardia, Mercè; Pons, Josefina Virtual assessment achieved two binary cocrystals based on a liquid and a solid pyridine derivative with modulated thermal stabilities CrystEngComm, 2023, 25, 4798-4811
7247155	CIF	C16 H16 N2 O4	P 1 21/c 1	17.3245; 4.8311; 18.3867 90; 107.778; 90	1465.41	Ejarque, Daniel; Calvet, Teresa; Font-Bardia, Mercè; Pons, Josefina Virtual assessment achieved two binary cocrystals based on a liquid and a solid pyridine derivative with modulated thermal stabilities CrystEngComm, 2023, 25, 4798-4811
7247156	CIF	Eu0.7 K5 Mo4 O16 Yb0.3	C 1 2/m 1	10.40289; 6.00012; 7.72969 90; 117.197; 90	429.134	Posokhova, Svetlana M.; Morozov, Vladimir A.; Zonov, Egor M.; Deyneko, Dina V.; Spassky, Dmitry A.; Fedyunin, Fedor D.; Belik, Alexei A.; Pavlova, Erzhena T.; Vasin, Andrey A.; Lazoryak, Bogdan I. K5Yb1−xEux(MoO4)4 phosphors: aperiodic structures and luminescence properties CrystEngComm, 2023, 25, 4822-4833
7247163	CIF	C58 H24 F10 I4 N4 O4 Sn	P -1	8.1405; 12.0603; 14.974 70.718; 85.026; 83.285	1376.3	Siddiqui, Rafia; Rani, Jyoti; Akshita,; Dhamija, Swati; Shivam, Kumar; Kagra, Deepika; Sharma, Purshotam; Venugopalan, P.; Patra, Ranjan Homo- and hetero-halogen interaction based molecular associations in wheel–axle topology derived Sn(iv) porphyrin complexes: an experimental and theoretical analysis CrystEngComm, 2023, 25, 4946-4959
7247164	CIF	C64 H44 F2 I4 N4 O4 Sn	P 1 21/c 1	14.2789; 16.8821; 12.1517 90; 96.37; 90	2911.18	Siddiqui, Rafia; Rani, Jyoti; Akshita,; Dhamija, Swati; Shivam, Kumar; Kagra, Deepika; Sharma, Purshotam; Venugopalan, P.; Patra, Ranjan Homo- and hetero-halogen interaction based molecular associations in wheel–axle topology derived Sn(iv) porphyrin complexes: an experimental and theoretical analysis CrystEngComm, 2023, 25, 4946-4959
7247165	CIF	C64 H40 F6 I4 N4 O4 Sn	C 1 2/c 1	21.2268; 15.2917; 18.6929 90; 94.748; 90	6046.8	Siddiqui, Rafia; Rani, Jyoti; Akshita,; Dhamija, Swati; Shivam, Kumar; Kagra, Deepika; Sharma, Purshotam; Venugopalan, P.; Patra, Ranjan Homo- and hetero-halogen interaction based molecular associations in wheel–axle topology derived Sn(iv) porphyrin complexes: an experimental and theoretical analysis CrystEngComm, 2023, 25, 4946-4959
7247166	CIF	C59 H31 Cl3 F4 I4 N4 O4 Sn	P 1 21/c 1	12.5134; 39.2235; 12.3836 90; 103.376; 90	5913.2	Siddiqui, Rafia; Rani, Jyoti; Akshita,; Dhamija, Swati; Shivam, Kumar; Kagra, Deepika; Sharma, Purshotam; Venugopalan, P.; Patra, Ranjan Homo- and hetero-halogen interaction based molecular associations in wheel–axle topology derived Sn(iv) porphyrin complexes: an experimental and theoretical analysis CrystEngComm, 2023, 25, 4946-4959
7247167	CIF	C65 H43 Cl3 F4 I4 N4 O4 Sn	P 1 21/c 1	12.5356; 40.7661; 12.4757 90; 102.912; 90	6214.2	Siddiqui, Rafia; Rani, Jyoti; Akshita,; Dhamija, Swati; Shivam, Kumar; Kagra, Deepika; Sharma, Purshotam; Venugopalan, P.; Patra, Ranjan Homo- and hetero-halogen interaction based molecular associations in wheel–axle topology derived Sn(iv) porphyrin complexes: an experimental and theoretical analysis CrystEngComm, 2023, 25, 4946-4959
7247168	CIF	C70 H50 F8 I4 N4 O4 Sn	C 1 c 1	15.5029; 19.537; 22.8054 90; 102.773; 90	6736.4	Siddiqui, Rafia; Rani, Jyoti; Akshita,; Dhamija, Swati; Shivam, Kumar; Kagra, Deepika; Sharma, Purshotam; Venugopalan, P.; Patra, Ranjan Homo- and hetero-halogen interaction based molecular associations in wheel–axle topology derived Sn(iv) porphyrin complexes: an experimental and theoretical analysis CrystEngComm, 2023, 25, 4946-4959
7247169	CIF	C58 H26 F8 I4 N4 O4 Sn	P 1 21/c 1	10.6659; 24.8734; 30.8319 90; 92.536; 90	8171.61	Siddiqui, Rafia; Rani, Jyoti; Akshita,; Dhamija, Swati; Shivam, Kumar; Kagra, Deepika; Sharma, Purshotam; Venugopalan, P.; Patra, Ranjan Homo- and hetero-halogen interaction based molecular associations in wheel–axle topology derived Sn(iv) porphyrin complexes: an experimental and theoretical analysis CrystEngComm, 2023, 25, 4946-4959
7247170	CIF	C26 H22 N20 O2 Pb3	P -1	11.1507; 11.742; 14.0683 73.932; 85.67; 84.591	1759.79	Mahmoudi, Ghodrat; Zangrando, Ennio; Gurbanov, Atash V.; Eftekhari-Sis, Bagher; Mitoraj, Mariusz P.; Sagan, Filip; Safin, Damir A. Tetrel bonding stabilization of a new coordination polymer constructed from lead(ii) azide and 1-(pyridin-2-yl)ethylidenepicolinohydrazide CrystEngComm, 2023, 25, 5100-5108
7247177	CIF	C14 H28 Co Li N8 O14	C 1 2 1	17.0535; 10.0663; 6.9926 90; 91.543; 90	1199.95	Yue, Zhi-Yuan; Liao, Rong-Meng; Luo, Wang; Wang, Na; Miao, Le-Ping; Ye, Heng-Yun; Shi, Chao A room-temperature nitrite-based hybrid bimetal molecular ferroelectric material: [(R)-3-quinuclidinol]2[LiCo(NO2)6] CrystEngComm, 2023, 25, 5085-5091
7247178	CIF	C14 H28 Co Li N8 O14	P 3 2 1	9.9786; 9.9786; 7.0265 90; 90; 120	605.91	Yue, Zhi-Yuan; Liao, Rong-Meng; Luo, Wang; Wang, Na; Miao, Le-Ping; Ye, Heng-Yun; Shi, Chao A room-temperature nitrite-based hybrid bimetal molecular ferroelectric material: [(R)-3-quinuclidinol]2[LiCo(NO2)6] CrystEngComm, 2023, 25, 5085-5091
7247179	CIF	C16 H14 Cl2 N2	P 1 21/n 1	5.3766; 8.7055; 15.6819 90; 99.722; 90	723.47	Bhoday, Harmeet; Yang, Kaidi; Kelley, Steven P.; Glaser, Rainer Crystal environment induced symmetry reduction (CEISR): deep analysis of para-chloroacetophenone azine and generalization CrystEngComm, 2023, 25, 4638-4657
7247180	CIF	C16 H14 Br2 N2	P 1 21/n 1	5.5678; 8.7473; 15.6491 90; 98.8027; 90	753.18	Bhoday, Harmeet; Yang, Kaidi; Kelley, Steven P.; Glaser, Rainer Crystal environment induced symmetry reduction (CEISR): deep analysis of para-chloroacetophenone azine and generalization CrystEngComm, 2023, 25, 4638-4657
7247181	CIF	C16 H14 Cl2 N2	P 1 21/c 1	15.0686; 9.1426; 10.3068 90; 93.7551; 90	1416.88	Bhoday, Harmeet; Yang, Kaidi; Kelley, Steven P.; Glaser, Rainer Crystal environment induced symmetry reduction (CEISR): deep analysis of para-chloroacetophenone azine and generalization CrystEngComm, 2023, 25, 4638-4657
7247182	CIF	C16 H14 Br2 N2	P b c a	9.3239; 10.3551; 30.346 90; 90; 90	2929.9	Bhoday, Harmeet; Yang, Kaidi; Kelley, Steven P.; Glaser, Rainer Crystal environment induced symmetry reduction (CEISR): deep analysis of para-chloroacetophenone azine and generalization CrystEngComm, 2023, 25, 4638-4657
7247185	CIF	C51 H108 N3 Na O15 S3	P -1	5.3204; 13.5037; 43.718 82.294; 89.769; 89.83	3112.5	Arul Prakash, Sukanya; Chinapaka, Ravindar; John, Martin Luther; Dey, Somnath; Kamlekar, Ravi Kanth Crystal structure, molecular packing, and intermolecular interactions of N-pentadecanoyltaurine and N-acyltaurine's interaction with cholesterol CrystEngComm, 2023, 25, 5286-5295
7247186	CIF	C116.5 H93.63 Cd4.67 N14.83 O28.5	P 1 21/n 1	14.02999; 43.3663; 33.7009 90; 94.381; 90	20444.7	Habib, Faiza; Tocher, Derek A.; Carmalt, Claire J. Encapsulation of N-containing compounds in a new hydrophilic Cd-based crystalline sponge via coordinative alignment method CrystEngComm, 2023, 25, 5001-5011
7247187	CIF	C142.2 H117.2 Cd6.8 N19.5 O48	P 1 21/n 1	13.6817; 43.2808; 33.7646 90; 95.3182; 90	19907.8	Habib, Faiza; Tocher, Derek A.; Carmalt, Claire J. Encapsulation of N-containing compounds in a new hydrophilic Cd-based crystalline sponge via coordinative alignment method CrystEngComm, 2023, 25, 5001-5011
7247188	CIF	C173.5 H146.25 Cd7 N19.25 O46	P 1 21/n 1	14.1427; 43.199; 33.7991 90; 94.7053; 90	20580	Habib, Faiza; Tocher, Derek A.; Carmalt, Claire J. Encapsulation of N-containing compounds in a new hydrophilic Cd-based crystalline sponge via coordinative alignment method CrystEngComm, 2023, 25, 5001-5011
7247189	CIF	C117.39 H103.38 Cd5.6 N14.2 O39.66	P 1 21/n 1	13.9475; 43.3134; 33.5321 90; 94.4569; 90	20195.9	Habib, Faiza; Tocher, Derek A.; Carmalt, Claire J. Encapsulation of N-containing compounds in a new hydrophilic Cd-based crystalline sponge via coordinative alignment method CrystEngComm, 2023, 25, 5001-5011
7247190	CIF	C115.44 H96.4 Cd5.6 N14.68 O39.2	P 1 21/n 1	14.68693; 42.8432; 33.8507 90; 93.1111; 90	21268.7	Habib, Faiza; Tocher, Derek A.; Carmalt, Claire J. Encapsulation of N-containing compounds in a new hydrophilic Cd-based crystalline sponge via coordinative alignment method CrystEngComm, 2023, 25, 5001-5011
7247191	CIF	C94.83 H81.86 Cd4 N10.57 O28.17	P 1 21/n 1	14.615; 43.0674; 33.6023 90; 93.676; 90	21106.8	Habib, Faiza; Tocher, Derek A.; Carmalt, Claire J. Encapsulation of N-containing compounds in a new hydrophilic Cd-based crystalline sponge via coordinative alignment method CrystEngComm, 2023, 25, 5001-5011
7247192	CIF	C123 H108.67 Cd4.67 N15 O27.67	P 1 21/n 1	14.75582; 42.951; 33.8388 90; 93.4415; 90	21407.6	Habib, Faiza; Tocher, Derek A.; Carmalt, Claire J. Encapsulation of N-containing compounds in a new hydrophilic Cd-based crystalline sponge via coordinative alignment method CrystEngComm, 2023, 25, 5001-5011
7247193	CIF	C147.75 H0.25 Cd7 N20.75 O51.75	P 1 21/n 1	14.6954; 42.2913; 33.8929 90; 91.649; 90	21055.3	Habib, Faiza; Tocher, Derek A.; Carmalt, Claire J. Encapsulation of N-containing compounds in a new hydrophilic Cd-based crystalline sponge via coordinative alignment method CrystEngComm, 2023, 25, 5001-5011
7247194	CIF	C106.46 H110.99 Cd4.67 N14.5 O36	P 1 21/n 1	14.5221; 42.7754; 33.9548 90; 93.429; 90	21054.6	Habib, Faiza; Tocher, Derek A.; Carmalt, Claire J. Encapsulation of N-containing compounds in a new hydrophilic Cd-based crystalline sponge via coordinative alignment method CrystEngComm, 2023, 25, 5001-5011
7247195	CIF	C161.75 H131 Cd6.9 N25.5 O41.65	P 1 21/n 1	14.9412; 42.7238; 33.8725 90; 93.6969; 90	21577.3	Habib, Faiza; Tocher, Derek A.; Carmalt, Claire J. Encapsulation of N-containing compounds in a new hydrophilic Cd-based crystalline sponge via coordinative alignment method CrystEngComm, 2023, 25, 5001-5011
7247196	CIF	C110.67 H81.33 Cd4.67 N12.67 O28.67	P 1 21/n 1	14.0589; 43.1549; 33.7222 90; 94.5246; 90	20395.8	Habib, Faiza; Tocher, Derek A.; Carmalt, Claire J. Encapsulation of N-containing compounds in a new hydrophilic Cd-based crystalline sponge via coordinative alignment method CrystEngComm, 2023, 25, 5001-5011
7247201	CIF	C52 H84 Cd3 N6 O36	C 1 2/c 1	36.833; 10.295; 20.105 90; 102.065; 90	7455.3	Goswami, Anindita; Dutta, Prantik; Biradha, Kumar Metal–organic frameworks with open metal sites act as efficient heterogeneous catalysts for Knoevenagel condensation and the Chan–Lam coupling reaction CrystEngComm, 2023, 25, 5092-5099
7247202	CIF	C312 H276 Cu24 N30 O144	I 4/m	30.4107; 30.4107; 30.414 90; 90; 90	28127.2	Goswami, Anindita; Dutta, Prantik; Biradha, Kumar Metal–organic frameworks with open metal sites act as efficient heterogeneous catalysts for Knoevenagel condensation and the Chan–Lam coupling reaction CrystEngComm, 2023, 25, 5092-5099
7247203	CIF	C28 H25 N O7	P b c a	16.0415; 6.6425; 44.992 90; 90; 90	4794.2	Meng, Lingshan; Li, Duanxiu; Zhu, Yujing; Wang, Jianming; Deng, Zongwu; Zhang, Hailu Pirfenidone–flavonoid cocrystals with reduced solubility and dissolution rate CrystEngComm, 2023, 25, 5133-5140
7247204	CIF	C39 H32 N2 O7	C 1 c 1	18.9053; 8.2831; 20.9395 90; 98.594; 90	3242.19	Meng, Lingshan; Li, Duanxiu; Zhu, Yujing; Wang, Jianming; Deng, Zongwu; Zhang, Hailu Pirfenidone–flavonoid cocrystals with reduced solubility and dissolution rate CrystEngComm, 2023, 25, 5133-5140
7247205	CIF	C12 H6 O2	P c a 21	18.4305; 3.7948; 25.3173 90; 90; 90	1770.69	Dogaru, Andreea; Apostol, Adrian A.; Maxim, Catalin; Raduca, Mihai; Novikov, Alexander S.; Nicolescu, Alina; Deleanu, Calin; Nica, Simona; Andruh, Marius Halogen bonded supramolecular assemblies constructed from azulene derivatives and perfluorinated di-/triiodobenzenes CrystEngComm, 2023, 25, 5243-5261
7247206	CIF	C18 H8 F4 I2 O2	P -1	4.1607; 14.3681; 16.2365 70.813; 88.318; 83.695	911.15	Dogaru, Andreea; Apostol, Adrian A.; Maxim, Catalin; Raduca, Mihai; Novikov, Alexander S.; Nicolescu, Alina; Deleanu, Calin; Nica, Simona; Andruh, Marius Halogen bonded supramolecular assemblies constructed from azulene derivatives and perfluorinated di-/triiodobenzenes CrystEngComm, 2023, 25, 5243-5261
7247207	CIF	C26 H14 F4 I2 N2	C 1 2/c 1	29.444; 8.5268; 18.3966 90; 91.377; 90	4617.4	Dogaru, Andreea; Apostol, Adrian A.; Maxim, Catalin; Raduca, Mihai; Novikov, Alexander S.; Nicolescu, Alina; Deleanu, Calin; Nica, Simona; Andruh, Marius Halogen bonded supramolecular assemblies constructed from azulene derivatives and perfluorinated di-/triiodobenzenes CrystEngComm, 2023, 25, 5243-5261
7247208	CIF	C18 H8 F4 I2 O2	P -1	7.4786; 8.5409; 14.6445 75.696; 77.44; 88.124	884.49	Dogaru, Andreea; Apostol, Adrian A.; Maxim, Catalin; Raduca, Mihai; Novikov, Alexander S.; Nicolescu, Alina; Deleanu, Calin; Nica, Simona; Andruh, Marius Halogen bonded supramolecular assemblies constructed from azulene derivatives and perfluorinated di-/triiodobenzenes CrystEngComm, 2023, 25, 5243-5261
7247209	CIF	C32 H14 F8 I4 N2	P 1 21/c 1	4.22529; 34.4499; 21.9267 90; 91.425; 90	3190.7	Dogaru, Andreea; Apostol, Adrian A.; Maxim, Catalin; Raduca, Mihai; Novikov, Alexander S.; Nicolescu, Alina; Deleanu, Calin; Nica, Simona; Andruh, Marius Halogen bonded supramolecular assemblies constructed from azulene derivatives and perfluorinated di-/triiodobenzenes CrystEngComm, 2023, 25, 5243-5261
7247210	CIF	C26 H14 F3 I3 N2	C m c e	34.3394; 7.4235; 19.2266 90; 90; 90	4901.2	Dogaru, Andreea; Apostol, Adrian A.; Maxim, Catalin; Raduca, Mihai; Novikov, Alexander S.; Nicolescu, Alina; Deleanu, Calin; Nica, Simona; Andruh, Marius Halogen bonded supramolecular assemblies constructed from azulene derivatives and perfluorinated di-/triiodobenzenes CrystEngComm, 2023, 25, 5243-5261
7247211	CIF	C144 H64 F24 I24 O16	P 1 21/c 1	18.2877; 30.6219; 28.2054 90; 98.227; 90	15632.6	Dogaru, Andreea; Apostol, Adrian A.; Maxim, Catalin; Raduca, Mihai; Novikov, Alexander S.; Nicolescu, Alina; Deleanu, Calin; Nica, Simona; Andruh, Marius Halogen bonded supramolecular assemblies constructed from azulene derivatives and perfluorinated di-/triiodobenzenes CrystEngComm, 2023, 25, 5243-5261
7247216	CIF	C10 H10 N4 O4	P 1 21/c 1	10.5137; 5.4852; 10.3155 90; 110.873; 90	555.85	Pagliari, Anderson B.; Rosa, Jéssica M. L.; de Lima, Priscila S. V.; Zimmer, Geórgia C.; da Silva, Maria E. C.; de Oliveira, Érica G.; Bonacorso, Helio G.; Zanatta, Nilo; Martins, Marcos A. P. Polymorphism in N-(5-methylisoxazol-3-yl)malonamide: understanding the supramolecular structure and the crystallization mechanism CrystEngComm, 2023, 25, 5118-5132
7247217	CIF	C11 H12 N4 O4	P 1 2/n 1	9.5647; 4.6961; 13.7344 90; 97.14; 90	612.12	Pagliari, Anderson B.; Rosa, Jéssica M. L.; de Lima, Priscila S. V.; Zimmer, Geórgia C.; da Silva, Maria E. C.; de Oliveira, Érica G.; Bonacorso, Helio G.; Zanatta, Nilo; Martins, Marcos A. P. Polymorphism in N-(5-methylisoxazol-3-yl)malonamide: understanding the supramolecular structure and the crystallization mechanism CrystEngComm, 2023, 25, 5118-5132
7247218	CIF	C13 H18 N4 O5 S	P m n 21	20.0136; 8.2017; 9.831 90; 90; 90	1613.71	Pagliari, Anderson B.; Rosa, Jéssica M. L.; de Lima, Priscila S. V.; Zimmer, Geórgia C.; da Silva, Maria E. C.; de Oliveira, Érica G.; Bonacorso, Helio G.; Zanatta, Nilo; Martins, Marcos A. P. Polymorphism in N-(5-methylisoxazol-3-yl)malonamide: understanding the supramolecular structure and the crystallization mechanism CrystEngComm, 2023, 25, 5118-5132
7247219	CIF	C11 H12 N4 O4	P -1	4.9247; 9.8219; 12.0712 88.35; 82.491; 88.948	578.57	Pagliari, Anderson B.; Rosa, Jéssica M. L.; de Lima, Priscila S. V.; Zimmer, Geórgia C.; da Silva, Maria E. C.; de Oliveira, Érica G.; Bonacorso, Helio G.; Zanatta, Nilo; Martins, Marcos A. P. Polymorphism in N-(5-methylisoxazol-3-yl)malonamide: understanding the supramolecular structure and the crystallization mechanism CrystEngComm, 2023, 25, 5118-5132
7247220	CIF	C88 H88 Cl4 N4 O9 Zn2	P -1	11.135; 19.665; 21.122 106.71; 102.08; 104.65	4082	Kim, Gyeongwoo; Han, Jihun; Kim, Dongwon; Jung, Ok-Sang Single crystals of cyclodimeric zinc(ii) complexes containing 9,10-bis((isoquinolin-5-yloxy)methyl)anthracene: reversible adsorption of target molecules and recognition of CH2I2 in an SCSC mode CrystEngComm, 2023, 25, 5077-5084
7247221	CIF	C58 H52 Cl4 N6 O2 Zn2	P 1 21/n 1	6.0205; 18.3; 23.836 90; 91.674; 90	2625	Kim, Gyeongwoo; Han, Jihun; Kim, Dongwon; Jung, Ok-Sang Single crystals of cyclodimeric zinc(ii) complexes containing 9,10-bis((isoquinolin-5-yloxy)methyl)anthracene: reversible adsorption of target molecules and recognition of CH2I2 in an SCSC mode CrystEngComm, 2023, 25, 5077-5084
7247222	CIF	C217 H210 Cl10 N8 O12 Zn4	P -1	13.164; 17.894; 21.651 76.66; 72.73; 85.85	4739	Kim, Gyeongwoo; Han, Jihun; Kim, Dongwon; Jung, Ok-Sang Single crystals of cyclodimeric zinc(ii) complexes containing 9,10-bis((isoquinolin-5-yloxy)methyl)anthracene: reversible adsorption of target molecules and recognition of CH2I2 in an SCSC mode CrystEngComm, 2023, 25, 5077-5084
7247223	CIF	C100 H88 Cl4 N4 O4 Zn2	P -1	13.7962; 17.9965; 20.997 75.579; 72.959; 88.789	4819.7	Kim, Gyeongwoo; Han, Jihun; Kim, Dongwon; Jung, Ok-Sang Single crystals of cyclodimeric zinc(ii) complexes containing 9,10-bis((isoquinolin-5-yloxy)methyl)anthracene: reversible adsorption of target molecules and recognition of CH2I2 in an SCSC mode CrystEngComm, 2023, 25, 5077-5084
7247224	CIF	C6 H18 Cl3 N3	P 1 21/n 1	10.9842; 7.9342; 25.1271 90; 91.717; 90	2188.86	Hu, Zheng-Hui; Gong, Chen; Sun, Shu-Qi; Liu, Xin-Yu; Gao, Ji-Xing High temperature switchable dielectric properties in molecular crystal material 1,4,7-triazacyclononane trihydrochloride CrystEngComm, 2023, 25, 5304-5309
7247225	CIF	C6 H18 Cl3 N3	R -3 m :H	8.0176; 8.0176; 15.1832 90; 90; 120	845.25	Hu, Zheng-Hui; Gong, Chen; Sun, Shu-Qi; Liu, Xin-Yu; Gao, Ji-Xing High temperature switchable dielectric properties in molecular crystal material 1,4,7-triazacyclononane trihydrochloride CrystEngComm, 2023, 25, 5304-5309
7247228	CIF	C5 H11 Br3 F N Pb	P 21 21 21	7.8341; 10.1533; 14.2642 90; 90; 90	1134.6	Gan, Tian; Xu, Zhe-Kun; Gan, Jia-Qi; Wang, Zhong-Xia Structural dimension engineering and high-temperature dielectric–optical switching in fluorine-substituted lead bromide hybrid perovskites CrystEngComm, 2023, 25, 5029-5034
7247229	CIF	C20 H40 Br8 F8 N4 Pb2	P 41 21 2	12.205; 12.205; 51.295 90; 90; 90	7641	Gan, Tian; Xu, Zhe-Kun; Gan, Jia-Qi; Wang, Zhong-Xia Structural dimension engineering and high-temperature dielectric–optical switching in fluorine-substituted lead bromide hybrid perovskites CrystEngComm, 2023, 25, 5029-5034
7247230	CIF	C13 H9 Br2 N O	I 1 2/a 1	6.1745; 6.8716; 28.3078 90; 96.189; 90	1194.06	Yoshikawa, Isao; Zhang, Zaixiang; Suzuki, Masahiro; Ikedo, Hana; Yin, Qiuxiang; Houjou, Hirohiko Active control of molecular stacking types in a congeneric library of dihalogenated salicylideneaniline crystals and their solid solutions CrystEngComm, 2023, 25, 5109-5117
7247231	CIF	C13 H9 Br2 N O	P c a 21	6.0569; 6.933; 28.5038 90; 90; 90	1196.95	Yoshikawa, Isao; Zhang, Zaixiang; Suzuki, Masahiro; Ikedo, Hana; Yin, Qiuxiang; Houjou, Hirohiko Active control of molecular stacking types in a congeneric library of dihalogenated salicylideneaniline crystals and their solid solutions CrystEngComm, 2023, 25, 5109-5117
7247232	CIF	C13 H9 Br2 N O	P c c n	56.5791; 6.894; 6.1018 90; 90; 90	2380.05	Yoshikawa, Isao; Zhang, Zaixiang; Suzuki, Masahiro; Ikedo, Hana; Yin, Qiuxiang; Houjou, Hirohiko Active control of molecular stacking types in a congeneric library of dihalogenated salicylideneaniline crystals and their solid solutions CrystEngComm, 2023, 25, 5109-5117
7247233	CIF	C13 H9 Br Cl N O	P c c n	55.8702; 6.9161; 6.1083 90; 90; 90	2360.27	Yoshikawa, Isao; Zhang, Zaixiang; Suzuki, Masahiro; Ikedo, Hana; Yin, Qiuxiang; Houjou, Hirohiko Active control of molecular stacking types in a congeneric library of dihalogenated salicylideneaniline crystals and their solid solutions CrystEngComm, 2023, 25, 5109-5117
7247234	CIF	C13 H9 Br Cl N O	P 1 21/c 1	27.8584; 6.8627; 6.1547 90; 95.84; 90	1170.57	Yoshikawa, Isao; Zhang, Zaixiang; Suzuki, Masahiro; Ikedo, Hana; Yin, Qiuxiang; Houjou, Hirohiko Active control of molecular stacking types in a congeneric library of dihalogenated salicylideneaniline crystals and their solid solutions CrystEngComm, 2023, 25, 5109-5117
7247235	CIF	C13 H9 Br2 N O	P c c n	56.4542; 6.902; 6.1053 90; 90; 90	2378.91	Yoshikawa, Isao; Zhang, Zaixiang; Suzuki, Masahiro; Ikedo, Hana; Yin, Qiuxiang; Houjou, Hirohiko Active control of molecular stacking types in a congeneric library of dihalogenated salicylideneaniline crystals and their solid solutions CrystEngComm, 2023, 25, 5109-5117
7247246	CIF	C16 H14 Cu N4 O6	P 1 21/c 1	5.5038; 15.3084; 9.9468 90; 92.58; 90	837.21	Li, Wen-Ze; Li, Jing; Zhao, Hong-Tian; Zhang, Xiao-Sa; Liu, Yu; Liu, Zhi-Tong; Fu, Hong-Xin; Luan, Jian Fabrication of two 2D Cu-based coordination polymers via a secondary ligand adjustment and a derived Cu/Cu2O heterojunction for an enhanced dye removal capacity CrystEngComm, 2023, 25, 5351-5361
7247247	CIF	C20 H14 Cu N4 O6	P 1 21/c 1	9.791; 6.3116; 28.379 90; 93.082; 90	1751.2	Li, Wen-Ze; Li, Jing; Zhao, Hong-Tian; Zhang, Xiao-Sa; Liu, Yu; Liu, Zhi-Tong; Fu, Hong-Xin; Luan, Jian Fabrication of two 2D Cu-based coordination polymers via a secondary ligand adjustment and a derived Cu/Cu2O heterojunction for an enhanced dye removal capacity CrystEngComm, 2023, 25, 5351-5361
7247254	CIF	C192 Ag45 Br6 F24 Sb4	P -1	18.711; 20.882; 21.381 110.987; 114.356; 99.657	6599	Gao, Yu-Quan; Wu, Wei-Hong; Mao, Hui; Zhang, Ya-Ge; Zhan, Cai-Hong; Jiang, Zhan-Guo Transformations of silver(i) chalcogenide clusters induced by halide ions as dopant components rather than surface active species CrystEngComm, 2023, 25, 4934-4938
7247255	CIF	C192 H288 Ag45 Cl6 F24 Sb4	P -1	19.854; 20.442; 20.492 102.885; 116.443; 108.691	6365	Gao, Yu-Quan; Wu, Wei-Hong; Mao, Hui; Zhang, Ya-Ge; Zhan, Cai-Hong; Jiang, Zhan-Guo Transformations of silver(i) chalcogenide clusters induced by halide ions as dopant components rather than surface active species CrystEngComm, 2023, 25, 4934-4938
7247256	CIF	C360 H540 Ag148 Br30 S26	P 4/m n c	30.517; 30.517; 35.19 90; 90; 90	32772	Gao, Yu-Quan; Wu, Wei-Hong; Mao, Hui; Zhang, Ya-Ge; Zhan, Cai-Hong; Jiang, Zhan-Guo Transformations of silver(i) chalcogenide clusters induced by halide ions as dopant components rather than surface active species CrystEngComm, 2023, 25, 4934-4938
7247266	CIF	C7 H10 Ag N4 O3	C 1 2/c 1	22.261; 14.2526; 7.7279 90; 108.177; 90	2329.5	Nalaoh, Phattananawee; Jenkins, David M. Di-triazole boat conformation leads to metal–organic nanotube while chair conformation leads to coordination polymer CrystEngComm, 2023, 25, 4929-4933
7247267	CIF	C14 H20 N6	P n a 21	12.7466; 17.0131; 6.1821 90; 90; 90	1340.65	Nalaoh, Phattananawee; Jenkins, David M. Di-triazole boat conformation leads to metal–organic nanotube while chair conformation leads to coordination polymer CrystEngComm, 2023, 25, 4929-4933
7247268	CIF	C10 H14 F6 O6 S2	C 1 2/c 1	15.4247; 9.6024; 10.6881 90; 98.793; 90	1564.45	Nalaoh, Phattananawee; Jenkins, David M. Di-triazole boat conformation leads to metal–organic nanotube while chair conformation leads to coordination polymer CrystEngComm, 2023, 25, 4929-4933
7247269	CIF	C20 H26 F6 N8 O6 S2	P -1	6.6612; 7.092; 15.1212 94.455; 98.312; 90.959	704.42	Nalaoh, Phattananawee; Jenkins, David M. Di-triazole boat conformation leads to metal–organic nanotube while chair conformation leads to coordination polymer CrystEngComm, 2023, 25, 4929-4933
7247270	CIF	C12 H18 Ag N7 O3	P 1 21/c 1	12.5507; 12.907; 9.9446 90; 108.336; 90	1529.15	Nalaoh, Phattananawee; Jenkins, David M. Di-triazole boat conformation leads to metal–organic nanotube while chair conformation leads to coordination polymer CrystEngComm, 2023, 25, 4929-4933
7247271	CIF	C12 H18 N6	P 1 21/n 1	8.4768; 10.883; 13.588 90; 92.07; 90	1252.7	Nalaoh, Phattananawee; Jenkins, David M. Di-triazole boat conformation leads to metal–organic nanotube while chair conformation leads to coordination polymer CrystEngComm, 2023, 25, 4929-4933
7247272	CIF	C33 H53 N7 O16 S4 Zn2	I 41/a c d :2	27.7261; 27.7261; 28.5384 90; 90; 90	21938.5	Liang, Yu-Jie; Liu, Liu; Yao, Jun; Deng, Min; Xu, Quan-Qing; Zhu, Ai-Xin; Huang, Bo Two flexible zinc–triazole–dicarboxylate frameworks: breathing behaviors for CO2 uptake and dye adsorption properties CrystEngComm, 2023, 25, 5174-5183
7247273	CIF	C17 H21 N7 O7 S2 Zn2	P 4/n c c :2	13.3634; 13.3634; 30.7634 90; 90; 90	5493.7	Liang, Yu-Jie; Liu, Liu; Yao, Jun; Deng, Min; Xu, Quan-Qing; Zhu, Ai-Xin; Huang, Bo Two flexible zinc–triazole–dicarboxylate frameworks: breathing behaviors for CO2 uptake and dye adsorption properties CrystEngComm, 2023, 25, 5174-5183
7247275	CIF	C46 H36 Cu F3 N6 O3 P2 S	P 1 21/c 1	19.06366; 9.17342; 24.46359 90; 96.298; 90	4252.35	Sun, Zhen-Zhou; Hu, Fu-Zhen; Gao, Cheng-Jie; Mou, Wen-Long; Wang, Guo; Zhu, Ning; Pan, Xun; Li, Zhong-Feng; Han, Hong-Liang; Fu, Hongbing; Xin, Xiu-Lan; Dai, Lixiong; Jin, Qiong-Hua; Qiu, Qi-Ming One-dimensional infinite chain Ag(i) complex with high quantum yield and TADF property: prepared by metal ion adjustment CrystEngComm, 2023, 25, 5405-5412
7247276	CIF	C57 H44 Ag2 F6 N6 O6 P2 S2	P -1	13.589; 18.55; 24.627 80.807; 89.307; 89.793	6128	Sun, Zhen-Zhou; Hu, Fu-Zhen; Gao, Cheng-Jie; Mou, Wen-Long; Wang, Guo; Zhu, Ning; Pan, Xun; Li, Zhong-Feng; Han, Hong-Liang; Fu, Hongbing; Xin, Xiu-Lan; Dai, Lixiong; Jin, Qiong-Hua; Qiu, Qi-Ming One-dimensional infinite chain Ag(i) complex with high quantum yield and TADF property: prepared by metal ion adjustment CrystEngComm, 2023, 25, 5405-5412
7247277	CIF	C46 H36 Ag F3 N6 O3 P2 S	P 1 21/c 1	13.9056; 22.9786; 14.7403 90; 116.689; 90	4208.17	Sun, Zhen-Zhou; Hu, Fu-Zhen; Gao, Cheng-Jie; Mou, Wen-Long; Wang, Guo; Zhu, Ning; Pan, Xun; Li, Zhong-Feng; Han, Hong-Liang; Fu, Hongbing; Xin, Xiu-Lan; Dai, Lixiong; Jin, Qiong-Hua; Qiu, Qi-Ming One-dimensional infinite chain Ag(i) complex with high quantum yield and TADF property: prepared by metal ion adjustment CrystEngComm, 2023, 25, 5405-5412
7247278	CIF	C7 H7 B O3	P 1 21/c 1	3.889; 13.249; 14.043 90; 91.986; 90	723.1	Li, Guoyan; Yang, Xiaofeng; Miao, Jinling; Cui, Yu; Sun, Guoxin; Li, Yexin Substitution position regulating the excitation-dependent fluorescence–phosphorescence emission of formylphenylboronic acids for single-component white light and anticounterfeiting CrystEngComm, 2023, 25, 5479-5485
7247279	CIF	C7 H7 B O3	C 1 2/c 1	22.75; 3.8166; 17.211 90; 101.691; 90	1463.4	Li, Guoyan; Yang, Xiaofeng; Miao, Jinling; Cui, Yu; Sun, Guoxin; Li, Yexin Substitution position regulating the excitation-dependent fluorescence–phosphorescence emission of formylphenylboronic acids for single-component white light and anticounterfeiting CrystEngComm, 2023, 25, 5479-5485
7247280	CIF	C12 H12 N2 Se2	P 1 21/c 1	18.046; 8.3234; 18.3738 90; 118.457; 90	2426.4	Alfuth, Jan; Jeannin, Olivier; Fourmigué, Marc Chalcogen bonding interactions in a series of aromatic selenocyanates CrystEngComm, 2023, 25, 5316-5323
7247281	CIF	C8 H4 N2 Se2	P n m a	11.563; 17.139; 4.8436 90; 90; 90	959.9	Alfuth, Jan; Jeannin, Olivier; Fourmigué, Marc Chalcogen bonding interactions in a series of aromatic selenocyanates CrystEngComm, 2023, 25, 5316-5323
7247282	CIF	C8 H4 N2 Se2	P 1 21/c 1	9.117; 4.0552; 11.8113 90; 95.91; 90	434.36	Alfuth, Jan; Jeannin, Olivier; Fourmigué, Marc Chalcogen bonding interactions in a series of aromatic selenocyanates CrystEngComm, 2023, 25, 5316-5323
7247283	CIF	C6 H2 N2 S Se2	P n m a	11.2833; 18.088; 4.056 90; 90; 90	827.8	Alfuth, Jan; Jeannin, Olivier; Fourmigué, Marc Chalcogen bonding interactions in a series of aromatic selenocyanates CrystEngComm, 2023, 25, 5316-5323
7247284	CIF	C34 H23 N7 Se4	P -1	7.4494; 9.201; 12.306 74.58; 89.306; 88.669	812.9	Alfuth, Jan; Jeannin, Olivier; Fourmigué, Marc Chalcogen bonding interactions in a series of aromatic selenocyanates CrystEngComm, 2023, 25, 5316-5323
7247285	CIF	C20 H14 N4 Se2	P 1 21/c 1	8.8342; 14.079; 7.6447 90; 110.592; 90	890.1	Alfuth, Jan; Jeannin, Olivier; Fourmigué, Marc Chalcogen bonding interactions in a series of aromatic selenocyanates CrystEngComm, 2023, 25, 5316-5323
7247286	CIF	C7 H10 Cl4 I N	P 1 21/c 1	8.3175; 9.85; 7.6668 90; 101.728; 90	615.01	Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maxim N.; Novikov, Alexander S.; Sukhikh, Taisiya S.; Adonin, Sergey A. Halogen bonding in chloroiodates(iii) CrystEngComm, 2023, 25, 5233-5237
7247287	CIF	C7 H10 Cl4 I N	P 1 21/c 1	4.3707; 11.8303; 11.8442 90; 92.985; 90	611.59	Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maxim N.; Novikov, Alexander S.; Sukhikh, Taisiya S.; Adonin, Sergey A. Halogen bonding in chloroiodates(iii) CrystEngComm, 2023, 25, 5233-5237
7247288	CIF	C12 H14 Cl5 I N2	P -1	7.4887; 7.6756; 8.0494 93.199; 110.363; 95.058	430.22	Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maxim N.; Novikov, Alexander S.; Sukhikh, Taisiya S.; Adonin, Sergey A. Halogen bonding in chloroiodates(iii) CrystEngComm, 2023, 25, 5233-5237
7247289	CIF	C8 H12 Cl4 I N	C 1 2/c 1	17.4476; 9.9715; 7.8504 90; 102.6; 90	1332.91	Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maxim N.; Novikov, Alexander S.; Sukhikh, Taisiya S.; Adonin, Sergey A. Halogen bonding in chloroiodates(iii) CrystEngComm, 2023, 25, 5233-5237
7247290	CIF	C4 H12 Cl4 I N	P 32	16.4343; 16.4343; 11.4451 90; 90; 120	2677.03	Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maxim N.; Novikov, Alexander S.; Sukhikh, Taisiya S.; Adonin, Sergey A. Halogen bonding in chloroiodates(iii) CrystEngComm, 2023, 25, 5233-5237
7247291	CIF	C9 H14 Cl4 I N	P 1 21/n 1	8.4156; 16.0769; 10.9381 90; 103.705; 90	1437.75	Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maxim N.; Novikov, Alexander S.; Sukhikh, Taisiya S.; Adonin, Sergey A. Halogen bonding in chloroiodates(iii) CrystEngComm, 2023, 25, 5233-5237
7247292	CIF	C12 H14 Cl8 I2 N2	P 42 b c	11.5876; 11.5876; 16.4371 90; 90; 90	2207.1	Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maxim N.; Novikov, Alexander S.; Sukhikh, Taisiya S.; Adonin, Sergey A. Halogen bonding in chloroiodates(iii) CrystEngComm, 2023, 25, 5233-5237
7247293	CIF	C8 H12 Cl4 I N	P 1 21/c 1	11.3598; 8.5116; 15.14 90; 110.486; 90	1371.3	Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maxim N.; Novikov, Alexander S.; Sukhikh, Taisiya S.; Adonin, Sergey A. Halogen bonding in chloroiodates(iii) CrystEngComm, 2023, 25, 5233-5237
7247294	CIF	C6 H7 Cl5 I N	P 1 21 1	8.2044; 9.6553; 8.2874 90; 105.887; 90	631.42	Korobeynikov, Nikita A.; Usoltsev, Andrey N.; Sokolov, Maxim N.; Novikov, Alexander S.; Sukhikh, Taisiya S.; Adonin, Sergey A. Halogen bonding in chloroiodates(iii) CrystEngComm, 2023, 25, 5233-5237
7247303	CIF	C29.2 H27.6 O14.6 Zn3	C 1 2/c 1	20.1166; 10.6178; 16.0756 90; 108.39; 90	3258.3	Toledo-Jaldín, Helen Paola; Pinzón-Vanegas, Cristian; León-Gómez, Juan Pablo; Blanco Flores, Alien; Martínez-Otero, Diego; Reyes Domínguez, Iván A.; Canseco-González, Daniel; Rosales-Vázquez, Luis D.; Salomón-Flores, María K.; Dorazco-González, Alejandro Sensitive luminescent chemosensing of fluoride based on Eu-doped Zn-LMOF in aqueous media: structural and spectroscopic studies CrystEngComm, 2023, 25, 3766-3776
7247304	CIF	C34 H37 Co N4 O8.5	C c c a :2	15.3926; 54.654; 16.2237 90; 90; 90	13648.5	Huang, Wei-Chun; Chen, Wei-Hao; Chen, Chia-Ling; Liao, Tsung-Te; Chen, Yi-Wun; Chen, Jhy-Der Formation of entangled Co(ii) coordination polymers based on bis-pyridyl-bis-amide and angular dicarboxylate ligands: a structural comparison CrystEngComm, 2023, 25, 5575-5587
7247305	CIF	C57 H60 Co2 N7 O15	P 1 21/c 1	14.3467; 24.9926; 17.2868 90; 101.204; 90	6080.25	Huang, Wei-Chun; Chen, Wei-Hao; Chen, Chia-Ling; Liao, Tsung-Te; Chen, Yi-Wun; Chen, Jhy-Der Formation of entangled Co(ii) coordination polymers based on bis-pyridyl-bis-amide and angular dicarboxylate ligands: a structural comparison CrystEngComm, 2023, 25, 5575-5587
7247306	CIF	C34 H37 Co N4 O9.5 S	C 1 2/c 1	27.658; 11.2065; 24.7275 90; 114.988; 90	6946.9	Huang, Wei-Chun; Chen, Wei-Hao; Chen, Chia-Ling; Liao, Tsung-Te; Chen, Yi-Wun; Chen, Jhy-Der Formation of entangled Co(ii) coordination polymers based on bis-pyridyl-bis-amide and angular dicarboxylate ligands: a structural comparison CrystEngComm, 2023, 25, 5575-5587
7247307	CIF	C25 H25 Co N2 O6	P 1 21/c 1	12.7831; 14.0167; 13.2901 90; 93.441; 90	2377	Huang, Wei-Chun; Chen, Wei-Hao; Chen, Chia-Ling; Liao, Tsung-Te; Chen, Yi-Wun; Chen, Jhy-Der Formation of entangled Co(ii) coordination polymers based on bis-pyridyl-bis-amide and angular dicarboxylate ligands: a structural comparison CrystEngComm, 2023, 25, 5575-5587
7247308	CIF	C38 H30 Co N4 O11 S	P 1 21/c 1	14.1784; 28.3482; 11.4749 90; 103.114; 90	4491.8	Huang, Wei-Chun; Chen, Wei-Hao; Chen, Chia-Ling; Liao, Tsung-Te; Chen, Yi-Wun; Chen, Jhy-Der Formation of entangled Co(ii) coordination polymers based on bis-pyridyl-bis-amide and angular dicarboxylate ligands: a structural comparison CrystEngComm, 2023, 25, 5575-5587
7247309	CIF	C31 H32 Co N4 O8	P 1 21/c 1	11.8533; 14.3536; 18.8237 90; 94.5365; 90	3192.58	Huang, Wei-Chun; Chen, Wei-Hao; Chen, Chia-Ling; Liao, Tsung-Te; Chen, Yi-Wun; Chen, Jhy-Der Formation of entangled Co(ii) coordination polymers based on bis-pyridyl-bis-amide and angular dicarboxylate ligands: a structural comparison CrystEngComm, 2023, 25, 5575-5587
7247310	CIF	C24 H25 Co N2 O9 S	C 1 2/c 1	21.6886; 12.8559; 20.7441 90; 103.494; 90	5624.3	Huang, Wei-Chun; Chen, Wei-Hao; Chen, Chia-Ling; Liao, Tsung-Te; Chen, Yi-Wun; Chen, Jhy-Der Formation of entangled Co(ii) coordination polymers based on bis-pyridyl-bis-amide and angular dicarboxylate ligands: a structural comparison CrystEngComm, 2023, 25, 5575-5587
7247311	CIF	C39 H36 Co N4 O11	P 1 21/n 1	11.3937; 22.6845; 13.7311 90; 93.2983; 90	3543.07	Huang, Wei-Chun; Chen, Wei-Hao; Chen, Chia-Ling; Liao, Tsung-Te; Chen, Yi-Wun; Chen, Jhy-Der Formation of entangled Co(ii) coordination polymers based on bis-pyridyl-bis-amide and angular dicarboxylate ligands: a structural comparison CrystEngComm, 2023, 25, 5575-5587
7247312	CIF	C38 H28 Co N4 O9	P -1	12.8615; 13.3572; 13.9703 71.1164; 76.1766; 88.4604	2201.74	Huang, Wei-Chun; Chen, Wei-Hao; Chen, Chia-Ling; Liao, Tsung-Te; Chen, Yi-Wun; Chen, Jhy-Der Formation of entangled Co(ii) coordination polymers based on bis-pyridyl-bis-amide and angular dicarboxylate ligands: a structural comparison CrystEngComm, 2023, 25, 5575-5587
7247313	CIF	C41 H30 Co F6 N4 O9	P n a 21	21.402; 7.777; 23.478 90; 90; 90	3907.8	Huang, Wei-Chun; Chen, Wei-Hao; Chen, Chia-Ling; Liao, Tsung-Te; Chen, Yi-Wun; Chen, Jhy-Der Formation of entangled Co(ii) coordination polymers based on bis-pyridyl-bis-amide and angular dicarboxylate ligands: a structural comparison CrystEngComm, 2023, 25, 5575-5587
7247314	CIF	C30 H27 Cl3 O3	P -1	9.4393; 11.7938; 12.8424 75.714; 89.665; 77.614	1351.5	Dutta, Dipjyoti; Gogoi, Anamika; Dutta, Rupjyoti; Harmalkar, Sarvesh S.; Lama, Prem; Dey, Sandeep Kumar C–H hydrogen bond and halogen bond directed self-assembly of ethereal podands and C–X⋯F−/HF2− halogen bonding in solution CrystEngComm, 2023, 25, 5650-5659
7247315	CIF	C30 H27 I3 O3	P -1	9.645; 12.616; 14.168 106.195; 93.337; 93.16	1648.2	Dutta, Dipjyoti; Gogoi, Anamika; Dutta, Rupjyoti; Harmalkar, Sarvesh S.; Lama, Prem; Dey, Sandeep Kumar C–H hydrogen bond and halogen bond directed self-assembly of ethereal podands and C–X⋯F−/HF2− halogen bonding in solution CrystEngComm, 2023, 25, 5650-5659
7247316	CIF	C33 H27 N3 O3	C 1 2/c 1	30.916; 8.682; 25.527 90; 119.415; 90	5968	Dutta, Dipjyoti; Gogoi, Anamika; Dutta, Rupjyoti; Harmalkar, Sarvesh S.; Lama, Prem; Dey, Sandeep Kumar C–H hydrogen bond and halogen bond directed self-assembly of ethereal podands and C–X⋯F−/HF2− halogen bonding in solution CrystEngComm, 2023, 25, 5650-5659
7247317	CIF	C63 H60 Br6 O7	P -1	9.4811; 12.591; 13.809 107.591; 95.204; 91.591	1562.3	Dutta, Dipjyoti; Gogoi, Anamika; Dutta, Rupjyoti; Harmalkar, Sarvesh S.; Lama, Prem; Dey, Sandeep Kumar C–H hydrogen bond and halogen bond directed self-assembly of ethereal podands and C–X⋯F−/HF2− halogen bonding in solution CrystEngComm, 2023, 25, 5650-5659
7247326	CIF	C37 H36 F3 N9 O4 S	P -1	11.0587; 11.8069; 14.601 78.679; 76.705; 77.663	1790.65	Rai, Sunil K.; Gunnam, Anilkumar; Roy, Debopriya; Rajput, Raveena; Kulkarni, Kiran; Nangia, Ashwini K. Cocrystallization of multi-kinase inhibitor pazopanib with fenamic acids: improving dissolution and inhibiting cell migration CrystEngComm, 2023, 25, 5565-5574
7247327	CIF	C34 H32 F3 N9 O4 S	P 1 21/c 1	9.3626; 18.0718; 19.7247 90; 94.683; 90	3326.3	Rai, Sunil K.; Gunnam, Anilkumar; Roy, Debopriya; Rajput, Raveena; Kulkarni, Kiran; Nangia, Ashwini K. Cocrystallization of multi-kinase inhibitor pazopanib with fenamic acids: improving dissolution and inhibiting cell migration CrystEngComm, 2023, 25, 5565-5574
7247328	CIF	C37 H36 F3 N9 O4 S	P -1	10.125; 18.32; 20.77 68.4; 89.7; 81.04	3533	Rai, Sunil K.; Gunnam, Anilkumar; Roy, Debopriya; Rajput, Raveena; Kulkarni, Kiran; Nangia, Ashwini K. Cocrystallization of multi-kinase inhibitor pazopanib with fenamic acids: improving dissolution and inhibiting cell migration CrystEngComm, 2023, 25, 5565-5574
7247329	CIF	C33 H39 Mn3 N15 O13	C 1 2/c 1	21.7912; 20.2706; 10.2341 90; 102.939; 90	4405.8	Zhong, Yun-Jing; Ouyang, Zhi-Jian; Kuang, Xiao-Man; Li, You-Hong; Chen, Wen-Bin; Yang, Meng; Dong, Wen Solvent effect on the structures of three manganese complexes based on azotetrazole-3-hydroxy-2-naphthoic acid: synthesis, structures, and magnetic and fluorescent properties CrystEngComm, 2023, 25, 5524-5532
7247330	CIF	C28 H28 Mn2 N12 O10	P 1 21/c 1	10.7765; 13.3012; 11.2337 90; 98.472; 90	1592.7	Zhong, Yun-Jing; Ouyang, Zhi-Jian; Kuang, Xiao-Man; Li, You-Hong; Chen, Wen-Bin; Yang, Meng; Dong, Wen Solvent effect on the structures of three manganese complexes based on azotetrazole-3-hydroxy-2-naphthoic acid: synthesis, structures, and magnetic and fluorescent properties CrystEngComm, 2023, 25, 5524-5532
7247331	CIF	C64 H93 Mn6 N24 O32.5 S8	P -1	10.6758; 12.4221; 19.041 82.315; 79.293; 72.475	2357.8	Zhong, Yun-Jing; Ouyang, Zhi-Jian; Kuang, Xiao-Man; Li, You-Hong; Chen, Wen-Bin; Yang, Meng; Dong, Wen Solvent effect on the structures of three manganese complexes based on azotetrazole-3-hydroxy-2-naphthoic acid: synthesis, structures, and magnetic and fluorescent properties CrystEngComm, 2023, 25, 5524-5532
7247341	CIF	C44 H35 Fe N Ni O P2 S2	P -1	10.7721; 13.5889; 13.8513 86.809; 74.723; 72.872	1868.64	Srivastava, Devyani; Kushwaha, Aparna; Kociok-Köhn, Gabriele; Gosavi, Suresh W.; Chauhan, Ratna; Ashokkumar, Muthupandian; Kumar, Abhinav; Muddassir, Mohd. Impact of substituent's position on the DSSC performances of new 1,1′-bis-(diphenylphosphino)ferrocene appended nickel(ii) methoxy cyanodithiolates CrystEngComm, 2023, 25, 5660-5672
7247342	CIF	C44 H35 Fe N Ni O P2 S2	P 1 21/n 1	14.3705; 17.2455; 16.2961 90; 101.34; 90	3959.77	Srivastava, Devyani; Kushwaha, Aparna; Kociok-Köhn, Gabriele; Gosavi, Suresh W.; Chauhan, Ratna; Ashokkumar, Muthupandian; Kumar, Abhinav; Muddassir, Mohd. Impact of substituent's position on the DSSC performances of new 1,1′-bis-(diphenylphosphino)ferrocene appended nickel(ii) methoxy cyanodithiolates CrystEngComm, 2023, 25, 5660-5672
7247343	CIF	C89 H74 Fe2 N2 Ni2 O3 P4 S4	P 1 21/n 1	13.944; 14.063; 19.8997 90; 104.471; 90	3778.4	Srivastava, Devyani; Kushwaha, Aparna; Kociok-Köhn, Gabriele; Gosavi, Suresh W.; Chauhan, Ratna; Ashokkumar, Muthupandian; Kumar, Abhinav; Muddassir, Mohd. Impact of substituent's position on the DSSC performances of new 1,1′-bis-(diphenylphosphino)ferrocene appended nickel(ii) methoxy cyanodithiolates CrystEngComm, 2023, 25, 5660-5672
7247344	CIF	C38 H26 Cu N2 P S4	C 1 2/c 1	25.212; 11.5626; 11.6676 90; 90.114; 90	3401.3	Costa, António G.; Lopes, Gonçalo; Ribeiro, Susana; Santos, Isabel C.; Simão, Dulce; Pereira, Laura C. J.; Le Breton, Nolwenn; Choua, Sylvie; Baudron, Stéphane A.; Almeida, Manuel; Rabaça, Sandra Cyano benzene functionalised Ni and Cu bisdithiolene complexes CrystEngComm, 2023, 25, 5362-5371
7247345	CIF	C38 H26 N2 Ni P S4	C 1 2/c 1	24.9983; 11.6753; 11.664 90; 90.396; 90	3404.2	Costa, António G.; Lopes, Gonçalo; Ribeiro, Susana; Santos, Isabel C.; Simão, Dulce; Pereira, Laura C. J.; Le Breton, Nolwenn; Choua, Sylvie; Baudron, Stéphane A.; Almeida, Manuel; Rabaça, Sandra Cyano benzene functionalised Ni and Cu bisdithiolene complexes CrystEngComm, 2023, 25, 5362-5371
7247346	CIF	C62 H46 N2 Ni P2 S4	P -1	9.6337; 10.8969; 13.2465 80.138; 89.456; 87.27	1368.48	Costa, António G.; Lopes, Gonçalo; Ribeiro, Susana; Santos, Isabel C.; Simão, Dulce; Pereira, Laura C. J.; Le Breton, Nolwenn; Choua, Sylvie; Baudron, Stéphane A.; Almeida, Manuel; Rabaça, Sandra Cyano benzene functionalised Ni and Cu bisdithiolene complexes CrystEngComm, 2023, 25, 5362-5371
7247347	CIF	C38 H26 Cu N2 P S4	P 1 21 1	7.7936; 15.7909; 14.0517 90; 95.771; 90	1720.55	Costa, António G.; Lopes, Gonçalo; Ribeiro, Susana; Santos, Isabel C.; Simão, Dulce; Pereira, Laura C. J.; Le Breton, Nolwenn; Choua, Sylvie; Baudron, Stéphane A.; Almeida, Manuel; Rabaça, Sandra Cyano benzene functionalised Ni and Cu bisdithiolene complexes CrystEngComm, 2023, 25, 5362-5371
7247348	CIF	C62 H46 N2 Ni P2 S4	P -1	13.5065; 14.3303; 14.8428 86.334; 77.455; 70.668	2646.1	Costa, António G.; Lopes, Gonçalo; Ribeiro, Susana; Santos, Isabel C.; Simão, Dulce; Pereira, Laura C. J.; Le Breton, Nolwenn; Choua, Sylvie; Baudron, Stéphane A.; Almeida, Manuel; Rabaça, Sandra Cyano benzene functionalised Ni and Cu bisdithiolene complexes CrystEngComm, 2023, 25, 5362-5371
7247349	CIF	C64 H49 N3 Ni P2 S4	P -1	11.2071; 12.4949; 20.7404 84.392; 80.941; 76.747	2785.96	Costa, António G.; Lopes, Gonçalo; Ribeiro, Susana; Santos, Isabel C.; Simão, Dulce; Pereira, Laura C. J.; Le Breton, Nolwenn; Choua, Sylvie; Baudron, Stéphane A.; Almeida, Manuel; Rabaça, Sandra Cyano benzene functionalised Ni and Cu bisdithiolene complexes CrystEngComm, 2023, 25, 5362-5371
7247350	CIF	C62 H46 Cu N2 P2 S4	P -1	13.5644; 14.4462; 14.8839 86.177; 76.389; 70.747	2675.92	Costa, António G.; Lopes, Gonçalo; Ribeiro, Susana; Santos, Isabel C.; Simão, Dulce; Pereira, Laura C. J.; Le Breton, Nolwenn; Choua, Sylvie; Baudron, Stéphane A.; Almeida, Manuel; Rabaça, Sandra Cyano benzene functionalised Ni and Cu bisdithiolene complexes CrystEngComm, 2023, 25, 5362-5371
7247351	CIF	C62 H46 Cu N2 P2 S4	P -1	9.6136; 10.9075; 13.3709 79.764; 89.324; 87.292	1378.21	Costa, António G.; Lopes, Gonçalo; Ribeiro, Susana; Santos, Isabel C.; Simão, Dulce; Pereira, Laura C. J.; Le Breton, Nolwenn; Choua, Sylvie; Baudron, Stéphane A.; Almeida, Manuel; Rabaça, Sandra Cyano benzene functionalised Ni and Cu bisdithiolene complexes CrystEngComm, 2023, 25, 5362-5371
7247360	CIF	C10 H13 Cd N O5	P 61	9.3792; 9.3792; 22.4879 90; 90; 120	1713.21	Windsor, Hunter J.; Kepert, Cameron J.; Macreadie, Lauren K. Spontaneous resolution of two chiral metal–organic frameworks through local geometric and lattice frustration effects CrystEngComm, 2023, 25, 5428-5435
7247361	CIF	C10 H13 Cd N O5	P 65	9.3938; 9.3938; 22.5064 90; 90; 120	1719.96	Windsor, Hunter J.; Kepert, Cameron J.; Macreadie, Lauren K. Spontaneous resolution of two chiral metal–organic frameworks through local geometric and lattice frustration effects CrystEngComm, 2023, 25, 5428-5435
7247362	CIF	C39 H39 Cd3 N3 O15	P 21 21 2	9.5668; 23.3692; 17.0992 90; 90; 90	3822.84	Windsor, Hunter J.; Kepert, Cameron J.; Macreadie, Lauren K. Spontaneous resolution of two chiral metal–organic frameworks through local geometric and lattice frustration effects CrystEngComm, 2023, 25, 5428-5435
7247364	CIF	C32 H77 Dy N O59 P7 W12	P 1 21/c 1	25.615; 14.6148; 24.466 90; 113.576; 90	8394.5	Li, Ying-Yu; Jin, Guan-Yu; Wang, Zhi-Qiang; Hu, Cong; Wang, Xue-Dong; Liu, Jian-Ming; Liu, Min; Han, Hong-Liang; Li, Zhong-Feng; Jin, Qiong-Hua Facile fabrication and characterization of rare earth complexes based on Keggin-type polyoxometalate with highly efficient activity for photocatalytic degradation of MO CrystEngComm, 2023, 25, 5851-5860
7247365	CIF	C32 H77 Ho N O59 P7 W12	P 1 21/c 1	25.749; 14.669; 24.645 90; 113.558; 90	8532.9	Li, Ying-Yu; Jin, Guan-Yu; Wang, Zhi-Qiang; Hu, Cong; Wang, Xue-Dong; Liu, Jian-Ming; Liu, Min; Han, Hong-Liang; Li, Zhong-Feng; Jin, Qiong-Hua Facile fabrication and characterization of rare earth complexes based on Keggin-type polyoxometalate with highly efficient activity for photocatalytic degradation of MO CrystEngComm, 2023, 25, 5851-5860
7247366	CIF	C32 H77 N O59 P7 Tm W12	P 1 21/c 1	25.235; 14.4532; 24.186 90; 113.447; 90	8092.9	Li, Ying-Yu; Jin, Guan-Yu; Wang, Zhi-Qiang; Hu, Cong; Wang, Xue-Dong; Liu, Jian-Ming; Liu, Min; Han, Hong-Liang; Li, Zhong-Feng; Jin, Qiong-Hua Facile fabrication and characterization of rare earth complexes based on Keggin-type polyoxometalate with highly efficient activity for photocatalytic degradation of MO CrystEngComm, 2023, 25, 5851-5860
7247367	CIF	C32 H77 N O59 P7 W12 Yb	P 1 21/c 1	25.633; 14.6214; 24.546 90; 113.451; 90	8439.7	Li, Ying-Yu; Jin, Guan-Yu; Wang, Zhi-Qiang; Hu, Cong; Wang, Xue-Dong; Liu, Jian-Ming; Liu, Min; Han, Hong-Liang; Li, Zhong-Feng; Jin, Qiong-Hua Facile fabrication and characterization of rare earth complexes based on Keggin-type polyoxometalate with highly efficient activity for photocatalytic degradation of MO CrystEngComm, 2023, 25, 5851-5860
7247368	CIF	C32 H77 Er N O59 P7 W12	P 1 21/c 1	25.703; 14.6812; 24.6 90; 113.535; 90	8510.7	Li, Ying-Yu; Jin, Guan-Yu; Wang, Zhi-Qiang; Hu, Cong; Wang, Xue-Dong; Liu, Jian-Ming; Liu, Min; Han, Hong-Liang; Li, Zhong-Feng; Jin, Qiong-Hua Facile fabrication and characterization of rare earth complexes based on Keggin-type polyoxometalate with highly efficient activity for photocatalytic degradation of MO CrystEngComm, 2023, 25, 5851-5860
7247369	CIF	C32 H77 Lu N O59 P7 W12	P 1 21/c 1	25.34; 14.4644; 24.289 90; 113.49; 90	8164.8	Li, Ying-Yu; Jin, Guan-Yu; Wang, Zhi-Qiang; Hu, Cong; Wang, Xue-Dong; Liu, Jian-Ming; Liu, Min; Han, Hong-Liang; Li, Zhong-Feng; Jin, Qiong-Hua Facile fabrication and characterization of rare earth complexes based on Keggin-type polyoxometalate with highly efficient activity for photocatalytic degradation of MO CrystEngComm, 2023, 25, 5851-5860
7247370	CIF	C30 H38 N2 O16 U2	P 1 21/n 1	19.7847; 10.1109; 35.7831 90; 90.6793; 90	7157.6	Kusumoto, Sotaro; Atoini, Youssef; Koide, Yoshihiro; Hayami, Shinya; Kim, Yang; Harrowfield, Jack; Thuéry, Pierre Ligand competition on uranyl ion: further examples of zwitterionic vs. anionic carboxylate coordination CrystEngComm, 2023, 25, 5748-5758
7247371	CIF	C34 H32 N2 O24 U4	P -1	11.6695; 12.5806; 14.2442 87.165; 88.3831; 84.6902	2079.07	Kusumoto, Sotaro; Atoini, Youssef; Koide, Yoshihiro; Hayami, Shinya; Kim, Yang; Harrowfield, Jack; Thuéry, Pierre Ligand competition on uranyl ion: further examples of zwitterionic vs. anionic carboxylate coordination CrystEngComm, 2023, 25, 5748-5758
7247372	CIF	C36 H24 N2 O16 U2	P -1	9.7035; 9.714; 10.6933 79.359; 75.201; 71.662	919.03	Kusumoto, Sotaro; Atoini, Youssef; Koide, Yoshihiro; Hayami, Shinya; Kim, Yang; Harrowfield, Jack; Thuéry, Pierre Ligand competition on uranyl ion: further examples of zwitterionic vs. anionic carboxylate coordination CrystEngComm, 2023, 25, 5748-5758
7247373	CIF	C72 H90 N8 O54 U5	P -1	11.3984; 11.401; 21.9898 88.8056; 79.8563; 60.8371	2449.37	Kusumoto, Sotaro; Atoini, Youssef; Koide, Yoshihiro; Hayami, Shinya; Kim, Yang; Harrowfield, Jack; Thuéry, Pierre Ligand competition on uranyl ion: further examples of zwitterionic vs. anionic carboxylate coordination CrystEngComm, 2023, 25, 5748-5758
7247374	CIF	C8 H8 N4 O4	P -1	7.0461; 7.5519; 9.8725 96.563; 102.071; 108.791	476.88	Romanenko, Galina V.; Fokin, Sergey V.; Tolstikov, Svyatoslav E.; Letyagin, Gleb A.; Ovcharenko, Victor I.; Strizhenko, Kirill V.; Sheremetev, Aleksei B. A co-crystal of heterobicyclic isomers as a product of the cyclocondensation reaction of 3,4-diaminofurazan with diethyl-2-oxosuccinate CrystEngComm, 2023, 25, 5413-5419
7247375	CIF	C8 H8 N4 O4	P c a 21	23.936; 5.1742; 7.7436 90; 90; 90	959.04	Romanenko, Galina V.; Fokin, Sergey V.; Tolstikov, Svyatoslav E.; Letyagin, Gleb A.; Ovcharenko, Victor I.; Strizhenko, Kirill V.; Sheremetev, Aleksei B. A co-crystal of heterobicyclic isomers as a product of the cyclocondensation reaction of 3,4-diaminofurazan with diethyl-2-oxosuccinate CrystEngComm, 2023, 25, 5413-5419
7247376	CIF	C8 H8 N4 O4	P -1	4.9852; 9.8017; 10.6338 67.729; 86.664; 83.011	477.23	Romanenko, Galina V.; Fokin, Sergey V.; Tolstikov, Svyatoslav E.; Letyagin, Gleb A.; Ovcharenko, Victor I.; Strizhenko, Kirill V.; Sheremetev, Aleksei B. A co-crystal of heterobicyclic isomers as a product of the cyclocondensation reaction of 3,4-diaminofurazan with diethyl-2-oxosuccinate CrystEngComm, 2023, 25, 5413-5419
7247393	CIF	C28 H42 Cu3 I5 N4	P -1	10.1442; 10.9745; 17.6401 86.956; 83.873; 88.591	1949.5	Mensah, Abraham; Chen, Wei-Min; Kweku, Ennin Vendish; Liu, Peng-Lai; Shao, Juan-Juan; Wang, Fang-Ming; Chen, Li-Zhuang Realizing luminescent from cuprous iodide complexes with high quantum yields by introducing planar aromatic groups and modification with halogen atoms on the ligand CrystEngComm, 2023, 25, 5722-5729
7247394	CIF	C26 H36 Cu2 F2 I4 N4	P 1 21/c 1	15.6992; 16.7737; 12.7912 90; 107.856; 90	3206.1	Mensah, Abraham; Chen, Wei-Min; Kweku, Ennin Vendish; Liu, Peng-Lai; Shao, Juan-Juan; Wang, Fang-Ming; Chen, Li-Zhuang Realizing luminescent from cuprous iodide complexes with high quantum yields by introducing planar aromatic groups and modification with halogen atoms on the ligand CrystEngComm, 2023, 25, 5722-5729
7247395	CIF	C26 H36 Br2 Cu2 I4 N4	P 1 21/c 1	16.3175; 16.9139; 12.8313 90; 107.318; 90	3380.8	Mensah, Abraham; Chen, Wei-Min; Kweku, Ennin Vendish; Liu, Peng-Lai; Shao, Juan-Juan; Wang, Fang-Ming; Chen, Li-Zhuang Realizing luminescent from cuprous iodide complexes with high quantum yields by introducing planar aromatic groups and modification with halogen atoms on the ligand CrystEngComm, 2023, 25, 5722-5729
7247396	CIF	C26 H36 Cu4 I8 N4	P -1	7.9774; 8.6192; 14.768 81.554; 85.562; 84.147	997.2	Mensah, Abraham; Chen, Wei-Min; Kweku, Ennin Vendish; Liu, Peng-Lai; Shao, Juan-Juan; Wang, Fang-Ming; Chen, Li-Zhuang Realizing luminescent from cuprous iodide complexes with high quantum yields by introducing planar aromatic groups and modification with halogen atoms on the ligand CrystEngComm, 2023, 25, 5722-5729
7247397	CIF	C26 H36 Cl2 Cu2 I4 N4	P 1 21/c 1	16.048; 16.8794; 12.8451 90; 107.618; 90	3316.29	Mensah, Abraham; Chen, Wei-Min; Kweku, Ennin Vendish; Liu, Peng-Lai; Shao, Juan-Juan; Wang, Fang-Ming; Chen, Li-Zhuang Realizing luminescent from cuprous iodide complexes with high quantum yields by introducing planar aromatic groups and modification with halogen atoms on the ligand CrystEngComm, 2023, 25, 5722-5729
7247398	CIF	C24 H12 O21 Yb5	P 1 21/c 1	9.82977; 22.43648; 13.79565 90; 108.608; 90	2883.51	Chamberlain, Thomas W.; Yasmine,; Coulthard, Claire T.; Clarkson, Guy J.; Degirmenci, Volkan; Krisnandi, Yuni K.; Walton, Richard I. Optimised synthesis and further structural diversity of ytterbium benzene-1,4-dicarboxylate MOFs CrystEngComm, 2023, 25, 5629-5640
7247399	CIF	C12 H12 O9 Yb	P -1	7.7973; 9.4775; 10.6851 68.823; 70.748; 74.995	686.3	Chamberlain, Thomas W.; Yasmine,; Coulthard, Claire T.; Clarkson, Guy J.; Degirmenci, Volkan; Krisnandi, Yuni K.; Walton, Richard I. Optimised synthesis and further structural diversity of ytterbium benzene-1,4-dicarboxylate MOFs CrystEngComm, 2023, 25, 5629-5640
7247400	CIF	C48 H36 O30 Yb4	P b c a	9.59605; 26.1011; 37.7873 90; 90; 90	9464.49	Chamberlain, Thomas W.; Yasmine,; Coulthard, Claire T.; Clarkson, Guy J.; Degirmenci, Volkan; Krisnandi, Yuni K.; Walton, Richard I. Optimised synthesis and further structural diversity of ytterbium benzene-1,4-dicarboxylate MOFs CrystEngComm, 2023, 25, 5629-5640
7247401	CIF	C22 H20 N2 O8 S	P 1 21/c 1	13.989; 7.878; 19.624 90; 101.67; 90	2118	Yang, Fengyi; Chen, Jiali; Wang, Junwen; Liu, Jinjian Five novel supramolecular assemblies constructed from the thiazolothiazole extended viologen moiety CrystEngComm, 2023, 25, 5461-5469
7247402	CIF	C19 H14 N2 O8 S	P -1	8.3923; 8.5678; 12.9934 79.779; 75.701; 78.675	879.5	Yang, Fengyi; Chen, Jiali; Wang, Junwen; Liu, Jinjian Five novel supramolecular assemblies constructed from the thiazolothiazole extended viologen moiety CrystEngComm, 2023, 25, 5461-5469
7247403	CIF	C18 H20 N3 O8 S	P -1	8.4052; 9.4814; 13.366 102.279; 106.083; 94.691	988.8	Yang, Fengyi; Chen, Jiali; Wang, Junwen; Liu, Jinjian Five novel supramolecular assemblies constructed from the thiazolothiazole extended viologen moiety CrystEngComm, 2023, 25, 5461-5469
7247404	CIF	C26 H28 N4 O13 S3	P -1	7.5645; 11.3096; 18.1129 95.837; 97.142; 99.33	1505.4	Yang, Fengyi; Chen, Jiali; Wang, Junwen; Liu, Jinjian Five novel supramolecular assemblies constructed from the thiazolothiazole extended viologen moiety CrystEngComm, 2023, 25, 5461-5469
7247405	CIF	C14 H13 N2 O5 S	P -1	5.6484; 8.1619; 15.8411 81.03; 85.54; 76.678	701.29	Yang, Fengyi; Chen, Jiali; Wang, Junwen; Liu, Jinjian Five novel supramolecular assemblies constructed from the thiazolothiazole extended viologen moiety CrystEngComm, 2023, 25, 5461-5469
7247406	CIF	C16 H42 Mo8 N40 O22	C 1 2/m 1	18.2829; 20.7; 10.448 90; 102.276; 90	3863.7	Lin, Rong-Yan; Dai, Ru-Dan; Dong, Xin; Zhou, Zhao-Hui Hexnuclear, octanuclear, dodecanuclear, and hexadecnuclear polyoxomolybdenum(v)-based porous materials for selective adsorption of gases CrystEngComm, 2023, 25, 5942-5950
7247407	CIF	C16 H88 Mo16 N32 Na8 O77	F d d d :2	14.99; 31.7213; 46.9852 90; 90; 90	22341.6	Lin, Rong-Yan; Dai, Ru-Dan; Dong, Xin; Zhou, Zhao-Hui Hexnuclear, octanuclear, dodecanuclear, and hexadecnuclear polyoxomolybdenum(v)-based porous materials for selective adsorption of gases CrystEngComm, 2023, 25, 5942-5950
7247408	CIF	C16 H47 Mo12 N32 Na4 O42	P -1	11.8391; 11.9219; 25.7883 98.134; 97.651; 91.857	3566.31	Lin, Rong-Yan; Dai, Ru-Dan; Dong, Xin; Zhou, Zhao-Hui Hexnuclear, octanuclear, dodecanuclear, and hexadecnuclear polyoxomolybdenum(v)-based porous materials for selective adsorption of gases CrystEngComm, 2023, 25, 5942-5950
7247409	CIF	C36 H31 Mo6 N18 O16	P -1	11.1739; 12.6845; 27.1349 83.745; 81.094; 84.215	3763.17	Lin, Rong-Yan; Dai, Ru-Dan; Dong, Xin; Zhou, Zhao-Hui Hexnuclear, octanuclear, dodecanuclear, and hexadecnuclear polyoxomolybdenum(v)-based porous materials for selective adsorption of gases CrystEngComm, 2023, 25, 5942-5950
7247410	CIF	C14 H22 N4 O11	C 1 2/c 1	18.5643; 15.172; 13.1988 90; 104.662; 90	3596.5	Yuan, Xin-Yue; Cheng, Yan; Liu, Jun; Sun, Qi-Lei; Xue, Fu-Min Six novel multicomponent systems of theobromine with carboxylic acids: crystallographic structures, solubility determination and DFT calculations CrystEngComm, 2023, 25, 5682-5696
7247411	CIF	C14 H14 N4 O7	P 1 21/c 1	7.9228; 6.33067; 29.1969 90; 95.122; 90	1458.57	Yuan, Xin-Yue; Cheng, Yan; Liu, Jun; Sun, Qi-Lei; Xue, Fu-Min Six novel multicomponent systems of theobromine with carboxylic acids: crystallographic structures, solubility determination and DFT calculations CrystEngComm, 2023, 25, 5682-5696
7247412	CIF	C14 H18 N4 O9	C 1 2/c 1	27.746; 6.6694; 17.362 90; 92.936; 90	3208.6	Yuan, Xin-Yue; Cheng, Yan; Liu, Jun; Sun, Qi-Lei; Xue, Fu-Min Six novel multicomponent systems of theobromine with carboxylic acids: crystallographic structures, solubility determination and DFT calculations CrystEngComm, 2023, 25, 5682-5696
7247413	CIF	C16 H16 N4 O5	P -1	8.8706; 9.1259; 11.3422 80.367; 69.633; 67.65	795.46	Yuan, Xin-Yue; Cheng, Yan; Liu, Jun; Sun, Qi-Lei; Xue, Fu-Min Six novel multicomponent systems of theobromine with carboxylic acids: crystallographic structures, solubility determination and DFT calculations CrystEngComm, 2023, 25, 5682-5696
7247415	CIF	C6 H7 N3 O4	P 1 21/c 1	15.9305; 7.0439; 15.4405 90; 116.292; 90	1553.38	Prohens, Rafel; Barbas, Rafael; de la Torre, Beatriz G.; Albericio, Fernando; Frontera, Antonio An experimental and computational investigation of the elusive anhydrous form of Oxyma-B CrystEngComm, 2023, 25, 5818-5826
7247418	CIF	C50 H64 Dy2 N22 O18 W	C 1 2/c 1	27.0713; 9.526; 24.0085 90; 93.82; 90	6177.6	Mao, Pan-Dong; Sun, Hui-Ying; Yan, Fei-Fei; Zhang, Shi-Hui; Li, Xin-Feng; Zhou, Ren-He; Zhang, Yi-Quan; Meng, Yin-Shan; Liu, Tao Dinuclear and trinuclear cyano-bridged {DyIIIMIV} (M = W, Mo) single-ion magnets supported by pentadentate Schiff-base ligands CrystEngComm, 2023, 25, 6030-6038
7247419	CIF	C50 H64 Dy2 Mo N22 O18	C 1 2/c 1	26.9939; 9.5351; 24.0996 90; 93.714; 90	6190	Mao, Pan-Dong; Sun, Hui-Ying; Yan, Fei-Fei; Zhang, Shi-Hui; Li, Xin-Feng; Zhou, Ren-He; Zhang, Yi-Quan; Meng, Yin-Shan; Liu, Tao Dinuclear and trinuclear cyano-bridged {DyIIIMIV} (M = W, Mo) single-ion magnets supported by pentadentate Schiff-base ligands CrystEngComm, 2023, 25, 6030-6038
7247420	CIF	C31 H39 Dy Mo N15 O16.5	P -1	10.5532; 11.6027; 18.7684 92.524; 95.871; 108.109	2165.8	Mao, Pan-Dong; Sun, Hui-Ying; Yan, Fei-Fei; Zhang, Shi-Hui; Li, Xin-Feng; Zhou, Ren-He; Zhang, Yi-Quan; Meng, Yin-Shan; Liu, Tao Dinuclear and trinuclear cyano-bridged {DyIIIMIV} (M = W, Mo) single-ion magnets supported by pentadentate Schiff-base ligands CrystEngComm, 2023, 25, 6030-6038
7247421	CIF	C29 H48 Dy N15 O16.5 W	P -1	10.4246; 11.7295; 18.732 93.031; 95.698; 108.135	2157.4	Mao, Pan-Dong; Sun, Hui-Ying; Yan, Fei-Fei; Zhang, Shi-Hui; Li, Xin-Feng; Zhou, Ren-He; Zhang, Yi-Quan; Meng, Yin-Shan; Liu, Tao Dinuclear and trinuclear cyano-bridged {DyIIIMIV} (M = W, Mo) single-ion magnets supported by pentadentate Schiff-base ligands CrystEngComm, 2023, 25, 6030-6038
7247422	CIF	C18 H21 Cd N3 O7 S	P 1 21/n 1	11.7573; 11.5545; 15.8209 90; 106.604; 90	2059.6	Wang, Xueyuan; Carrillo-Aravena, Eduardo; Wu, Yuandong; Mei, Dajiang; Wen, Shaoguo; Doert, Thomas Investigation of four Cd(ii) sulfonate complexes: crystal structure, Hirshfeld surface analysis, thermogravimetric and spectroscopic properties CrystEngComm, 2023, 25, 5673-5681
7247423	CIF	C23 H23 Cd N5 O7 S	P 1 21/n 1	11.5878; 17.7103; 13.2737 90; 114.676; 90	2475.3	Wang, Xueyuan; Carrillo-Aravena, Eduardo; Wu, Yuandong; Mei, Dajiang; Wen, Shaoguo; Doert, Thomas Investigation of four Cd(ii) sulfonate complexes: crystal structure, Hirshfeld surface analysis, thermogravimetric and spectroscopic properties CrystEngComm, 2023, 25, 5673-5681
7247424	CIF	C16 H22 Cd N4 O6 S4	P -1	5.73025; 8.1274; 12.86566 74.1108; 89.5736; 84.1958	573.204	Wang, Xueyuan; Carrillo-Aravena, Eduardo; Wu, Yuandong; Mei, Dajiang; Wen, Shaoguo; Doert, Thomas Investigation of four Cd(ii) sulfonate complexes: crystal structure, Hirshfeld surface analysis, thermogravimetric and spectroscopic properties CrystEngComm, 2023, 25, 5673-5681
7247425	CIF	C62 H68 Cd2 N14 O20 S2	P 1 21/c 1	7.364; 23.3599; 19.2032 90; 93.423; 90	3297.49	Wang, Xueyuan; Carrillo-Aravena, Eduardo; Wu, Yuandong; Mei, Dajiang; Wen, Shaoguo; Doert, Thomas Investigation of four Cd(ii) sulfonate complexes: crystal structure, Hirshfeld surface analysis, thermogravimetric and spectroscopic properties CrystEngComm, 2023, 25, 5673-5681
7247426	CIF	C34 H88 Dy2 Fe4 N10 O32	P -1	11.053; 11.22; 13.17 80.21; 80.56; 75.51	1546	Liu, Shujing; Zou, Chen; Wang, Hanjie; Chen, Sihuai; Yuan, Jun; Jia, Lihui Synthesis, structures, and magnetic properties of butterfly-shaped hexanuclear [FeIII4LnIII2] single-molecule magnets CrystEngComm, 2023, 25, 5893-5899
7247427	CIF	C34 H88 Fe4 N10 O32 Y2	P -1	10.8225; 11.1813; 12.9331 79.542; 79.911; 75.815	1478.02	Liu, Shujing; Zou, Chen; Wang, Hanjie; Chen, Sihuai; Yuan, Jun; Jia, Lihui Synthesis, structures, and magnetic properties of butterfly-shaped hexanuclear [FeIII4LnIII2] single-molecule magnets CrystEngComm, 2023, 25, 5893-5899
7247429	CIF	C29 H17 N S	P b c a	15.7355; 8.0029; 31.7701 90; 90; 90	4000.8	Xia, Zhou-An; Zhang, Xiangyu; Xi, Chang; Bai, Qing; Liu, Haichao; Zhang, Shi-Tong; Yang, Bing Constructing a pyrene-based dimer in a crystal by adjusting the steric hindrance over the pyrene plane CrystEngComm, 2023, 25, 5802-5809
7247430	CIF	C29 H17 N S	P 1 21/c 1	13.152; 14.0836; 12.0152 90; 115.009; 90	2016.88	Xia, Zhou-An; Zhang, Xiangyu; Xi, Chang; Bai, Qing; Liu, Haichao; Zhang, Shi-Tong; Yang, Bing Constructing a pyrene-based dimer in a crystal by adjusting the steric hindrance over the pyrene plane CrystEngComm, 2023, 25, 5802-5809
7247431	CIF	C29 H17 N S	P 21 21 21	7.731; 8.1036; 32.103 90; 90; 90	2011.2	Xia, Zhou-An; Zhang, Xiangyu; Xi, Chang; Bai, Qing; Liu, Haichao; Zhang, Shi-Tong; Yang, Bing Constructing a pyrene-based dimer in a crystal by adjusting the steric hindrance over the pyrene plane CrystEngComm, 2023, 25, 5802-5809
7247442	CIF	C18 H12 Cl2 N2 O	P 21 21 21	7.0782; 12.8899; 17.2503 90; 90; 90	1573.9	Dubey, Ritesh; Singh, Sandeep Dichlorosubstitution as a steering tool in hydrogen bonded cocrystals: the nature of rigid and flexible coformers in crystal structures CrystEngComm, 2023, 25, 5697-5705
7247443	CIF	C22 H16 Cl4 N2 O2	P 1 21/c 1	11.404; 12.721; 15.241 90; 109.811; 90	2080	Dubey, Ritesh; Singh, Sandeep Dichlorosubstitution as a steering tool in hydrogen bonded cocrystals: the nature of rigid and flexible coformers in crystal structures CrystEngComm, 2023, 25, 5697-5705
7247444	CIF	C18 H12 Cl2 N2 O	P 1 21/c 1	22.923; 11.7148; 11.64 90; 92.091; 90	3123.7	Dubey, Ritesh; Singh, Sandeep Dichlorosubstitution as a steering tool in hydrogen bonded cocrystals: the nature of rigid and flexible coformers in crystal structures CrystEngComm, 2023, 25, 5697-5705
7247445	CIF	C22 H16 Cl4 N2 O2	C 1 2/c 1	18.809; 3.8575; 29.184 90; 98.486; 90	2094.3	Dubey, Ritesh; Singh, Sandeep Dichlorosubstitution as a steering tool in hydrogen bonded cocrystals: the nature of rigid and flexible coformers in crystal structures CrystEngComm, 2023, 25, 5697-5705
7247446	CIF	C16 H12 Cl2 N2 O	P 1 21/c 1	10.5285; 7.097; 19.468 90; 99.747; 90	1433.7	Dubey, Ritesh; Singh, Sandeep Dichlorosubstitution as a steering tool in hydrogen bonded cocrystals: the nature of rigid and flexible coformers in crystal structures CrystEngComm, 2023, 25, 5697-5705
7247447	CIF	C22 H16 Cl4 N2 O2	P 1 21/n 1	10.3339; 7.2993; 14.544 90; 104.972; 90	1059.8	Dubey, Ritesh; Singh, Sandeep Dichlorosubstitution as a steering tool in hydrogen bonded cocrystals: the nature of rigid and flexible coformers in crystal structures CrystEngComm, 2023, 25, 5697-5705
7247448	CIF	C22 H16 Cl4 N2 O2	P 1 21/c 1	5.789; 14.243; 12.602 90; 98.64; 90	1027	Dubey, Ritesh; Singh, Sandeep Dichlorosubstitution as a steering tool in hydrogen bonded cocrystals: the nature of rigid and flexible coformers in crystal structures CrystEngComm, 2023, 25, 5697-5705
7247449	CIF	C18 H12 Cl2 N2 O	P 1 21/n 1	10.5269; 12.0193; 13.2546 90; 113.08; 90	1542.8	Dubey, Ritesh; Singh, Sandeep Dichlorosubstitution as a steering tool in hydrogen bonded cocrystals: the nature of rigid and flexible coformers in crystal structures CrystEngComm, 2023, 25, 5697-5705
7247450	CIF	C22 H16 Cl4 N2 O2	P -1	7.4028; 7.9597; 9.349 100.674; 94.021; 100.27	529.64	Dubey, Ritesh; Singh, Sandeep Dichlorosubstitution as a steering tool in hydrogen bonded cocrystals: the nature of rigid and flexible coformers in crystal structures CrystEngComm, 2023, 25, 5697-5705
7247451	CIF	C18 H12 Cl2 N2 O	P 1 21 1	3.8427; 17.047; 11.6457 90; 97.752; 90	755.9	Dubey, Ritesh; Singh, Sandeep Dichlorosubstitution as a steering tool in hydrogen bonded cocrystals: the nature of rigid and flexible coformers in crystal structures CrystEngComm, 2023, 25, 5697-5705
7247452	CIF	C24 H16 Cl4 N2 O2	P -1	7.9894; 9.4955; 15.762 85.572; 79.226; 71.653	1114.8	Dubey, Ritesh; Singh, Sandeep Dichlorosubstitution as a steering tool in hydrogen bonded cocrystals: the nature of rigid and flexible coformers in crystal structures CrystEngComm, 2023, 25, 5697-5705
7247453	CIF	C22 H16 Cl4 N2 O2	P 43 21 2	8.0784; 8.0784; 32.831 90; 90; 90	2142.6	Dubey, Ritesh; Singh, Sandeep Dichlorosubstitution as a steering tool in hydrogen bonded cocrystals: the nature of rigid and flexible coformers in crystal structures CrystEngComm, 2023, 25, 5697-5705
7247454	CIF	C18 H12 Cl2 N2 O	P -1	8.127; 8.5365; 11.656 75.042; 86.122; 78.916	766.5	Dubey, Ritesh; Singh, Sandeep Dichlorosubstitution as a steering tool in hydrogen bonded cocrystals: the nature of rigid and flexible coformers in crystal structures CrystEngComm, 2023, 25, 5697-5705
7247455	CIF	C25 H24 Mn N4 O5	C 1 2/c 1	20.8278; 14.7244; 7.739 90; 93.831; 90	2368.07	Smernik, Josephine F.; Gimeno-Fonquernie, Pol; Albalad, Jorge; Jones, Tyla S.; Young, Rosemary J.; Champness, Neil R.; Doonan, Christian J.; Evans, Jack D.; Sumby, Christopher J. Understanding the structural landscape of Mn-based MOFs formed with hinged pyrazole carboxylate linkers CrystEngComm, 2023, 25, 6539-6548
7247456	CIF	C10.5 H9 Mn0.5 N2 O3	I 1 2/a 1	20.3665; 4.5514; 21.1136 90; 101.761; 90	1916.06	Smernik, Josephine F.; Gimeno-Fonquernie, Pol; Albalad, Jorge; Jones, Tyla S.; Young, Rosemary J.; Champness, Neil R.; Doonan, Christian J.; Evans, Jack D.; Sumby, Christopher J. Understanding the structural landscape of Mn-based MOFs formed with hinged pyrazole carboxylate linkers CrystEngComm, 2023, 25, 6539-6548
7247457	CIF	C24 H29 Mn2 N10 O13	P n m a	22.1459; 12.0673; 12.5517 90; 90; 90	3354.33	Smernik, Josephine F.; Gimeno-Fonquernie, Pol; Albalad, Jorge; Jones, Tyla S.; Young, Rosemary J.; Champness, Neil R.; Doonan, Christian J.; Evans, Jack D.; Sumby, Christopher J. Understanding the structural landscape of Mn-based MOFs formed with hinged pyrazole carboxylate linkers CrystEngComm, 2023, 25, 6539-6548
7247458	CIF	C9 H11 Mn N4 O6.5	P n n m	11.4647; 15.947; 13.4871 90; 90; 90	2465.81	Smernik, Josephine F.; Gimeno-Fonquernie, Pol; Albalad, Jorge; Jones, Tyla S.; Young, Rosemary J.; Champness, Neil R.; Doonan, Christian J.; Evans, Jack D.; Sumby, Christopher J. Understanding the structural landscape of Mn-based MOFs formed with hinged pyrazole carboxylate linkers CrystEngComm, 2023, 25, 6539-6548
7247459	CIF	C9 H10 Mn N4 O6	C 1 c 1	14.414; 10.48; 7.74 90; 105.64; 90	1125.9	Smernik, Josephine F.; Gimeno-Fonquernie, Pol; Albalad, Jorge; Jones, Tyla S.; Young, Rosemary J.; Champness, Neil R.; Doonan, Christian J.; Evans, Jack D.; Sumby, Christopher J. Understanding the structural landscape of Mn-based MOFs formed with hinged pyrazole carboxylate linkers CrystEngComm, 2023, 25, 6539-6548
7247460	CIF	C21 H23 Mn2 N9 O11	C 1 m 1	12.318; 12.9645; 9.0482 90; 107.377; 90	1379	Smernik, Josephine F.; Gimeno-Fonquernie, Pol; Albalad, Jorge; Jones, Tyla S.; Young, Rosemary J.; Champness, Neil R.; Doonan, Christian J.; Evans, Jack D.; Sumby, Christopher J. Understanding the structural landscape of Mn-based MOFs formed with hinged pyrazole carboxylate linkers CrystEngComm, 2023, 25, 6539-6548
7247461	CIF	C23.5 H18.83 Mn N4.83 O4.83	C 1 2/c 1	23.2881; 10.4868; 24.8587 90; 114.461; 90	5526	Smernik, Josephine F.; Gimeno-Fonquernie, Pol; Albalad, Jorge; Jones, Tyla S.; Young, Rosemary J.; Champness, Neil R.; Doonan, Christian J.; Evans, Jack D.; Sumby, Christopher J. Understanding the structural landscape of Mn-based MOFs formed with hinged pyrazole carboxylate linkers CrystEngComm, 2023, 25, 6539-6548
7247462	CIF	C26 H36 Mn2 N8 O12	P 1 21/c 1	9.1364; 16.5273; 21.5295 90; 101.798; 90	3182.28	Smernik, Josephine F.; Gimeno-Fonquernie, Pol; Albalad, Jorge; Jones, Tyla S.; Young, Rosemary J.; Champness, Neil R.; Doonan, Christian J.; Evans, Jack D.; Sumby, Christopher J. Understanding the structural landscape of Mn-based MOFs formed with hinged pyrazole carboxylate linkers CrystEngComm, 2023, 25, 6539-6548
7247463	CIF	Cl4 Co7.38 Na O16 P4	I -4 2 m	9.115; 9.115; 10.2056 90; 90; 90	847.91	Yakubovich, Olga; Kiriukhina, Galina; Simonov, Sergei; Volkov, Anatoliy; Dimitrova, Olga NaCo7.38(PO4)4Cl4 in a series of homeotype compounds with stable cationic substructures derived from the sulphohalite archetype CrystEngComm, 2023, 25, 6006-6016
7247464	CIF	C16 H11 N7 O11	P 1 21/c 1	26.806; 7.7681; 20.357 90; 112.251; 90	3923.3	Zhang, Rongzheng; Xu, Yuangang; Yang, Feng; Wang, Pengcheng; Lin, Qiuhan; Huang, Hui; Lu, Ming Synthesis, characterization and properties of new heat resistant energetic materials based on two C–C bridged pyrazole and benzene skeletons CrystEngComm, 2023, 25, 5827-5833
7247465	CIF	C14 H12 N10 O14	P -1	6.2299; 7.4168; 12.7696 103.819; 90.179; 95.701	569.9	Zhang, Rongzheng; Xu, Yuangang; Yang, Feng; Wang, Pengcheng; Lin, Qiuhan; Huang, Hui; Lu, Ming Synthesis, characterization and properties of new heat resistant energetic materials based on two C–C bridged pyrazole and benzene skeletons CrystEngComm, 2023, 25, 5827-5833
7247467	CIF	C10 H10 O3	P 1 21/c 1	15.3694; 5.216; 22.3953 90; 97.797; 90	1778.76	Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941
7247468	CIF	C10 H10 O3	P 1 21/n 1	12.7762; 5.23515; 14.4736 90; 111.409; 90	901.27	Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941
7247469	CIF	C10 H10 O3	P 1 21/n 1	12.8223; 5.245; 14.5064 90; 111.569; 90	907.28	Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941
7247470	CIF	C10 H10 O3	P 1 21/n 1	12.8072; 5.24245; 14.4951 90; 111.513; 90	905.42	Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941
7247471	CIF	C10 H10 O3	P 1 21/n 1	12.747; 5.22886; 14.4507 90; 111.302; 90	897.37	Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941
7247472	CIF	C10 H10 O3	P 1 21/n 1	12.7632; 5.23201; 14.4635 90; 111.364; 90	899.46	Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941
7247473	CIF	C10 H10 O3	P 1 21/c 1	15.4013; 5.2236; 22.451 90; 97.71; 90	1789.86	Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941
7247474	CIF	C10 H10 O3	P 1 21/c 1	15.3811; 5.21845; 22.4123 90; 97.767; 90	1782.43	Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941
7247475	CIF	C10 H10 O3	P 1 21/c 1	15.3909; 5.22159; 22.4298 90; 97.735; 90	1786.17	Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941
7247476	CIF	C10 H10 O3	P 1 21/n 1	12.7932; 5.23468; 14.4811 90; 111.423; 90	902.77	Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941
7247477	CIF	C10 H10 O3	P 1 21/c 1	15.4043; 5.2267; 22.4631 90; 97.697; 90	1792.29	Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941
7247478	CIF	C7 H8 O6	P -1	7.1034; 7.4941; 15.5567 100.593; 91.274; 111.564	753.39	Ghouari, Nasreddine; Benali-Cherif, Rim; Takouachet, Radhwane; Falek, Wahiba; Missaoui, Djallila; Rahmouni, Ali; Bendeif, El-Eulmi; Benali-Cherif, Nourredine Crystal engineering of a new pharmaceutical polymorph of gallic acid monohydrate: a structural comparative study and chemical computational quantum investigations CrystEngComm, 2023, 25, 6279-6290
7247481	CIF	C36 H42 N8 O6	P 1 21/n 1	13.6491; 16.3995; 15.8476 90; 102.302; 90	3465.8	Cai, Zhen-an; Du, Jing; Huang, Tiefan; Ding, Yanjun; Wu, Mingzai Chloroform-selective vapochromic behavior based on crystal-state host–guest complexation of an organic cage CrystEngComm, 2023, 25, 5778-5781
7247482	CIF	C38 H44 Cl6 N8 O6	I 1 2/a 1	16.4758; 14.6068; 19.2419 90; 114.749; 90	4205.4	Cai, Zhen-an; Du, Jing; Huang, Tiefan; Ding, Yanjun; Wu, Mingzai Chloroform-selective vapochromic behavior based on crystal-state host–guest complexation of an organic cage CrystEngComm, 2023, 25, 5778-5781
7247493	CIF	C40 H50 Ag3 Cl4 F18 N2 P3 S8	P b c m	10.9437; 21.7335; 25.2207 90; 90; 90	5998.61	Kim, Seulgi; Lee, Shim Sung; Kim, Joon Rae; Lee, Eunji Assembling silver(i) coordination polymers of an NS4-macrocycle via an endo/exocyclic coordination mode CrystEngComm, 2023, 25, 6096-6101
7247494	CIF	C25 H31 Ag2 F6 N O6 S4	P 1 21 1	11.5778; 12.0547; 12.4212 90; 111.23; 90	1615.94	Kim, Seulgi; Lee, Shim Sung; Kim, Joon Rae; Lee, Eunji Assembling silver(i) coordination polymers of an NS4-macrocycle via an endo/exocyclic coordination mode CrystEngComm, 2023, 25, 6096-6101
7247495	CIF	C43 H48 Ag4 Cl2 F12 N2 O12 S12	C 1 2/c 1	24.3861; 10.5716; 24.9876 90; 106.3; 90	6182.9	Kim, Seulgi; Lee, Shim Sung; Kim, Joon Rae; Lee, Eunji Assembling silver(i) coordination polymers of an NS4-macrocycle via an endo/exocyclic coordination mode CrystEngComm, 2023, 25, 6096-6101
7247514	CIF	C26 H15 N O	P 1 21/c 1	7.687; 16.132; 14.951 90; 100.35; 90	1823.9	Ravi, Sasikala; Priyadharshini, Prakash; Karthikeyan, Subramanian; Pannipara, Mehboobali; Al-Sehemi, Abdullah G.; Madhu, Vedichi; Moon, Dohyun; Anthony, Savarimuthu Philip Anthracene–naphthylacetonitrile fluorescent isomers and Cl/H substituent dependent molecular packing, solid-state fluorescence and mechanofluorochromism CrystEngComm, 2023, 25, 6303-6309
7247515	CIF	C54 H33 Cl N2	P n a 21	16.899; 5.502; 41.337 90; 90; 90	3843.4	Ravi, Sasikala; Priyadharshini, Prakash; Karthikeyan, Subramanian; Pannipara, Mehboobali; Al-Sehemi, Abdullah G.; Madhu, Vedichi; Moon, Dohyun; Anthony, Savarimuthu Philip Anthracene–naphthylacetonitrile fluorescent isomers and Cl/H substituent dependent molecular packing, solid-state fluorescence and mechanofluorochromism CrystEngComm, 2023, 25, 6303-6309
7247516	CIF	C27 H17 N	P 1 21/c 1	20.818; 5.388; 17.241 90; 107.1; 90	1848.4	Ravi, Sasikala; Priyadharshini, Prakash; Karthikeyan, Subramanian; Pannipara, Mehboobali; Al-Sehemi, Abdullah G.; Madhu, Vedichi; Moon, Dohyun; Anthony, Savarimuthu Philip Anthracene–naphthylacetonitrile fluorescent isomers and Cl/H substituent dependent molecular packing, solid-state fluorescence and mechanofluorochromism CrystEngComm, 2023, 25, 6303-6309
7247517	CIF	C33 H35 N5 O4	P -1	7.1203; 12.9924; 16.795 90.201; 98.985; 98.48	1517.3	Kang, Yanlei; Chen, Jiahui; Hu, Xiurong; Jiang, Yunliang; Li, Zhong A cocrystal prediction method of graph neural networks based on molecular spatial information and global attention CrystEngComm, 2023, 25, 6405-6415
7247520	CIF	C23 H19 F N2 O11	P -1	9.231; 11.1587; 11.8072 109.53; 108.436; 100.043	1032.67	Zhang, Min; Gu, Dai-Lin; Zhen, Jian-Feng; Lu, Tong-Bu; Dai, Xia-Lin; Chen, Jia-Mei A novel drug–drug cocrystal of tegafur and myricetin: optimized properties of dissolution and tabletability CrystEngComm, 2023, 25, 6171-6179
7247534	CIF	C15 H16 I N2 O2	P 1 21/c 1	8.4502; 21.4984; 8.7348 90; 105.103; 90	1532	Shurikov, Matvey K.; Tretyakov, Evgeny V.; Petunin, Pavel V.; Votkina, Darya E.; Romanenko, Galina V.; Bogomyakov, Artem S.; Burguera, Sergi; Frontera, Antonio; Kukushkin, Vadim Yu.; Postnikov, Pavel S. Self-assembly of iodoacetylenyl-substituted nitronyl nitroxides via halogen bonding CrystEngComm, 2023, 25, 6152-6161
7247535	CIF	C15 H16 I N2 O2	P -1	9.7329; 12.393; 14.382 78.384; 72.269; 72.195	1562	Shurikov, Matvey K.; Tretyakov, Evgeny V.; Petunin, Pavel V.; Votkina, Darya E.; Romanenko, Galina V.; Bogomyakov, Artem S.; Burguera, Sergi; Frontera, Antonio; Kukushkin, Vadim Yu.; Postnikov, Pavel S. Self-assembly of iodoacetylenyl-substituted nitronyl nitroxides via halogen bonding CrystEngComm, 2023, 25, 6152-6161
7247536	CIF	C54 H46 N4	P -1	9.0392; 9.0518; 13.7313 76.202; 74.883; 67.225	988.05	Barton, Benita; Caira, Mino R.; Trollip, Danica B.; Hosten, Eric C. The behaviour of tricyclic fused host systems comprising seven-membered B-rings in mixed pyridines CrystEngComm, 2023, 25, 6317-6328
7247537	CIF	C54 H50 N4	P -1	8.9716; 9.2886; 13.8221 75.212; 76.005; 66.684	1009.8	Barton, Benita; Caira, Mino R.; Trollip, Danica B.; Hosten, Eric C. The behaviour of tricyclic fused host systems comprising seven-membered B-rings in mixed pyridines CrystEngComm, 2023, 25, 6317-6328
7247538	CIF	C56 H50 N4	P -1	8.7173; 11.2718; 12.6826 108.163; 105.764; 104.337	1061.65	Barton, Benita; Caira, Mino R.; Trollip, Danica B.; Hosten, Eric C. The behaviour of tricyclic fused host systems comprising seven-membered B-rings in mixed pyridines CrystEngComm, 2023, 25, 6317-6328
7247539	CIF	C106 H101 N7	P 1 21/c 1	9.0013; 26.7346; 9.0416 90; 114.066; 90	1986.7	Barton, Benita; Caira, Mino R.; Trollip, Danica B.; Hosten, Eric C. The behaviour of tricyclic fused host systems comprising seven-membered B-rings in mixed pyridines CrystEngComm, 2023, 25, 6317-6328
7247540	CIF	C56 H50 N4	P -1	8.9471; 9.974; 13.4375 73.488; 75.543; 74.301	1087.2	Barton, Benita; Caira, Mino R.; Trollip, Danica B.; Hosten, Eric C. The behaviour of tricyclic fused host systems comprising seven-membered B-rings in mixed pyridines CrystEngComm, 2023, 25, 6317-6328
7247541	CIF	C10 H12 B F O4 Si	P 1 21/n 1	13.3215; 6.9213; 13.3412 90; 105.928; 90	1182.9	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247542	CIF	C9 H10 B F3 O2 Si	P 1 21/c 1	8.3772; 11.1912; 12.2672 90; 102.988; 90	1120.64	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247543	CIF	C9 H9 B F N O2 Si	P 1 21/c 1	9.9043; 9.509; 12.4382 90; 108.389; 90	1111.61	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247544	CIF	C9 H10 B F O3 Si	P 1 21/m 1	7.5415; 6.9154; 10.0942 90; 95.474; 90	524.04	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247545	CIF	C8 H10 B Cl O2 Si	P 1 21/n 1	14.5174; 10.1711; 14.6098 90; 95.774; 90	2146.31	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247546	CIF	C9 H10 B N O2 Si	P 1 21/c 1	13.6654; 18.404; 8.4758 90; 96.021; 90	2119.89	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247547	CIF	C8 H10 B F O2 Si	P n a 21	8.9458; 10.0166; 25.8341 90; 90; 90	2314.9	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247548	CIF	C9 H10 B F3 O2 Si	P 1 21/n 1	14.0599; 10.9765; 14.9951 90; 94.876; 90	2305.8	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247549	CIF	C11 H18 B2 O5 Si	P 1 21/c 1	7.0678; 16.2162; 12.8481 90; 97.58; 90	1459.69	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247550	CIF	C8 H10 B Br O2 Si	I 41/a :2	15.6371; 15.6371; 17.646 90; 90; 90	4314.78	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247551	CIF	C8 H10 B Cl O2 Si	I 41/a :2	15.507; 15.507; 17.3326 90; 90; 90	4167.92	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247552	CIF	C9 H11 B O3 Si	I 41/a :2	15.5827; 15.5827; 17.2392 90; 90; 90	4186.03	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247553	CIF	C8 H9 B Cl2 O2 Si	P 1 21/n 1	12.917; 9.3267; 18.3757 90; 91.43; 90	2213.09	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247554	CIF	C8 H9 B F2 O2 Si	P -1	7.0164; 12.3417; 18.5513 93.405; 93.926; 105.818	1536.87	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247555	CIF	C8 H10 B F O2 Si	P 1 21/n 1	8.5329; 17.0749; 13.9049 90; 101.787; 90	1983.2	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247556	CIF	C9 H9 B F2 O3 Si	P -1	6.9101; 8.4399; 10.1501 86.142; 72.322; 70.59	531.58	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247557	CIF	C8 H9 B F2 O2 Si	P 1 21/n 1	14.4016; 8.5877; 25.338 90; 95.665; 90	3118.4	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247558	CIF	C8 H10 B I O2 Si	P b c a	6.6288; 11.6079; 29.9883 90; 90; 90	2307.49	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247559	CIF	C11 H19 B O2 Si2	P -1	8.616; 9.8164; 17.2931 103.181; 93.671; 100.986	1389.12	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247560	CIF	C9 H10 B F3 O2 Si	I 41/a :2	15.8197; 15.8197; 18.3035 90; 90; 90	4580.69	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247561	CIF	C8 H9 B F2 O2 Si	P 1 21/c 1	8.3266; 6.6782; 18.9086 90; 96.84; 90	1043.96	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247562	CIF	C8 H10 B F O2 Si	I 41/a :2	15.3391; 15.3391; 16.9322 90; 90; 90	3983.94	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247563	CIF	C11 H15 B O4 Si	P 1 21/n 1	11.1355; 10.6673; 12.051 90; 112.31; 90	1324.3	Durka, Krzysztof; Zuba, Adam; Marek-Urban, Paulina H.; Nowicki, Krzysztof; Drapała, Jakub; Woźniak, Krzysztof; Luliński, Sergiusz Exploring the effect of substitution patterns on the symmetry of hydrogen-bonded supramolecular motifs in functionalized benzosiloxaboroles CrystEngComm, 2023, 25, 6329-6342
7247564	CIF	C17 H16 Mn0.5 N4 O3	P -1	7.9293; 8.574; 11.9825 81.591; 88.173; 89.232	805.44	Das, Chhatan; Debnath, Subhrajyoti; Patel, Vishwas D.; Gupta, Dhritiman; Banerjee, Anjan; Mahata, Partha Differential supercapacitor and Schottky diode behaviours in two new isostructural coordination polymers based on redox active metal ions CrystEngComm, 2023, 25, 6343-6353
7247565	CIF	C17 H16 Fe0.5 N4 O3	P -1	7.9266; 8.5888; 11.8991 82.016; 87.908; 89.364	801.69	Das, Chhatan; Debnath, Subhrajyoti; Patel, Vishwas D.; Gupta, Dhritiman; Banerjee, Anjan; Mahata, Partha Differential supercapacitor and Schottky diode behaviours in two new isostructural coordination polymers based on redox active metal ions CrystEngComm, 2023, 25, 6343-6353
7247566	CIF	As Br2 La3 S5	C 1 c 1	22.3092; 7.1387; 7.1638 90; 98.471; 90	1128.45	Cicirello, Andrea; Swindle, Andrew; Wang, Jian Visualizing the alignment of lone pair electrons in La3AsS5Br2 and La5As2S9Cl3 to form an acentric or centrosymmetric structure CrystEngComm, 2023, 25, 6354-6360
7247567	CIF	As2 Cl3 La5 S9	P b c m	7.0472; 7.1152; 37.1137 90; 90; 90	1860.96	Cicirello, Andrea; Swindle, Andrew; Wang, Jian Visualizing the alignment of lone pair electrons in La3AsS5Br2 and La5As2S9Cl3 to form an acentric or centrosymmetric structure CrystEngComm, 2023, 25, 6354-6360
7247568	CIF	C45 H63 Cu3 N6 O16 P	P 63	19.794; 19.794; 9.0285 90; 90; 120	3063.47	Zhou, Mi; Wang, Yujiang; Yuan, Guoyuan; Ju, Zhanfeng; Yuan, Daqiang Synthesis and characterization of two metallo-hydrogen-bonded organic frameworks with diverse structures and properties CrystEngComm, 2023, 25, 6132-6136
7247569	CIF	C45 H69 Cu3 N6 O19 P	F 41 3 2	37.4254; 37.4254; 37.4254 90; 90; 90	52420.3	Zhou, Mi; Wang, Yujiang; Yuan, Guoyuan; Ju, Zhanfeng; Yuan, Daqiang Synthesis and characterization of two metallo-hydrogen-bonded organic frameworks with diverse structures and properties CrystEngComm, 2023, 25, 6132-6136
7247577	CIF	C31 H19 N5 O4 Zn	P -1	10.807; 11.9118; 12.0215 118.315; 98.197; 98.075	1309.44	Li, Ya-Ping; Zhang, Jian-Hua; Zhang, Xiao-Xia; Liu, Sui-Jun 2D → 3D polycatenated Zn(ii) metal–organic framework with good chemical stability as a fluorescent sensor toward salicylaldehyde, acetylacetone and H2PO4− CrystEngComm, 2023, 25, 6424-6433
7247579	CIF	C15 H14 N2 O6	P 1 21/n 1	4.83768; 14.8178; 20.0275 90; 95.964; 90	1427.88	Sobczak, Paulina; Sierański, Tomasz; Świątkowski, Marcin; Trzęsowska-Kruszyńska, Agata New Schiff base salts as sources of blue and green light in the solid state: the role of the anion and protonation CrystEngComm, 2023, 25, 6185-6193
7247580	CIF	C15 H16 Br N O4	P 1 21/c 1	4.7204; 21.155; 15.1364 90; 92.616; 90	1509.95	Sobczak, Paulina; Sierański, Tomasz; Świątkowski, Marcin; Trzęsowska-Kruszyńska, Agata New Schiff base salts as sources of blue and green light in the solid state: the role of the anion and protonation CrystEngComm, 2023, 25, 6185-6193
7247581	CIF	C15 H15 N O7 S	P 1 c 1	4.4714; 9.3275; 17.7797 90; 90.109; 90	741.54	Sobczak, Paulina; Sierański, Tomasz; Świątkowski, Marcin; Trzęsowska-Kruszyńska, Agata New Schiff base salts as sources of blue and green light in the solid state: the role of the anion and protonation CrystEngComm, 2023, 25, 6185-6193
7247582	CIF	C15 H16 Cl N O4	P 1 21/c 1	4.7037; 20.9656; 14.8427 90; 92.196; 90	1462.65	Sobczak, Paulina; Sierański, Tomasz; Świątkowski, Marcin; Trzęsowska-Kruszyńska, Agata New Schiff base salts as sources of blue and green light in the solid state: the role of the anion and protonation CrystEngComm, 2023, 25, 6185-6193
7247583	CIF	C15 H16 N O7 P	P 1 21/c 1	7.9912; 21.7863; 9.0403 90; 100.091; 90	1549.56	Sobczak, Paulina; Sierański, Tomasz; Świątkowski, Marcin; Trzęsowska-Kruszyńska, Agata New Schiff base salts as sources of blue and green light in the solid state: the role of the anion and protonation CrystEngComm, 2023, 25, 6185-6193
7247584	CIF	C15 H13 N O3	P -1	3.89223; 10.76523; 15.40737 109.037; 94.011; 90.8565	608.291	Sobczak, Paulina; Sierański, Tomasz; Świątkowski, Marcin; Trzęsowska-Kruszyńska, Agata New Schiff base salts as sources of blue and green light in the solid state: the role of the anion and protonation CrystEngComm, 2023, 25, 6185-6193
7247585	CIF	C15 H13 N O3	P 1 21/c 1	3.82566; 15.0716; 21.1995 90; 92.4431; 90	1221.23	Sobczak, Paulina; Sierański, Tomasz; Świątkowski, Marcin; Trzęsowska-Kruszyńska, Agata New Schiff base salts as sources of blue and green light in the solid state: the role of the anion and protonation CrystEngComm, 2023, 25, 6185-6193
7247591	CIF	C25 H28 N2 O7	P -1	6.9004; 10.5029; 15.8453 95.066; 92.516; 100.761	1121.6	Kawahata, Masatoshi; Yamamoto, Haruka; Tominaga, Masahide; Yamaguchi, Kentaro Multiple intermolecular interactions in guest inclusion by acyclic host compounds CrystEngComm, 2023, 25, 6137-6143
7247592	CIF	C25 H28 N2 O8	P -1	7.0715; 10.4603; 15.71 95.12; 94.102; 99.743	1136.3	Kawahata, Masatoshi; Yamamoto, Haruka; Tominaga, Masahide; Yamaguchi, Kentaro Multiple intermolecular interactions in guest inclusion by acyclic host compounds CrystEngComm, 2023, 25, 6137-6143
7247593	CIF	C26 H30 N2 O7	P -1	7.0766; 10.505; 15.939 95.513; 93.85; 100.486	1155.4	Kawahata, Masatoshi; Yamamoto, Haruka; Tominaga, Masahide; Yamaguchi, Kentaro Multiple intermolecular interactions in guest inclusion by acyclic host compounds CrystEngComm, 2023, 25, 6137-6143
7247594	CIF	C22 H22 N2 O6	P 1 21/n 1	10.8801; 12.8327; 13.3727 90; 93.49; 90	1863.6	Kawahata, Masatoshi; Yamamoto, Haruka; Tominaga, Masahide; Yamaguchi, Kentaro Multiple intermolecular interactions in guest inclusion by acyclic host compounds CrystEngComm, 2023, 25, 6137-6143
7247595	CIF	C22 H22 N2 O6	C m c m	6.6173; 13.6049; 20.3294 90; 90; 90	1830.2	Kawahata, Masatoshi; Yamamoto, Haruka; Tominaga, Masahide; Yamaguchi, Kentaro Multiple intermolecular interactions in guest inclusion by acyclic host compounds CrystEngComm, 2023, 25, 6137-6143
7247596	CIF	C26 H30 N2 O6	P -1	7.1643; 9.8755; 17.073 84.131; 85.474; 72.254	1143	Kawahata, Masatoshi; Yamamoto, Haruka; Tominaga, Masahide; Yamaguchi, Kentaro Multiple intermolecular interactions in guest inclusion by acyclic host compounds CrystEngComm, 2023, 25, 6137-6143
7247597	CIF	C18 H36 Cl2 Co N12 O14	P 1 21/c 1	9.7285; 9.8676; 16.7911 90; 97.648; 90	1597.6	Kuang, Baolong; Wang, Tingwei; Zhang, Chao; Zhang, Han; Lu, Zujia; Xie, Zhiming; Xu, Meiqi; Yi, Zhenxin; Zhang, Jianguo 2-Imidazolidone metal complexes: increased hydrogen bonds and fused ring ligand ratio to be insensitive CrystEngComm, 2023, 25, 6449-6454
7247598	CIF	C12 H24 Cl2 Cu N8 O12	P -1	7.4339; 8.4275; 9.0714 87.583; 78.69; 77.157	543.34	Kuang, Baolong; Wang, Tingwei; Zhang, Chao; Zhang, Han; Lu, Zujia; Xie, Zhiming; Xu, Meiqi; Yi, Zhenxin; Zhang, Jianguo 2-Imidazolidone metal complexes: increased hydrogen bonds and fused ring ligand ratio to be insensitive CrystEngComm, 2023, 25, 6449-6454
7247599	CIF	C49 H47 F6 Fe	P 1 21/c 1	11.3155; 17.9907; 20.6727 90; 98.456; 90	4162.67	Akram, Sehrish; Mehmood, Arshad; Noureen, Sajida; Ahmed, Maqsood In the pursuit of a ‘disappearing’ anhydrous phase of the antipyrine–dipicolinic acid (ANT–DPA) co-crystal: explained through relative stability and charge density analyses CrystEngComm, 2023, 25, 6478-6488
7247600	CIF	C18 H19 N3 O6	C 1 2/c 1	18.4087; 8.0394; 23.69 90; 91.284; 90	3505.1	Akram, Sehrish; Mehmood, Arshad; Noureen, Sajida; Ahmed, Maqsood In the pursuit of a ‘disappearing’ anhydrous phase of the antipyrine–dipicolinic acid (ANT–DPA) co-crystal: explained through relative stability and charge density analyses CrystEngComm, 2023, 25, 6478-6488
7247601	CIF	C30 H44 N2 O2	P -1	6.447; 10.416; 11.367 82.665; 87.026; 72.301	721.2	Manoharan, Deepak; Ahmad, Shamim; Tothadi, Srinu; Emmerling, Franziska; Bhattacharya, Biswajit; Ghosh, Soumyajit Linker size dependent mechanical properties of di-imine based molecular crystals CrystEngComm, 2023, 25, 6416-6423
7247602	CIF	C34 H52 N2 O2	P -1	10.1433; 11.0854; 15.0978 87.297; 78.914; 89.006	1664	Manoharan, Deepak; Ahmad, Shamim; Tothadi, Srinu; Emmerling, Franziska; Bhattacharya, Biswajit; Ghosh, Soumyajit Linker size dependent mechanical properties of di-imine based molecular crystals CrystEngComm, 2023, 25, 6416-6423
7247603	CIF	C32 H48 N2 O2	C 1 2/c 1	18.8769; 6.1559; 26.9215 90; 106.511; 90	2999.4	Manoharan, Deepak; Ahmad, Shamim; Tothadi, Srinu; Emmerling, Franziska; Bhattacharya, Biswajit; Ghosh, Soumyajit Linker size dependent mechanical properties of di-imine based molecular crystals CrystEngComm, 2023, 25, 6416-6423
7247604	CIF	C33 H50 N2 O2	P 1 21/c 1	10.9128; 10.0522; 29.338 90; 90.55; 90	3218.2	Manoharan, Deepak; Ahmad, Shamim; Tothadi, Srinu; Emmerling, Franziska; Bhattacharya, Biswajit; Ghosh, Soumyajit Linker size dependent mechanical properties of di-imine based molecular crystals CrystEngComm, 2023, 25, 6416-6423
7247616	CIF	C12 H10 N2	P 1 21/c 1	22.3235; 11.7383; 7.558 90; 92.989; 90	1977.8	Baig, K. Mohamed Yusuf; Kole, Goutam Kumar Silver(i) coordination polymers of trans-5-styrylpyrimidine – from structural diversity to solid-state reactivity under sunlight CrystEngComm, 2023, 25, 6204-6214
7247617	CIF	C12 H12 Ag N3 O4	P 1 21/n 1	7.799; 18.295; 8.984 90; 93.931; 90	1278.8	Baig, K. Mohamed Yusuf; Kole, Goutam Kumar Silver(i) coordination polymers of trans-5-styrylpyrimidine – from structural diversity to solid-state reactivity under sunlight CrystEngComm, 2023, 25, 6204-6214
7247618	CIF	C12 H12 Ag B F4 N2 O	P 1 21/n 1	7.7806; 18.88; 9.48 90; 96.15; 90	1384.6	Baig, K. Mohamed Yusuf; Kole, Goutam Kumar Silver(i) coordination polymers of trans-5-styrylpyrimidine – from structural diversity to solid-state reactivity under sunlight CrystEngComm, 2023, 25, 6204-6214
7247619	CIF	C12 H10 Ag F6 N2 Sb	P n m a	12.102; 6.6333; 17.915 90; 90; 90	1438.1	Baig, K. Mohamed Yusuf; Kole, Goutam Kumar Silver(i) coordination polymers of trans-5-styrylpyrimidine – from structural diversity to solid-state reactivity under sunlight CrystEngComm, 2023, 25, 6204-6214
7247620	CIF	C14 H10 Ag F3 N2 O2	C 1 2/c 1	36.304; 5.3887; 15.575 90; 110.695; 90	2850.4	Baig, K. Mohamed Yusuf; Kole, Goutam Kumar Silver(i) coordination polymers of trans-5-styrylpyrimidine – from structural diversity to solid-state reactivity under sunlight CrystEngComm, 2023, 25, 6204-6214
7247621	CIF	C13 H10 Ag F3 N2 O3 S	P 1 21/c 1	6.6106; 17.709; 12.3217 90; 94.626; 90	1437.8	Baig, K. Mohamed Yusuf; Kole, Goutam Kumar Silver(i) coordination polymers of trans-5-styrylpyrimidine – from structural diversity to solid-state reactivity under sunlight CrystEngComm, 2023, 25, 6204-6214
7247622	CIF	C28 H30 N8 O7	P 1 21/n 1	19.0792; 7.8359; 19.193 90; 94.076; 90	2862.1	Wood, Oskar G.; Jones, Leanne; Hawes, Chris S. Supporting coordination through hydrogen bonding in lanthanide complexes of 7-azaindole-N-oxide CrystEngComm, 2023, 25, 6371-6378
7247623	CIF	C56 H50 Cl6 N16 O9 Yb2	P -1	13.2616; 16.7698; 16.9393 118.495; 93.043; 103.059	3167.76	Wood, Oskar G.; Jones, Leanne; Hawes, Chris S. Supporting coordination through hydrogen bonding in lanthanide complexes of 7-azaindole-N-oxide CrystEngComm, 2023, 25, 6371-6378
7247624	CIF	C14 H10 Cu N4 O2	P 1 21/n 1	8.6982; 11.0452; 13.7542 90; 106.867; 90	1264.57	Wood, Oskar G.; Jones, Leanne; Hawes, Chris S. Supporting coordination through hydrogen bonding in lanthanide complexes of 7-azaindole-N-oxide CrystEngComm, 2023, 25, 6371-6378
7247625	CIF	C42 H36 Cl6 Eu2 N12 O6	P -1	8.4097; 10.7232; 13.8568 79.116; 80.131; 79.915	1195.72	Wood, Oskar G.; Jones, Leanne; Hawes, Chris S. Supporting coordination through hydrogen bonding in lanthanide complexes of 7-azaindole-N-oxide CrystEngComm, 2023, 25, 6371-6378
7247626	CIF	C21 H18 Eu N9 O12	P -1	8.5699; 11.7452; 14.2218 78.654; 77.154; 70.806	1306.15	Wood, Oskar G.; Jones, Leanne; Hawes, Chris S. Supporting coordination through hydrogen bonding in lanthanide complexes of 7-azaindole-N-oxide CrystEngComm, 2023, 25, 6371-6378
7247627	CIF	C21 H18 Gd N9 O12	P -1	8.5744; 11.7399; 14.2153 78.681; 77.157; 70.824	1305.88	Wood, Oskar G.; Jones, Leanne; Hawes, Chris S. Supporting coordination through hydrogen bonding in lanthanide complexes of 7-azaindole-N-oxide CrystEngComm, 2023, 25, 6371-6378
7247628	CIF	C16 H16 Cu2 N4 O4	P 1 21/c 1	12.4309; 10.4129; 13.1342 90; 104.761; 90	1644	Wood, Oskar G.; Jones, Leanne; Hawes, Chris S. Supporting coordination through hydrogen bonding in lanthanide complexes of 7-azaindole-N-oxide CrystEngComm, 2023, 25, 6371-6378
7247629	CIF	C8 H8 Br3 N Pb S	P 21 21 21	7.7383; 11.5787; 14.7269 90; 90; 90	1319.52	Gao, Cheng-Cheng; Tang, Xue-Na; Miao, Jing-Ling; Li, Yu; Li, Cuncheng; Liu, Guang-Ning Regulating the crystal and electronic structures and optical properties of hybrid bromoplumbates with alkylated N, S- or P-containing aromatic cations CrystEngComm, 2023, 25, 6556-6567
7247630	CIF	C9 H10 Br3 N Pb S	P b c a	17.703; 7.827; 20.1031 90; 90; 90	2785.5	Gao, Cheng-Cheng; Tang, Xue-Na; Miao, Jing-Ling; Li, Yu; Li, Cuncheng; Liu, Guang-Ning Regulating the crystal and electronic structures and optical properties of hybrid bromoplumbates with alkylated N, S- or P-containing aromatic cations CrystEngComm, 2023, 25, 6556-6567
7247631	CIF	C19 H18 Br3 P Pb	P b c a	22.601; 7.8074; 24.284 90; 90; 90	4285	Gao, Cheng-Cheng; Tang, Xue-Na; Miao, Jing-Ling; Li, Yu; Li, Cuncheng; Liu, Guang-Ning Regulating the crystal and electronic structures and optical properties of hybrid bromoplumbates with alkylated N, S- or P-containing aromatic cations CrystEngComm, 2023, 25, 6556-6567
7247632	CIF	C20 H20 Br3 P Pb	P b c a	22.297; 7.948; 25.2706 90; 90; 90	4478.4	Gao, Cheng-Cheng; Tang, Xue-Na; Miao, Jing-Ling; Li, Yu; Li, Cuncheng; Liu, Guang-Ning Regulating the crystal and electronic structures and optical properties of hybrid bromoplumbates with alkylated N, S- or P-containing aromatic cations CrystEngComm, 2023, 25, 6556-6567
7247633	CIF	C20 H24 Br8 N2 Pb3 S2	P 1 21/c 1	8.8791; 21.8322; 17.9977 90; 91.913; 90	3486.9	Gao, Cheng-Cheng; Tang, Xue-Na; Miao, Jing-Ling; Li, Yu; Li, Cuncheng; Liu, Guang-Ning Regulating the crystal and electronic structures and optical properties of hybrid bromoplumbates with alkylated N, S- or P-containing aromatic cations CrystEngComm, 2023, 25, 6556-6567
7247634	CIF	C21 H22 Br3 P Pb	P 1 21/n 1	13.3422; 8.1688; 21.4738 90; 95.977; 90	2327.7	Gao, Cheng-Cheng; Tang, Xue-Na; Miao, Jing-Ling; Li, Yu; Li, Cuncheng; Liu, Guang-Ning Regulating the crystal and electronic structures and optical properties of hybrid bromoplumbates with alkylated N, S- or P-containing aromatic cations CrystEngComm, 2023, 25, 6556-6567
7247635	CIF	C14 H8 N4 S2	P 1 21/c 1	15.6685; 3.7842; 10.8705 90; 108.658; 90	610.67	Rizzuto, Felix J.; Pal, Shyam C.; Kearns, Eleanor R.; Hua, Carol; Solomon, Marcello B.; Doheny, Patrick W.; Faust, Thomas B.; Kepert, Cameron J.; Das, Madhab C.; D'Alessandro, Deanna M. The physical and electronic properties of Metal–Organic Frameworks containing dipyridylthiazolo[5,4-d]thiazole CrystEngComm, 2023, 25, 6434-6440
7247636	CIF	C14 H8 N4 S2	P 1 21/c 1	8.4275; 6.304; 11.748 90; 93.544; 90	622.94	Rizzuto, Felix J.; Pal, Shyam C.; Kearns, Eleanor R.; Hua, Carol; Solomon, Marcello B.; Doheny, Patrick W.; Faust, Thomas B.; Kepert, Cameron J.; Das, Madhab C.; D'Alessandro, Deanna M. The physical and electronic properties of Metal–Organic Frameworks containing dipyridylthiazolo[5,4-d]thiazole CrystEngComm, 2023, 25, 6434-6440
7247637	CIF	C70 H40 N12 O8 S6 Zn2	P -1	14.728; 15.36; 15.369 93.63; 113.88; 91.64	3167	Rizzuto, Felix J.; Pal, Shyam C.; Kearns, Eleanor R.; Hua, Carol; Solomon, Marcello B.; Doheny, Patrick W.; Faust, Thomas B.; Kepert, Cameron J.; Das, Madhab C.; D'Alessandro, Deanna M. The physical and electronic properties of Metal–Organic Frameworks containing dipyridylthiazolo[5,4-d]thiazole CrystEngComm, 2023, 25, 6434-6440
7247638	CIF	C46 H34 N10 O10 S6 Zn2	P 1 21/c 1	17.1947; 18.5446; 15.7154 90; 100.974; 90	4919.52	Rizzuto, Felix J.; Pal, Shyam C.; Kearns, Eleanor R.; Hua, Carol; Solomon, Marcello B.; Doheny, Patrick W.; Faust, Thomas B.; Kepert, Cameron J.; Das, Madhab C.; D'Alessandro, Deanna M. The physical and electronic properties of Metal–Organic Frameworks containing dipyridylthiazolo[5,4-d]thiazole CrystEngComm, 2023, 25, 6434-6440
7247639	CIF	C28 H16 N4 O5 S2 Zn	C 1 2/c 1	32.53; 8.664; 22.1 90; 96.56; 90	6188	Rizzuto, Felix J.; Pal, Shyam C.; Kearns, Eleanor R.; Hua, Carol; Solomon, Marcello B.; Doheny, Patrick W.; Faust, Thomas B.; Kepert, Cameron J.; Das, Madhab C.; D'Alessandro, Deanna M. The physical and electronic properties of Metal–Organic Frameworks containing dipyridylthiazolo[5,4-d]thiazole CrystEngComm, 2023, 25, 6434-6440
7247640	CIF	C2 D3 F3 O	P 1 21/c 1	4.6413; 16.1899; 8.557 90; 91.691; 90	642.7	Barnett, S. A.; Bull, C. L.; Funnell, N. P.; Allan, D. R. The rich structural phase behaviour of 2,2,2-trifluoroethanol CrystEngComm, 2023, 25, 6291-6302
7247641	CIF	C2 D3 F3 O	P 1 21/c 1	4.654; 16.259; 8.577 90; 91.615; 90	648.8	Barnett, S. A.; Bull, C. L.; Funnell, N. P.; Allan, D. R. The rich structural phase behaviour of 2,2,2-trifluoroethanol CrystEngComm, 2023, 25, 6291-6302
7247642	CIF	C2 D3 F3 O	P 1 21/c 1	4.863; 33.054; 8.8694 90; 91.519; 90	1425.2	Barnett, S. A.; Bull, C. L.; Funnell, N. P.; Allan, D. R. The rich structural phase behaviour of 2,2,2-trifluoroethanol CrystEngComm, 2023, 25, 6291-6302
7247643	CIF	C9 H14 N4 O8	P 1 21 1	7.712; 7.481; 11.062 90; 108.44; 90	605.4	Wu, Qiong; Chai, Yingying; Huang, Ridong; Chen, Hai; He, Yang A linear CH±-NO3− base pair motif promoted by AgNO3 mediated proton transfer between guanosine and cytidine CrystEngComm, 2023, 25, 6549-6555
7247644	CIF	C9 H13 Ag N4 O8	P 21 21 21	4.6969; 15.1122; 17.3305 90; 90; 90	1230.13	Wu, Qiong; Chai, Yingying; Huang, Ridong; Chen, Hai; He, Yang A linear CH±-NO3− base pair motif promoted by AgNO3 mediated proton transfer between guanosine and cytidine CrystEngComm, 2023, 25, 6549-6555
7247645	CIF	C24 H38 Co F6 N4 O6	P 1 21/c 1	10.0114; 16.1179; 11.3898 90; 120.466; 90	1584.13	Ovcharenko, Victor; Fursova, Elena; Letyagin, Gleb; Morozov, Vitaly; Bogomyakov, Artem; Romanenko, Galina Alternating [ML2(MeOH)2] and [ML2(EtOH)2] layers in low-temperature ferromagnets [ML2(MeOH)2][ML2(EtOH)2] (M = CoII, NiII or CoII0.5NiII0.5) CrystEngComm, 2023, 25, 6194-6203
7247646	CIF	C24 H38 F6 N4 Ni O6	P 1 21/c 1	9.9328; 15.9853; 11.4746 90; 120.609; 90	1568.06	Ovcharenko, Victor; Fursova, Elena; Letyagin, Gleb; Morozov, Vitaly; Bogomyakov, Artem; Romanenko, Galina Alternating [ML2(MeOH)2] and [ML2(EtOH)2] layers in low-temperature ferromagnets [ML2(MeOH)2][ML2(EtOH)2] (M = CoII, NiII or CoII0.5NiII0.5) CrystEngComm, 2023, 25, 6194-6203
7247647	CIF	C22 H34 F6 N4 Ni O6	P 1 21/c 1	8.9504; 15.8017; 11.5358 90; 118.8; 90	1429.7	Ovcharenko, Victor; Fursova, Elena; Letyagin, Gleb; Morozov, Vitaly; Bogomyakov, Artem; Romanenko, Galina Alternating [ML2(MeOH)2] and [ML2(EtOH)2] layers in low-temperature ferromagnets [ML2(MeOH)2][ML2(EtOH)2] (M = CoII, NiII or CoII0.5NiII0.5) CrystEngComm, 2023, 25, 6194-6203
7247648	CIF	C23 H36 Co0.5 F6 N4 Ni0.5 O6	P 1 21/c 1	18.333; 15.836; 11.701 90; 120.036; 90	2940.9	Ovcharenko, Victor; Fursova, Elena; Letyagin, Gleb; Morozov, Vitaly; Bogomyakov, Artem; Romanenko, Galina Alternating [ML2(MeOH)2] and [ML2(EtOH)2] layers in low-temperature ferromagnets [ML2(MeOH)2][ML2(EtOH)2] (M = CoII, NiII or CoII0.5NiII0.5) CrystEngComm, 2023, 25, 6194-6203
7247649	CIF	C23 H36 Co F6 N4 O6	P 1 21/c 1	18.514; 15.792; 11.787 90; 120.86; 90	2958.3	Ovcharenko, Victor; Fursova, Elena; Letyagin, Gleb; Morozov, Vitaly; Bogomyakov, Artem; Romanenko, Galina Alternating [ML2(MeOH)2] and [ML2(EtOH)2] layers in low-temperature ferromagnets [ML2(MeOH)2][ML2(EtOH)2] (M = CoII, NiII or CoII0.5NiII0.5) CrystEngComm, 2023, 25, 6194-6203
7247650	CIF	C23 H36 F6 N4 Ni O6	P 1 21/c 1	18.564; 15.699; 11.768 90; 120.67; 90	2949.9	Ovcharenko, Victor; Fursova, Elena; Letyagin, Gleb; Morozov, Vitaly; Bogomyakov, Artem; Romanenko, Galina Alternating [ML2(MeOH)2] and [ML2(EtOH)2] layers in low-temperature ferromagnets [ML2(MeOH)2][ML2(EtOH)2] (M = CoII, NiII or CoII0.5NiII0.5) CrystEngComm, 2023, 25, 6194-6203
7247665	CIF	C48 H100 S4 Sn	P 1 21/c 1	71.41; 8.12; 9.297 90; 91.38; 90	5389	Wang, Tingting; Wan, Yixin; Yu, Nan; Gu, Kewei; Lu, Zhiwei; Wang, Junli Long-chain tin(iv) alkanethiolates (Sn(SCnH2n+1)4, n ≥ 12) with the coexistence of trans and gauche S–C bonds: a class of lamellar van der Waals molecular crystals CrystEngComm, 2023, 25, 5782-5786
7247666	CIF	C56 H116 S4 Sn	P 1 21/c 1	81.184; 7.8878; 9.253 90; 91.117; 90	5924.2	Wang, Tingting; Wan, Yixin; Yu, Nan; Gu, Kewei; Lu, Zhiwei; Wang, Junli Long-chain tin(iv) alkanethiolates (Sn(SCnH2n+1)4, n ≥ 12) with the coexistence of trans and gauche S–C bonds: a class of lamellar van der Waals molecular crystals CrystEngComm, 2023, 25, 5782-5786
7247667	CIF	C64 H132 S4 Sn	P 1 c 1	45.6447; 8.1335; 9.3171 90; 92.133; 90	3456.6	Wang, Tingting; Wan, Yixin; Yu, Nan; Gu, Kewei; Lu, Zhiwei; Wang, Junli Long-chain tin(iv) alkanethiolates (Sn(SCnH2n+1)4, n ≥ 12) with the coexistence of trans and gauche S–C bonds: a class of lamellar van der Waals molecular crystals CrystEngComm, 2023, 25, 5782-5786
7247668	CIF	C6 H4 Cl Cu2 N5	C 1 c 1	19.689; 3.6236; 11.631 90; 102.953; 90	808.7	Lu, Kuang-Lieh; Sie, Shu-Ling; Kamal, Surabhi; Zong-Zhan, Lu; Wei, Ling-Fang; Luo, Tzuoo-Tsair; Liu, Yen-Hsiang; Chang, Chao-Wan; Chi, Kai-Ming Fine-tuning synthesis of a novel CuI/CuII mixed-valence coordination polymer CrystEngComm, 2023
7247669	CIF	C12 H10 Cl Cu3 N10 O2	C 1 2/c 1	12.0666; 6.6817; 20.6749 90; 107.439; 90	1590.3	Lu, Kuang-Lieh; Sie, Shu-Ling; Kamal, Surabhi; Zong-Zhan, Lu; Wei, Ling-Fang; Luo, Tzuoo-Tsair; Liu, Yen-Hsiang; Chang, Chao-Wan; Chi, Kai-Ming Fine-tuning synthesis of a novel CuI/CuII mixed-valence coordination polymer CrystEngComm, 2023
7247681	CIF	C33 H24 In N3 O9	R -3 :H	13.8174; 13.8174; 26.1691 90; 90; 120	4326.9	Wang, Rui; Jiang, Nan; Luo, Rong; Yu, Hai-Jun; Yin, Yi; Bi, Shuang-Yu; Zhang, Dong-Mei; Shao, Feng Efficient detection of Al3+ and B4O72− over trigonal prism In(iii) complex CrystEngComm, 2023, 25, 6627-6634
7247682	CIF	C22 H28 N8 Ni O11	P -1	10.949; 11.9806; 12.0973 112.946; 106.988; 99.066	1329.49	Roy, Subhadip; Mal, Susital; Banik, Rupak; Das, Subrata; Dlháň, Ľubor; Titiš, Ján; Boča, Roman; Kirillov, Alexander M.; Novikov, Alexander S.; Hazendonk, Paul; Butcher, Ray J.; Bauza, Antonio; Frontera, Antonio Two isostructural complexes of Ni(ii) and Zn(ii) with violurate and pyridine: a detailed structural, theoretical, magnetic, and NMR investigation CrystEngComm, 2023, 25, 6503-6511
7247683	CIF	C22 H28 N8 O11 Zn	P -1	11.1064; 12.1528; 12.3032 113.663; 106.663; 98.98	1385.8	Roy, Subhadip; Mal, Susital; Banik, Rupak; Das, Subrata; Dlháň, Ľubor; Titiš, Ján; Boča, Roman; Kirillov, Alexander M.; Novikov, Alexander S.; Hazendonk, Paul; Butcher, Ray J.; Bauza, Antonio; Frontera, Antonio Two isostructural complexes of Ni(ii) and Zn(ii) with violurate and pyridine: a detailed structural, theoretical, magnetic, and NMR investigation CrystEngComm, 2023, 25, 6503-6511
7247685	CIF	C8 H20 Cl4 Mn N2 O4	P 1 21/c 1	16.1956; 7.178; 7.2126 90; 100.097; 90	825.49	Bothma, Shalene N.; Sheppard, Charles J.; Turnbull, Mark M.; Landee, Christopher P.; Rademeyer, Melanie The odd–even effect in n-carboxyalkylammonium-containing organic–inorganic hybrids of Mn(ii) halides: structural and magnetic characterisation CrystEngComm, 2023, 25, 6568-6591
7247686	CIF	C6 H20 Cl4 Mn N2 O6	C 1 2/c 1	21.3208; 7.0794; 11.144 90; 107.916; 90	1600.49	Bothma, Shalene N.; Sheppard, Charles J.; Turnbull, Mark M.; Landee, Christopher P.; Rademeyer, Melanie The odd–even effect in n-carboxyalkylammonium-containing organic–inorganic hybrids of Mn(ii) halides: structural and magnetic characterisation CrystEngComm, 2023, 25, 6568-6591
7247687	CIF	C10 H28 Cl4 Mn N2 O6	P -1	5.9046; 7.8188; 11.5638 91.74; 99.872; 104.651	507.33	Bothma, Shalene N.; Sheppard, Charles J.; Turnbull, Mark M.; Landee, Christopher P.; Rademeyer, Melanie The odd–even effect in n-carboxyalkylammonium-containing organic–inorganic hybrids of Mn(ii) halides: structural and magnetic characterisation CrystEngComm, 2023, 25, 6568-6591
7247688	CIF	C12 H28 Cl4 Mn N2 O4	P -1	7.137; 7.2664; 19.6318 85.695; 87.366; 88.66	1013.96	Bothma, Shalene N.; Sheppard, Charles J.; Turnbull, Mark M.; Landee, Christopher P.; Rademeyer, Melanie The odd–even effect in n-carboxyalkylammonium-containing organic–inorganic hybrids of Mn(ii) halides: structural and magnetic characterisation CrystEngComm, 2023, 25, 6568-6591
7247700	CIF	C19 H20 N2 O S	P 1 21/c 1	10.5007; 19.5547; 8.6349 90; 97.941; 90	1756.07	Ahmed, Muhammad Naeem; Akhtar, Maheen; Andleeb, Hina; Bashir, Muhammad Adnan; Ibrahim, Mahmoud A. A.; Sidhom, Peter A.; Arshad, Ifzan; Tahir, Muhammad Nawaz; Gil, Diego M.; Gomila, Rosa M.; Frontera, Antonio Crystal engineering with 1,3,4-oxadiazole derivatives: on the importance of CH⋯N and CH⋯π interactions CrystEngComm, 2023, 25, 6710-6718
7247701	CIF	C22 H26 N2 O4 S	P 1 21/c 1	10.4066; 24.9033; 8.8792 90; 97.936; 90	2279.08	Ahmed, Muhammad Naeem; Akhtar, Maheen; Andleeb, Hina; Bashir, Muhammad Adnan; Ibrahim, Mahmoud A. A.; Sidhom, Peter A.; Arshad, Ifzan; Tahir, Muhammad Nawaz; Gil, Diego M.; Gomila, Rosa M.; Frontera, Antonio Crystal engineering with 1,3,4-oxadiazole derivatives: on the importance of CH⋯N and CH⋯π interactions CrystEngComm, 2023, 25, 6710-6718
7247702	CIF	C21 H27 N3 O12 Tb	P -1	10.4819; 10.9273; 12.5634 104.646; 108.134; 97.016	1291.14	Zhao, Yuming; Zhang, Rudie; Xiao, Cheng; Yue, Dan; Qin, Bowen; Liu, Jinhui; Wang, Zhenling; Fu, Yu A dual-emission Tb-based MOF induced by ESPT for ratiometric ammonia sensing CrystEngComm, 2023, 25, 6528-6532
7247705	CIF	C120 H72 Hf6 O32	R -3 :H	30.238; 30.238; 15.131 90; 90; 120	11981	Ma, Yali; Wang, Haitang; Wang, Hailong; Wang, Jiani; Jiang, Shuaiyu; Zheng, Qiang; Jia, Songyan; Li, Xue; Ma, Tianyi A stable ultra-microporous hafnium-based metal–organic framework with high performance for CO2 adsorption and separation CrystEngComm, 2023, 25, 6489-6495
7247709	CIF	C16 H14 Br Cl3 N2 O S	C 1 2/c 1	35.975; 6.3852; 17.1343 90; 104.246; 90	3814.8	Madhesiya, Avinash; Dash, Sibananda G.; Gupta, Princi; Akhir, Abdul; Saxena, Deepanshi; Maitra, Rahul; Chopra, Sidharth; Thakur, Tejender S. Development of new multicomponent crystals of the antifungal drug tioconazole and the assessment of their biopharmaceutical attributes CrystEngComm, 2023, 25, 6758-6776
7247710	CIF	C23 H16 Cl4 N3 O5 S	P -1	7.7627; 11.9414; 14.9934 110.029; 96.939; 103.891	1235.79	Madhesiya, Avinash; Dash, Sibananda G.; Gupta, Princi; Akhir, Abdul; Saxena, Deepanshi; Maitra, Rahul; Chopra, Sidharth; Thakur, Tejender S. Development of new multicomponent crystals of the antifungal drug tioconazole and the assessment of their biopharmaceutical attributes CrystEngComm, 2023, 25, 6758-6776
7247711	CIF	C40 H36 Cl6 N4 O11 S2	P 1 21/n 1	7.8551; 46.374; 12.4658 90; 90.468; 90	4540.8	Madhesiya, Avinash; Dash, Sibananda G.; Gupta, Princi; Akhir, Abdul; Saxena, Deepanshi; Maitra, Rahul; Chopra, Sidharth; Thakur, Tejender S. Development of new multicomponent crystals of the antifungal drug tioconazole and the assessment of their biopharmaceutical attributes CrystEngComm, 2023, 25, 6758-6776
7247712	CIF	C22 H22 Cl3 N2 O10 S	P 1	7.5563; 8.3022; 20.6593 83.732; 82.528; 89.714	1277.3	Madhesiya, Avinash; Dash, Sibananda G.; Gupta, Princi; Akhir, Abdul; Saxena, Deepanshi; Maitra, Rahul; Chopra, Sidharth; Thakur, Tejender S. Development of new multicomponent crystals of the antifungal drug tioconazole and the assessment of their biopharmaceutical attributes CrystEngComm, 2023, 25, 6758-6776
7247713	CIF	C18 H15 Cl3 N2 O5 S	P -1	10.2522; 10.7638; 11.0528 112.364; 105.711; 96.357	1054.06	Madhesiya, Avinash; Dash, Sibananda G.; Gupta, Princi; Akhir, Abdul; Saxena, Deepanshi; Maitra, Rahul; Chopra, Sidharth; Thakur, Tejender S. Development of new multicomponent crystals of the antifungal drug tioconazole and the assessment of their biopharmaceutical attributes CrystEngComm, 2023, 25, 6758-6776
7247714	CIF	C22 H18 Cl3 N3 O3 S	P -1	8.0219; 12.3226; 23.9838 97.644; 99.212; 90.462	2318.4	Madhesiya, Avinash; Dash, Sibananda G.; Gupta, Princi; Akhir, Abdul; Saxena, Deepanshi; Maitra, Rahul; Chopra, Sidharth; Thakur, Tejender S. Development of new multicomponent crystals of the antifungal drug tioconazole and the assessment of their biopharmaceutical attributes CrystEngComm, 2023, 25, 6758-6776
7247715	CIF	C16 H15 Cl3 N2 O5 S2	I 1 2/a 1	16.9432; 6.7811; 34.455 90; 98.406; 90	3916.1	Madhesiya, Avinash; Dash, Sibananda G.; Gupta, Princi; Akhir, Abdul; Saxena, Deepanshi; Maitra, Rahul; Chopra, Sidharth; Thakur, Tejender S. Development of new multicomponent crystals of the antifungal drug tioconazole and the assessment of their biopharmaceutical attributes CrystEngComm, 2023, 25, 6758-6776
7247716	CIF	C20 H16 Cl3 N2 O3 S	P -1	7.488; 11.3843; 13.028 83.111; 83.102; 75.116	1060.94	Madhesiya, Avinash; Dash, Sibananda G.; Gupta, Princi; Akhir, Abdul; Saxena, Deepanshi; Maitra, Rahul; Chopra, Sidharth; Thakur, Tejender S. Development of new multicomponent crystals of the antifungal drug tioconazole and the assessment of their biopharmaceutical attributes CrystEngComm, 2023, 25, 6758-6776
7247717	CIF	C23 H14 Cl3 N2 O4 S2	C 1 2/c 1	28.7499; 6.6873; 26.7737 90; 106.37; 90	4938.8	Madhesiya, Avinash; Dash, Sibananda G.; Gupta, Princi; Akhir, Abdul; Saxena, Deepanshi; Maitra, Rahul; Chopra, Sidharth; Thakur, Tejender S. Development of new multicomponent crystals of the antifungal drug tioconazole and the assessment of their biopharmaceutical attributes CrystEngComm, 2023, 25, 6758-6776
7247718	CIF	C32 H32 Cl6 N4 O11 S3	P -1	8.4631; 12.0147; 21.5955 82.36; 88.44; 88.592	2175.1	Madhesiya, Avinash; Dash, Sibananda G.; Gupta, Princi; Akhir, Abdul; Saxena, Deepanshi; Maitra, Rahul; Chopra, Sidharth; Thakur, Tejender S. Development of new multicomponent crystals of the antifungal drug tioconazole and the assessment of their biopharmaceutical attributes CrystEngComm, 2023, 25, 6758-6776
7247719	CIF	C20 H25 Cl3 N2 O10.42 S	P 21 21 21	7.6028; 9.9444; 35.6016 90; 90; 90	2691.67	Madhesiya, Avinash; Dash, Sibananda G.; Gupta, Princi; Akhir, Abdul; Saxena, Deepanshi; Maitra, Rahul; Chopra, Sidharth; Thakur, Tejender S. Development of new multicomponent crystals of the antifungal drug tioconazole and the assessment of their biopharmaceutical attributes CrystEngComm, 2023, 25, 6758-6776