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COD ID	Links	Formula	Space group	Cell parameters	Cell volume	Bibliography
7243049	CIF	C48 H28 Mn3 N6 O12	P -1	9.6405; 10.1868; 12.8047 76.922; 70.96; 78.692	1147.62	Zhou, Chuan-Cong; Liu, Hou-Ting; Ding, Li; Lu, Jing; Wang, Su-Na; Li, Yun-Wu Proton conductivities of four low dimensional MOFs: affected by the amount of chelated ligands CrystEngComm, 2021, 23, 5106-5115
7243050	CIF	C40 H44 Co3 N4 O24	P 1 21/n 1	8.0999; 27.363; 20.2667 90; 96.328; 90	4464.5	Zhou, Chuan-Cong; Liu, Hou-Ting; Ding, Li; Lu, Jing; Wang, Su-Na; Li, Yun-Wu Proton conductivities of four low dimensional MOFs: affected by the amount of chelated ligands CrystEngComm, 2021, 23, 5106-5115
7243051	CIF	C22 H14	P 1 21/c 1	16.9; 5.571; 16.42 90; 96.441; 90	1536.2	Shen, Yue; Wang, Shiyin; Zhang, Xiangyu; Li, Nan; Liu, Haichao; Yang, Bing Supramolecular complex strategy for pure organic multi-color luminescent materials and stimuli-responsive luminescence switching CrystEngComm, 2021, 23, 5918-5924
7243052	CIF	C37 H17 N6	P 1 21/c 1	9.7595; 7.9919; 36.1641 90; 91.478; 90	2819.8	Shen, Yue; Wang, Shiyin; Zhang, Xiangyu; Li, Nan; Liu, Haichao; Yang, Bing Supramolecular complex strategy for pure organic multi-color luminescent materials and stimuli-responsive luminescence switching CrystEngComm, 2021, 23, 5918-5924
7243053	CIF	C32 H14 F8	P 1 21/c 1	6.8012; 24.7708; 14.5619 90; 101.513; 90	2403.9	Shen, Yue; Wang, Shiyin; Zhang, Xiangyu; Li, Nan; Liu, Haichao; Yang, Bing Supramolecular complex strategy for pure organic multi-color luminescent materials and stimuli-responsive luminescence switching CrystEngComm, 2021, 23, 5918-5924
7243054	CIF	C36 H38 Br2 N4 O2	P 1 21/c 1	8.30793; 15.8271; 25.9265 90; 92.478; 90	3405.9	Xu, Zixuan; Su, Linhan; Chen, Xiaofen; Yang, Ying A novel ionic AIE smart responsive material with multiple structural transformations RSC Advances, 2021, 11, 20911-20915
7243055	CIF	C15 H24 O5	P 1 21/c 1	16.7684; 7.5872; 12.5827 90; 93.71; 90	1597.48	Saget, Raphaël; Jaunky, Piotr; Duñach, Elisabet Bi(OTf)3-catalysed intramolecular cyclisation of unsaturated acetals RSC Advances, 2021, 11, 21066-21072
7243056	CIF	C22 H26 N2 O3 S	P 1 21/c 1	12.8677; 9.6306; 16.3003 90; 92.7196; 90	2017.7	Okura, Ryuhei; Uchiyama, Hiromasa; Kadota, Kazunori; Tozuka, Yuichi Hydrogen bonding from crystalline water mediates the hydration/dehydration of mequitazine glycolate CrystEngComm, 2021, 23, 4816-4824
7243057	CIF	C22 H26 N2 O3 S	P 1 21/c 1	13.0245; 9.6841; 16.368 90; 92.7266; 90	2062.2	Okura, Ryuhei; Uchiyama, Hiromasa; Kadota, Kazunori; Tozuka, Yuichi Hydrogen bonding from crystalline water mediates the hydration/dehydration of mequitazine glycolate CrystEngComm, 2021, 23, 4816-4824
7243058	CIF	C17 H10 O4 S2	P -1	5.778; 13.713; 16.811 81.532; 81.28; 86.7	1301.4	Gao, Xiang-Yu; Li, Yu-Lin; Liu, Tian-Fu; Huang, Xin-Song; Cao, Rong Single-crystal-to-single-crystal transformation of tetrathiafulvalene-based hydrogen-bonded organic frameworks CrystEngComm, 2021, 23, 4743-4747
7243059	CIF	C34 H20 O8 S4	P -1	8.4537; 14.128; 18.021 106.291; 97.991; 103.267	1962.5	Gao, Xiang-Yu; Li, Yu-Lin; Liu, Tian-Fu; Huang, Xin-Song; Cao, Rong Single-crystal-to-single-crystal transformation of tetrathiafulvalene-based hydrogen-bonded organic frameworks CrystEngComm, 2021, 23, 4743-4747
7243060	CIF	C H O S	P -1	8.301; 18.954; 20.558 114.88; 96.22; 95.19	2884	Gao, Xiang-Yu; Li, Yu-Lin; Liu, Tian-Fu; Huang, Xin-Song; Cao, Rong Single-crystal-to-single-crystal transformation of tetrathiafulvalene-based hydrogen-bonded organic frameworks CrystEngComm, 2021, 23, 4743-4747
7243061	CIF	C262.38 H275.18 N18 O85.27 Rb3.98	I 41	57.3567; 57.3567; 29.225 90; 90; 90	96144	Mizuno, Asato; Shuku, Yoshiaki; Suizu, Rie; Tsuchiizu, Masahisa; Awaga, Kunio 3D supramolecular chiral crystal structures of radical anion salts of (−)-NDI-Δ and possible magnetic phase diagrams CrystEngComm, 2021, 23, 5053-5059
7243062	CIF	C20 H14 N2 O S	P 1 21/n 1	3.8618; 33.708; 11.8039 90; 98.934; 90	1517.9	Charpe, Vaibhav Pramod; Ragupathi, Ayyakkannu; Sagadevan, Arunachalam; Hwang, Kuo Chu Photoredox synthesis of functionalized quinazolines via copper-catalyzed aerobic oxidative Csp2‒H annulation of amidines with terminal alkynes Green Chemistry, 2021, 23, 5024-5030
7243063	CIF	C21 H18 N2 O2 S	P 1 21/c 1	9.3403; 17.0872; 10.882 90; 106.207; 90	1667.74	Charpe, Vaibhav Pramod; Ragupathi, Ayyakkannu; Sagadevan, Arunachalam; Hwang, Kuo Chu Photoredox synthesis of functionalized quinazolines via copper-catalyzed aerobic oxidative Csp2‒H annulation of amidines with terminal alkynes Green Chemistry, 2021, 23, 5024-5030
7243064	CIF	C22 H15 Cl N2 O2	P 1 21/n 1	14.02; 8.187; 15.972 90; 104.692; 90	1773.4	Charpe, Vaibhav Pramod; Ragupathi, Ayyakkannu; Sagadevan, Arunachalam; Hwang, Kuo Chu Photoredox synthesis of functionalized quinazolines via copper-catalyzed aerobic oxidative Csp2‒H annulation of amidines with terminal alkynes Green Chemistry, 2021, 23, 5024-5030
7243065	CIF	C16 H11 N O4	P b c a	18.517; 6.9182; 38.2895 90; 90; 90	4905.05	Bashir, Muhammad Adnan; Zhang, Yulong; Yu, Huaibin; Wang, Bofei; Zhao, Weining; Zhong, Fangrui Bimetallic copper/cobalt-cocatalyzed double aerobic phenol oxidation/cyclization toward π-extended benzofuro[2,3-b]indoles as electron donors for electroluminescence Green Chemistry, 2021, 23, 5031-5036
7243066	CIF	C24 H22 Si2	P 21 21 21	7.7979; 36.7369; 14.1416 90; 90; 90	4051.15	Kumar, Vipin B.; Fleming, Cassandra L.; Murali, Sai Shruthi; Hume, Paul A.; Davis, Nathaniel J. L. K.; Söhnel, Tilo; Leitao, Erin M. The photophysical properties of naphthalene bridged disilanes RSC Advances, 2021, 11, 21343-21350
7243067	CIF	C24 H24 Si2	P 1 21/n 1	9.2512; 18.1877; 12.5609 90; 104.094; 90	2049.85	Kumar, Vipin B.; Fleming, Cassandra L.; Murali, Sai Shruthi; Hume, Paul A.; Davis, Nathaniel J. L. K.; Söhnel, Tilo; Leitao, Erin M. The photophysical properties of naphthalene bridged disilanes RSC Advances, 2021, 11, 21343-21350
7243068	CIF	C14 H16 N2 O6	P 1 21/c 1	8.4828; 12.528; 6.6496 90; 92.535; 90	706	Singh, Abhishek; Singh, Reman Kumar; Patwari, G. Naresh Hierarchy of π-stacking determines the conformational preferences of bis-squaramates CrystEngComm, 2021, 23, 5331-5336
7243069	CIF	C20 H18 N4 O14	P 1 21/c 1	11.8489; 15.6629; 11.8621 90; 93.465; 90	2197.44	Singh, Abhishek; Singh, Reman Kumar; Patwari, G. Naresh Hierarchy of π-stacking determines the conformational preferences of bis-squaramates CrystEngComm, 2021, 23, 5331-5336
7243070	CIF	C14 H16 N2 O6	P -1	7.8262; 9.1203; 10.2647 79.094; 86.345; 79.409	706.86	Singh, Abhishek; Singh, Reman Kumar; Patwari, G. Naresh Hierarchy of π-stacking determines the conformational preferences of bis-squaramates CrystEngComm, 2021, 23, 5331-5336
7243071	CIF	C12 H12 N2 O6	C 1 2/c 1	9.8568; 10.1633; 12.2811 90; 101.617; 90	1205.09	Singh, Abhishek; Singh, Reman Kumar; Patwari, G. Naresh Hierarchy of π-stacking determines the conformational preferences of bis-squaramates CrystEngComm, 2021, 23, 5331-5336
7243072	CIF	C30 H36 N4 O12	P -1	8.4804; 13.0556; 13.3103 84.028; 86.103; 89.868	1462.27	Singh, Abhishek; Singh, Reman Kumar; Patwari, G. Naresh Hierarchy of π-stacking determines the conformational preferences of bis-squaramates CrystEngComm, 2021, 23, 5331-5336
7243073	CIF	C4 H17 N23 O	P -1	7.4436; 10.1464; 11.1808 89.53; 74.805; 86.082	812.97	Liu, Yifei; Dong, Zhen; Yang, Rui; Li, Haiyan; Liu, Yaxin; Ye, Zhiwen Imino-bridged N-rich energetic materials: C4H3N17 and their derivatives assembled from the powerful combination of four tetrazoles CrystEngComm, 2021, 23, 5377-5384
7243074	CIF	C4 H19 N21 O6	P -1	7.3804; 11.4595; 11.8445 64.029; 81.549; 89.905	888.6	Liu, Yifei; Dong, Zhen; Yang, Rui; Li, Haiyan; Liu, Yaxin; Ye, Zhiwen Imino-bridged N-rich energetic materials: C4H3N17 and their derivatives assembled from the powerful combination of four tetrazoles CrystEngComm, 2021, 23, 5377-5384
7243075	CIF	C4 H10 N19 Na O	P -1	9.5686; 9.5808; 9.5851 81.051; 81.699; 60.468	752.9	Liu, Yifei; Dong, Zhen; Yang, Rui; Li, Haiyan; Liu, Yaxin; Ye, Zhiwen Imino-bridged N-rich energetic materials: C4H3N17 and their derivatives assembled from the powerful combination of four tetrazoles CrystEngComm, 2021, 23, 5377-5384
7243076	CIF	C8 H15 N17 O2 S2	C 1 2 1	13.226; 10.403; 7.7069 90; 117.138; 90	943.7	Liu, Yifei; Dong, Zhen; Yang, Rui; Li, Haiyan; Liu, Yaxin; Ye, Zhiwen Imino-bridged N-rich energetic materials: C4H3N17 and their derivatives assembled from the powerful combination of four tetrazoles CrystEngComm, 2021, 23, 5377-5384
7243077	CIF	C7 H14 N17 Na O3	P -1	7.2417; 10.6666; 11.9926 77.757; 85.569; 80.379	891.72	Liu, Yifei; Dong, Zhen; Yang, Rui; Li, Haiyan; Liu, Yaxin; Ye, Zhiwen Imino-bridged N-rich energetic materials: C4H3N17 and their derivatives assembled from the powerful combination of four tetrazoles CrystEngComm, 2021, 23, 5377-5384
7243078	CIF	C7 H18 N26	P -1	7.234; 10.5985; 13.966 70.681; 89.167; 71.541	953.6	Liu, Yifei; Dong, Zhen; Yang, Rui; Li, Haiyan; Liu, Yaxin; Ye, Zhiwen Imino-bridged N-rich energetic materials: C4H3N17 and their derivatives assembled from the powerful combination of four tetrazoles CrystEngComm, 2021, 23, 5377-5384
7243079	CIF	C42 H36 N4	P 1 21/n 1	15.6432; 13.2799; 17.6411 90; 114.078; 90	3345.9	Luo, Zhenli; Pan, Yixiao; Yao, Zhen; Yang, Ji; Zhang, Xin; Liu, Xintong; Xu, Lijin; Fan, Qing-Hua BF3·Et2O as a metal-free catalyst for direct reductive amination of aldehydes with amines using formic acid as a reductant Green Chemistry, 2021, 23, 5205-5211
7243080	CIF	C12 H13 N3 O9	P 1 21/c 1	10.8226; 13.7338; 9.9166 90; 106.482; 90	1413.4	Garg, Utsav; Azim, Yasser; Alam, Mahboob In acid-aminopyrimidine continuum: experimental and computational studies of furan tetracarboxylate-2-aminopyrimidinium salt RSC Advances, 2021, 11, 21463-21474
7243081	CIF	C33 H50 Cl4 Fe2 N8 O3	P c c n	17.8183; 23.7713; 9.3271 90; 90; 90	3950.6	Balamurugan, Mani; Suresh, Eringathodi; Palaniandavar, Mallayan μ-Oxo-bridged diiron(iii) complexes of tripodal 4N ligands as catalysts for alkane hydroxylation reaction using m-CPBA as an oxidant: substrate vs. self hydroxylation RSC Advances, 2021, 11, 21514-21526
7243082	CIF	C28 H63 Cl4 Fe2 N12 O	P 1 21/n 1	17.8072; 15.7838; 17.8744 90; 116.311; 90	4503.4	Balamurugan, Mani; Suresh, Eringathodi; Palaniandavar, Mallayan μ-Oxo-bridged diiron(iii) complexes of tripodal 4N ligands as catalysts for alkane hydroxylation reaction using m-CPBA as an oxidant: substrate vs. self hydroxylation RSC Advances, 2021, 11, 21514-21526
7243083	CIF	C32 H20 Ge N2 O4	P 1 21 1	6.0837; 15.6412; 13.3288 90; 98.927; 90	1253	Shangin, Pavel G.; Krylova, Irina V.; Lalov, Andrey V.; Kozmenkova, Anna Y.; Saverina, Evgeniya A.; Buikin, Petr A.; Korlyukov, Alexander A.; Starikova, Alyona A.; Nikolaevskaya, Elena N.; Egorov, Mikhail P.; Syroeshkin, Mikhail A. Supramolecular D⋯A-layered structures based on germanium complexes with 2,3-dihydroxynaphthalene and N,N′-bidentate ligands RSC Advances, 2021, 11, 21527-21536
7243084	CIF	C14 H13 N3 O4 S	P n a 21	11.443; 25.579; 5.1731 90; 90; 90	1514.2	Hazarika, Pragyan J.; Gupta, Poonam; Gunnam, Anilkumar; Allu, Suryanarayana; Nangia, Ashwini K.; Nath, Naba K. Photomechanical response of sulfonylhydrazone molecular crystals CrystEngComm, 2021, 23, 4910-4916
7243085	CIF	C14 H14 N2 O2 S	P 1 21/c 1	11.54; 5.32; 22.8 90; 100.001; 90	1378.5	Hazarika, Pragyan J.; Gupta, Poonam; Gunnam, Anilkumar; Allu, Suryanarayana; Nangia, Ashwini K.; Nath, Naba K. Photomechanical response of sulfonylhydrazone molecular crystals CrystEngComm, 2021, 23, 4910-4916
7243086	CIF	C14 H13 N3 O4 S	P -1	5.6676; 10.5227; 12.1824 93.86; 94.947; 98.214	714.07	Hazarika, Pragyan J.; Gupta, Poonam; Gunnam, Anilkumar; Allu, Suryanarayana; Nangia, Ashwini K.; Nath, Naba K. Photomechanical response of sulfonylhydrazone molecular crystals CrystEngComm, 2021, 23, 4910-4916
7243087	CIF	C14 H13 N3 O4 S	P 1 21/c 1	20.0412; 10.228; 15.0199 90; 102.816; 90	3002.1	Hazarika, Pragyan J.; Gupta, Poonam; Gunnam, Anilkumar; Allu, Suryanarayana; Nangia, Ashwini K.; Nath, Naba K. Photomechanical response of sulfonylhydrazone molecular crystals CrystEngComm, 2021, 23, 4910-4916
7243088	CIF	C48 H55 N4 O2	P -1	11.9297; 12.924; 13.666 75.136; 78.644; 89.902	1994	Hu, Fangzhi; Wang, Liang; Ge, Chunyan; Li, Xinyao; Ding, Zhanshuai; Xu, Lubin; Li, Shuai-Shuai Divergent α-functionalization of cyclic amines via ring construction by molecular O2 oxidized dearomatization and ring deconstruction by aromatization-driven C‒C σ-bond cleavage Green Chemistry, 2021, 23, 5535-5541
7243089	CIF	C25 H34 N2 O2	R -3 :H	34.3408; 34.3408; 10.4316 90; 90; 120	10653.7	Hu, Fangzhi; Wang, Liang; Ge, Chunyan; Li, Xinyao; Ding, Zhanshuai; Xu, Lubin; Li, Shuai-Shuai Divergent α-functionalization of cyclic amines via ring construction by molecular O2 oxidized dearomatization and ring deconstruction by aromatization-driven C‒C σ-bond cleavage Green Chemistry, 2021, 23, 5535-5541
7243090	CIF	C21 H25 Cl N2 O	P 1 21/c 1	15.3242; 13.8242; 9.0303 90; 104.165; 90	1854.86	Hu, Fangzhi; Wang, Liang; Ge, Chunyan; Li, Xinyao; Ding, Zhanshuai; Xu, Lubin; Li, Shuai-Shuai Divergent α-functionalization of cyclic amines via ring construction by molecular O2 oxidized dearomatization and ring deconstruction by aromatization-driven C‒C σ-bond cleavage Green Chemistry, 2021, 23, 5535-5541
7243091	CIF	B5 H12 N O12	A e a 2	11.3246; 11.0147; 9.1513 90; 90; 90	1141.51	Kusy, Rafał; Grela, Karol Ligand-free (Z)-selective transfer semihydrogenation of alkynes catalyzed by in situ generated oxidizable copper nanoparticles Green Chemistry, 2021, 23, 5494-5502
7243092	CIF	C21 H17 N3 O2 S2	P -1	7.4642; 11.1508; 11.6693 92.468; 98.297; 99.779	944.85	Cao, Xian-Ting; Wei, Su-Ning; Sun, Hao-Tian; Li, Meng; Zheng, Zuo-Ling; Wang, Guannan Iridium-catalyzed regioselective C‒H sulfonamidation of 1,2,4-thiadiazoles with sulfonyl azides in water RSC Advances, 2021, 11, 22000-22004
7243093	CIF	C48 H30 Co2 N14 O14	P -1	10.1573; 12.9967; 17.941 106.658; 94.168; 92.148	2258.8	Tseng, Tien-Wen; Luo, Tzuoo-Tsair; Tseng, Kuo-Yang; Hong, Yu-Xian; Huang, Guang-Cheng Bent-bis(triazolyl)-based coordination polymers tuned by dicarboxylate ligands: syntheses, structures and properties CrystEngComm, 2021, 23, 5293-5305
7243094	CIF	C30 H24 Cd N6 O9 S	P 1 21/c 1	6.0668; 25.6268; 19.263 90; 93.306; 90	2989.9	Tseng, Tien-Wen; Luo, Tzuoo-Tsair; Tseng, Kuo-Yang; Hong, Yu-Xian; Huang, Guang-Cheng Bent-bis(triazolyl)-based coordination polymers tuned by dicarboxylate ligands: syntheses, structures and properties CrystEngComm, 2021, 23, 5293-5305
7243095	CIF	C31.25 H27.25 N6.25 O8.25 Zn	P -1	10.2125; 11.4153; 15.21 95.508; 102.091; 104.351	1659.1	Tseng, Tien-Wen; Luo, Tzuoo-Tsair; Tseng, Kuo-Yang; Hong, Yu-Xian; Huang, Guang-Cheng Bent-bis(triazolyl)-based coordination polymers tuned by dicarboxylate ligands: syntheses, structures and properties CrystEngComm, 2021, 23, 5293-5305
7243096	CIF	C24 H24 Cd N6 O6	C 1 2/c 1	27.066; 8; 23.551 90; 109.498; 90	4807	Tseng, Tien-Wen; Luo, Tzuoo-Tsair; Tseng, Kuo-Yang; Hong, Yu-Xian; Huang, Guang-Cheng Bent-bis(triazolyl)-based coordination polymers tuned by dicarboxylate ligands: syntheses, structures and properties CrystEngComm, 2021, 23, 5293-5305
7243097	CIF	C25 H17 N7 O6 Zn	P 1 21/c 1	16.038; 8.955; 17.558 90; 111.217; 90	2350.8	Tseng, Tien-Wen; Luo, Tzuoo-Tsair; Tseng, Kuo-Yang; Hong, Yu-Xian; Huang, Guang-Cheng Bent-bis(triazolyl)-based coordination polymers tuned by dicarboxylate ligands: syntheses, structures and properties CrystEngComm, 2021, 23, 5293-5305
7243098	CIF	C24 H17 N7 O8 Zn	P -1	7.2333; 9.681; 17.5939 98.331; 98.781; 103.468	1163.04	Tseng, Tien-Wen; Luo, Tzuoo-Tsair; Tseng, Kuo-Yang; Hong, Yu-Xian; Huang, Guang-Cheng Bent-bis(triazolyl)-based coordination polymers tuned by dicarboxylate ligands: syntheses, structures and properties CrystEngComm, 2021, 23, 5293-5305
7243099	CIF	C34 H26 Cd2 N6 O10	P 1 21/n 1	7.8677; 25.794; 16.371 90; 95.172; 90	3308.8	Tseng, Tien-Wen; Luo, Tzuoo-Tsair; Tseng, Kuo-Yang; Hong, Yu-Xian; Huang, Guang-Cheng Bent-bis(triazolyl)-based coordination polymers tuned by dicarboxylate ligands: syntheses, structures and properties CrystEngComm, 2021, 23, 5293-5305
7243100	CIF	B12 H13 K O25	P a -3	12.243; 12.243; 12.243 90; 90; 90	1835.1	Qiu, Qi-Ming; Yang, Guo-Yu From [B6O13]8− to [GaB5O13]8− to [Ga{B5O9(OH)}{BO(OH)2}]2−: synthesis, structure and nonlinear optical properties of new metal borates CrystEngComm, 2021, 23, 5200-5207
7243101	CIF	B6 Cs Ga H3 Na O13	P -1	7.027; 8.039; 11.442 108.567; 93.633; 90.442	611.2	Qiu, Qi-Ming; Yang, Guo-Yu From [B6O13]8− to [GaB5O13]8− to [Ga{B5O9(OH)}{BO(OH)2}]2−: synthesis, structure and nonlinear optical properties of new metal borates CrystEngComm, 2021, 23, 5200-5207
7243102	CIF	C2 H10 B5 Ga N2 O10	P 1 c 1	6.686; 8.082; 10.485 90; 97.192; 90	562.1	Qiu, Qi-Ming; Yang, Guo-Yu From [B6O13]8− to [GaB5O13]8− to [Ga{B5O9(OH)}{BO(OH)2}]2−: synthesis, structure and nonlinear optical properties of new metal borates CrystEngComm, 2021, 23, 5200-5207
7243103	CIF	C52 H44 N8 O14 S2 Zn2	P -1	11.9101; 14.8958; 16.5644 106.243; 109.77; 96.022	2589.55	Wang, Xiuli; Ma, Jianxin; Xu, Na; Wang, Yue; Sun, Jiayu; Liu, Guocheng Three Zn(ii) coordination polymers constructed with a new amide-thiophene-derived bis-pyridyl ligand as ultrasensitive luminescent sensors for Hg(ii) and purines CrystEngComm, 2021, 23, 4760-4766
7243104	CIF	C27 H22 N4 O6 S Zn	P -1	10.0385; 11.1557; 12.4792 79.339; 80.212; 68.539	1270.1	Wang, Xiuli; Ma, Jianxin; Xu, Na; Wang, Yue; Sun, Jiayu; Liu, Guocheng Three Zn(ii) coordination polymers constructed with a new amide-thiophene-derived bis-pyridyl ligand as ultrasensitive luminescent sensors for Hg(ii) and purines CrystEngComm, 2021, 23, 4760-4766
7243105	CIF	C26 H20 N4 O7 S Zn	P -1	9.8851; 10.896; 12.2041 82.082; 80.528; 68.643	1203.18	Wang, Xiuli; Ma, Jianxin; Xu, Na; Wang, Yue; Sun, Jiayu; Liu, Guocheng Three Zn(ii) coordination polymers constructed with a new amide-thiophene-derived bis-pyridyl ligand as ultrasensitive luminescent sensors for Hg(ii) and purines CrystEngComm, 2021, 23, 4760-4766
7243106	CIF	C12 H28 N2 Ni O2	P b c a	7.2917; 10.6849; 17.7929 90; 90; 90	1386.26	Wilson, Rachel L.; Macdonald, Thomas J.; Lin, Chieh-Ting; Xu, Shengda; Taylor, Alaric; Knapp, Caroline E.; Guldin, Stefan; McLachlan, Martyn A.; Carmalt, Claire J.; Blackman, Chris S. Chemical vapour deposition (CVD) of nickel oxide using the novel nickel dialkylaminoalkoxide precursor [Ni(dmamp′)2] (dmamp′ = 2-dimethylamino-2-methyl-1-propanolate) RSC Advances, 2021, 11, 22199-22205
7243107	CIF	C86 H144 N18 O19	P 1	12.2116; 14.5632; 14.5319 67.762; 86.941; 84.111	2379.2	Köhler, Linda; Hübler, Conrad; Seichter, Wilhelm; Mazik, Monika Binding modes of methyl α-d-glucopyranoside to an artificial receptor in crystalline complexes RSC Advances, 2021, 11, 22221-22229
7243108	CIF	C6 H8 Br2 Cu N2	P m m n :2	8.3552; 8.5782; 6.6959 90; 90; 90	479.91	Ding, Fei; Yang, Chuanlu; Gong, Xiangnan; Zheng, Hui; Zhou, Xiaoyu; Li, Lingli; Zhang, Lichun; Wang, Dehua; Pan, Bingying Structure, phase transition and properties of the one-dimensional antiferromagnet Cu(2,6-dimethylpyrazine)Br2 RSC Advances, 2021, 11, 22565-22570
7243109	CIF	C6 H8 Br2 Cu N2	P 1 21/n 1	10.2576; 8.3613; 11.2178 90; 102.982; 90	937.52	Ding, Fei; Yang, Chuanlu; Gong, Xiangnan; Zheng, Hui; Zhou, Xiaoyu; Li, Lingli; Zhang, Lichun; Wang, Dehua; Pan, Bingying Structure, phase transition and properties of the one-dimensional antiferromagnet Cu(2,6-dimethylpyrazine)Br2 RSC Advances, 2021, 11, 22565-22570
7243110	CIF	Bi2 Ni2 O10 P2	P -1	7.4211; 6.5606; 5.1633 83.817; 110.727; 123.412	195.03	Colmont, Marie; Zadoya, Anastasiya; Darie, Céline; Domingos, Cyril; Leclercq, Bastien; Mentré, Olivier Direct Bi3±-Bi3+ contacts mediated by lone pairs in the HP-BiNiO(PO4) polymorph CrystEngComm, 2021, 23, 5124-5130
7243111	CIF	C47 H33 Cl N2	P -1	9.4495; 11.2688; 18.2721 73.315; 82.268; 74.353	1791.27	Nagarasu, Palaniyappan; Kundu, Anu; Thiruvenkatam, Vijay; Raghavaiah, Pallepogu; Anthony, Savarimuthu Philip; Madhu, Vedichi Investigating the structure‒fluorescence properties of tetraphenylethylene fused imidazole AIEgens: reversible mechanofluorochromism and polymer matrix controlled fluorescence tuning CrystEngComm, 2021, 23, 5403-5410
7243112	CIF	C47 H34 N2	P -1	9.397; 10.5684; 19.829 100.913; 91.886; 113.365	1762.3	Nagarasu, Palaniyappan; Kundu, Anu; Thiruvenkatam, Vijay; Raghavaiah, Pallepogu; Anthony, Savarimuthu Philip; Madhu, Vedichi Investigating the structure‒fluorescence properties of tetraphenylethylene fused imidazole AIEgens: reversible mechanofluorochromism and polymer matrix controlled fluorescence tuning CrystEngComm, 2021, 23, 5403-5410
7243113	CIF	C47 H33 F N2	P -1	9.3263; 10.8791; 19.822 98.441; 94.465; 114.358	1790.8	Nagarasu, Palaniyappan; Kundu, Anu; Thiruvenkatam, Vijay; Raghavaiah, Pallepogu; Anthony, Savarimuthu Philip; Madhu, Vedichi Investigating the structure‒fluorescence properties of tetraphenylethylene fused imidazole AIEgens: reversible mechanofluorochromism and polymer matrix controlled fluorescence tuning CrystEngComm, 2021, 23, 5403-5410
7243114	CIF	C71 H72 Cd7 N12 O49	C 1 2 1	29.6992; 14.6641; 25.7385 90; 108.808; 90	10610.9	Li, Yang; Chen, Shumei; Xu, Zhong-Xuan; Wu, Xin; Zhang, Huabin; Zhang, Jian Asymmetric metal‒organic frameworks with double helices for enantioselective recognition CrystEngComm, 2021, 23, 4748-4751
7243115	CIF	C72 H72 Cd7 N12 O49	C 1 2 1	29.771; 14.658; 25.708 90; 108.927; 90	10612	Li, Yang; Chen, Shumei; Xu, Zhong-Xuan; Wu, Xin; Zhang, Huabin; Zhang, Jian Asymmetric metal‒organic frameworks with double helices for enantioselective recognition CrystEngComm, 2021, 23, 4748-4751
7243116	CIF	C44 H26 F9 N4 O6 Y	P n a 21	21.53; 10.926; 18.35 90; 90; 90	4317	Cen, Peipei; He, Zixin; Ding, Runmei; Yang, Huifang; Li, Li; Zhang, Yi-Quan; Li, Yonghong; Tian, Danian; Liu, Xiangyu Modulating the slow magnetic relaxation of a mononuclear Dy(iii) single-molecule magnet via a magnetic field and dilution effects CrystEngComm, 2021, 23, 5443-5450
7243117	CIF	C44 H26 F9 N4 O6 Y	P n a 21	21.3258; 10.8147; 17.9497 90; 90; 90	4139.8	Cen, Peipei; He, Zixin; Ding, Runmei; Yang, Huifang; Li, Li; Zhang, Yi-Quan; Li, Yonghong; Tian, Danian; Liu, Xiangyu Modulating the slow magnetic relaxation of a mononuclear Dy(iii) single-molecule magnet via a magnetic field and dilution effects CrystEngComm, 2021, 23, 5443-5450
7243118	CIF	C32 H36 Cu2 N4 O8	P -1	8.5547; 9.8407; 10.2731 113.733; 99.453; 92.307	775.51	Mukherjee, Debojyoti; Nag, Probal; Shteinman, Albert A.; Vennapusa, Sivaranjana Reddy; Mandal, Ujjwal; Mitra, Mainak Catechol oxidation promoted by bridging phenoxo moieties in a bis(μ-phenoxo)-bridged dicopper(ii) complex RSC Advances, 2021, 11, 22951-22959
7243119	CIF	C16 H15 I O2 S	P 21 21 21	5.4771; 9.0324; 31.6646 90; 90; 90	1566.49	Lin, Li; Yang, Zhonglie; Liu, Jianchen; Wang, Jingxia; Zheng, Jiale; Li, Jun-Long; Zhang, Xiaobin; Liu, Xiang-Wei; Jiang, Hezhong; Li, Jiahong Visible-light-induced surfactant-promoted sulfonylation of alkenes and alkynes with sulfonyl chloride by the formation of an EDA-complex with NaI in water at room temperature Green Chemistry, 2021, 23, 5467-5473
7243120	CIF	C60 H53 Cl N4 Ni4 O12	P 1 21/c 1	16.831; 23.697; 14.715 90; 92.577; 90	5863.1	Kushvaha, Saroj Kumar; Francis, Maria; Kumar, Jayasree; Nag, Ekta; Ravichandran, Prathap; Roy, Sudipta; Chandra Mondal, Kartik Synthesis, oligomerization and catalytic studies of a redox-active Ni4-cubane: a detailed mechanistic investigation RSC Advances, 2021, 11, 22849-22858
7243121	CIF	C16 H16 O2	P 1 21/c 1	11.421; 15.783; 7.4458 90; 93.411; 90	1339.8	Kushvaha, Saroj Kumar; Francis, Maria; Kumar, Jayasree; Nag, Ekta; Ravichandran, Prathap; Roy, Sudipta; Chandra Mondal, Kartik Synthesis, oligomerization and catalytic studies of a redox-active Ni4-cubane: a detailed mechanistic investigation RSC Advances, 2021, 11, 22849-22858
7243122	CIF	C64 H65 Cl2 N5 Ni4 O14	P -1	14.07; 14.216; 19.039 76.64; 68.85; 63.449	3166	Kushvaha, Saroj Kumar; Francis, Maria; Kumar, Jayasree; Nag, Ekta; Ravichandran, Prathap; Roy, Sudipta; Chandra Mondal, Kartik Synthesis, oligomerization and catalytic studies of a redox-active Ni4-cubane: a detailed mechanistic investigation RSC Advances, 2021, 11, 22849-22858
7243123	CIF	C24 H27 N O5	P 21 21 21	9.2258; 15.495; 15.6334 90; 90; 90	2234.9	Kushvaha, Saroj Kumar; Francis, Maria; Kumar, Jayasree; Nag, Ekta; Ravichandran, Prathap; Roy, Sudipta; Chandra Mondal, Kartik Synthesis, oligomerization and catalytic studies of a redox-active Ni4-cubane: a detailed mechanistic investigation RSC Advances, 2021, 11, 22849-22858
7243124	CIF	C17 H14 O2 S	P 1 21/c 1	11.6106; 16.0508; 7.5624 90; 104.79; 90	1362.63	Klöpfer, Viktor; Eckl, Robert; Floß, Johannes; Roth, Philippe M. C.; Reiser, Oliver; Barham, Joshua P. Catalyst-free, scalable heterocyclic flow photocyclopropanation Green Chemistry, 2021, 23, 6366-6372
7243125	CIF	C8 H4 Cu N4 O2	P 1 21/c 1	5.1833; 23.147; 6.8285 90; 107.681; 90	780.57	Hua, Feng-Zhen; Feng, Chao; Zhang, Ling-Mei; Yang, Yu-Meng; Zhang, Guo-Ning; Wang, Yu-Cheng; Zhao, Hong Electrochemiluminescence properties and luminescence sensing of four novel polymers derived from 3-(pyrazin-2-yl)-1H-pyrazole-5-carboxylic acid CrystEngComm, 2021, 23, 5463-5474
7243126	CIF	C8 H8 Cl N4 O4 Zn1.5	P -1	6.8724; 8.5555; 10.8947 103.025; 102.889; 111.241	547.97	Hua, Feng-Zhen; Feng, Chao; Zhang, Ling-Mei; Yang, Yu-Meng; Zhang, Guo-Ning; Wang, Yu-Cheng; Zhao, Hong Electrochemiluminescence properties and luminescence sensing of four novel polymers derived from 3-(pyrazin-2-yl)-1H-pyrazole-5-carboxylic acid CrystEngComm, 2021, 23, 5463-5474
7243127	CIF	C8 H6 N4 Ni O4	P 1 21/c 1	8.5821; 13.578; 9.2842 90; 116.067; 90	971.8	Hua, Feng-Zhen; Feng, Chao; Zhang, Ling-Mei; Yang, Yu-Meng; Zhang, Guo-Ning; Wang, Yu-Cheng; Zhao, Hong Electrochemiluminescence properties and luminescence sensing of four novel polymers derived from 3-(pyrazin-2-yl)-1H-pyrazole-5-carboxylic acid CrystEngComm, 2021, 23, 5463-5474
7243128	CIF	C8 H5 Cl N4 O2 Pb	P 1 21/c 1	13.8772; 9.5629; 7.5481 90; 94.152; 90	999.05	Hua, Feng-Zhen; Feng, Chao; Zhang, Ling-Mei; Yang, Yu-Meng; Zhang, Guo-Ning; Wang, Yu-Cheng; Zhao, Hong Electrochemiluminescence properties and luminescence sensing of four novel polymers derived from 3-(pyrazin-2-yl)-1H-pyrazole-5-carboxylic acid CrystEngComm, 2021, 23, 5463-5474
7243129	CIF	C16 H16 Co0.67 N2 O6	C m c e	20.5149; 16.0901; 15.5524 90; 90; 90	5133.6	Mylonas-Margaritis, Ioannis; Mayans, Júlia; Tong, Wenming; Farràs, Pau; Escuer, Albert; McArdle, Patrick; Papatriantafyllopoulou, Constantina Synthesis and characterization of new coordination compounds by the use of 2-pyridinemethanol and di- or tricarboxylic acids CrystEngComm, 2021, 23, 5489-5497
7243130	CIF	C23 H22 N3 O7 Zn2	P n a 21	17.034; 11.4043; 12.6992 90; 90; 90	2466.96	Mylonas-Margaritis, Ioannis; Mayans, Júlia; Tong, Wenming; Farràs, Pau; Escuer, Albert; McArdle, Patrick; Papatriantafyllopoulou, Constantina Synthesis and characterization of new coordination compounds by the use of 2-pyridinemethanol and di- or tricarboxylic acids CrystEngComm, 2021, 23, 5489-5497
7243131	CIF	C14.5 H11.5 N1.5 Ni0.75 O6.62	I 1 2/m 1	11.3588; 30.0187; 12.2991 90; 117.471; 90	3720.8	Mylonas-Margaritis, Ioannis; Mayans, Júlia; Tong, Wenming; Farràs, Pau; Escuer, Albert; McArdle, Patrick; Papatriantafyllopoulou, Constantina Synthesis and characterization of new coordination compounds by the use of 2-pyridinemethanol and di- or tricarboxylic acids CrystEngComm, 2021, 23, 5489-5497
7243132	CIF	C46 H38 N6 Ni2 O18	C m c e	20.5127; 16.0761; 15.2569 90; 90; 90	5031.2	Mylonas-Margaritis, Ioannis; Mayans, Júlia; Tong, Wenming; Farràs, Pau; Escuer, Albert; McArdle, Patrick; Papatriantafyllopoulou, Constantina Synthesis and characterization of new coordination compounds by the use of 2-pyridinemethanol and di- or tricarboxylic acids CrystEngComm, 2021, 23, 5489-5497
7243133	CIF	C40 H36 Fe3 N4 O12	P 1 21/n 1	10.4617; 14.6431; 12.7995 90; 97.576; 90	1943.7	Mylonas-Margaritis, Ioannis; Mayans, Júlia; Tong, Wenming; Farràs, Pau; Escuer, Albert; McArdle, Patrick; Papatriantafyllopoulou, Constantina Synthesis and characterization of new coordination compounds by the use of 2-pyridinemethanol and di- or tricarboxylic acids CrystEngComm, 2021, 23, 5489-5497
7243134	CIF	C8 H17 N O9	P 1 21 1	6.1846; 27.8403; 7.4558 90; 109.007; 90	1213.76	Losev, E. A.; Pishchur, D. P.; Boldyreva, E. V. A new monohydrated molecular salt of GABA with l-tartaric acid: the structure-forming role of water CrystEngComm, 2021, 23, 6086-6092
7243135	CIF	C32 H30 Ag2 N7 O8.5	P -1	11.388; 12.621; 14.493 100.52; 109.121; 97.132	1896.7	Jiang, Wei; Lv, Mengying; Gao, Baihui; Liu, Bo; Yan, Guosong; Zhou, Shi; Liu, Chunbo; Xie, Wei; Che, Guangbo Facile construction of an Ag0-doped Ag(i)-based coordination polymer via a self-photoreduction strategy for enhanced visible light driven photocatalysis CrystEngComm, 2021, 23, 5397-5402
7243136	CIF	C36 H64 Cu6 Mo12 N20 O62 Te2	C 1 2/c 1	16.206; 13.665; 19.848 90; 105.603; 90	4233.5	Ying, Jun; Sun, Chenxi; Jin, Liang; Tian, Aixiang; Wang, Xiuli Five compounds based on [TeMo6O24]6− and [β-Mo8O26]4− anions synthesized by using different symmetrical and asymmetric N-donor ligands CrystEngComm, 2021, 23, 5385-5396
7243137	CIF	C12 H44 Cu2 Mo6 N8 O30 Te	P 1 21/n 1	10.4645; 14.6884; 13.0321 90; 95.1; 90	1995.2	Ying, Jun; Sun, Chenxi; Jin, Liang; Tian, Aixiang; Wang, Xiuli Five compounds based on [TeMo6O24]6− and [β-Mo8O26]4− anions synthesized by using different symmetrical and asymmetric N-donor ligands CrystEngComm, 2021, 23, 5385-5396
7243138	CIF	C52 H72 Cu4 Mo16 N24 O54	C 1 2/c 1	12.79; 21.231; 19.024 90; 97.734; 90	5118.9	Ying, Jun; Sun, Chenxi; Jin, Liang; Tian, Aixiang; Wang, Xiuli Five compounds based on [TeMo6O24]6− and [β-Mo8O26]4− anions synthesized by using different symmetrical and asymmetric N-donor ligands CrystEngComm, 2021, 23, 5385-5396
7243139	CIF	C13 H16 Cu Mo4 N4 O15	P 1 21/n 1	10.7719; 18.3338; 12.7561 90; 113.685; 90	2307	Ying, Jun; Sun, Chenxi; Jin, Liang; Tian, Aixiang; Wang, Xiuli Five compounds based on [TeMo6O24]6− and [β-Mo8O26]4− anions synthesized by using different symmetrical and asymmetric N-donor ligands CrystEngComm, 2021, 23, 5385-5396
7243140	CIF	C26 H42 Cu5 Mo12 N12 O56 Te2	P -1	11.1044; 11.8366; 13.6033 77.836; 72.274; 85.532	1664.7	Ying, Jun; Sun, Chenxi; Jin, Liang; Tian, Aixiang; Wang, Xiuli Five compounds based on [TeMo6O24]6− and [β-Mo8O26]4− anions synthesized by using different symmetrical and asymmetric N-donor ligands CrystEngComm, 2021, 23, 5385-5396
7243141	CIF	C16 H14 Cu N8	P 1 21/c 1	5.3383; 9.0913; 15.5717 90; 95.648; 90	752.06	Petrenko, Yuliia P.; Piasta, Karolina; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Shova, Sergiu; Novitchi, Ghénadie; Toporivska, Yuliya; Gumienna-Kontecka, Elzbieta; Martins, Luísa M. D. R. S.; Lampeka, Rostyslav D. An investigation of two copper(ii) complexes with a triazole derivative as a ligand: magnetic and catalytic properties RSC Advances, 2021, 11, 23442-23449
7243142	CIF	C20 H24 Cu2 N8 O6	C 1 2/c 1	22.4328; 7.23016; 15.4337 90; 107.996; 90	2380.77	Petrenko, Yuliia P.; Piasta, Karolina; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Shova, Sergiu; Novitchi, Ghénadie; Toporivska, Yuliya; Gumienna-Kontecka, Elzbieta; Martins, Luísa M. D. R. S.; Lampeka, Rostyslav D. An investigation of two copper(ii) complexes with a triazole derivative as a ligand: magnetic and catalytic properties RSC Advances, 2021, 11, 23442-23449
7243143	CIF	C43 H54 As0.55 F6 Fe N O8 P0.45	P -1	10.188; 11.162; 19.431 86.926; 77.759; 88.866	2156.2	Suzaki, Yuji; Fukuchi, Yugo; Tadami, Hiroko; Koizumi, Take-aki; Osakada, Kohtaro; Ide, Tomohito; Horie, Masaki; Hoshino, Norihisa; Akutagawa, Tomoyuki Further investigations of the crystal-to-crystal phase transition of a [2]pseudorotaxane composed of ferrocene-terminated dialkylammonium and dibenzo[24]crown-8-ether CrystEngComm, 2021, 23, 5944-5952
7243144	CIF	C43 H54 F6 Fe N O8 P	P -1	10.1785; 11.0668; 19.4314 86.883; 77.412; 88.969	2133	Suzaki, Yuji; Fukuchi, Yugo; Tadami, Hiroko; Koizumi, Take-aki; Osakada, Kohtaro; Ide, Tomohito; Horie, Masaki; Hoshino, Norihisa; Akutagawa, Tomoyuki Further investigations of the crystal-to-crystal phase transition of a [2]pseudorotaxane composed of ferrocene-terminated dialkylammonium and dibenzo[24]crown-8-ether CrystEngComm, 2021, 23, 5944-5952
7243145	CIF	C43 H54 As0.49 F6 Fe N O8 P0.51	P -1	10.204; 11.089; 19.442 86.955; 77.616; 88.875	2145.6	Suzaki, Yuji; Fukuchi, Yugo; Tadami, Hiroko; Koizumi, Take-aki; Osakada, Kohtaro; Ide, Tomohito; Horie, Masaki; Hoshino, Norihisa; Akutagawa, Tomoyuki Further investigations of the crystal-to-crystal phase transition of a [2]pseudorotaxane composed of ferrocene-terminated dialkylammonium and dibenzo[24]crown-8-ether CrystEngComm, 2021, 23, 5944-5952
7243146	CIF	C43 H54 As0.67 F6 Fe N O8 P0.33	P -1	10.175; 11.163; 19.424 86.799; 77.778; 88.65	2152.7	Suzaki, Yuji; Fukuchi, Yugo; Tadami, Hiroko; Koizumi, Take-aki; Osakada, Kohtaro; Ide, Tomohito; Horie, Masaki; Hoshino, Norihisa; Akutagawa, Tomoyuki Further investigations of the crystal-to-crystal phase transition of a [2]pseudorotaxane composed of ferrocene-terminated dialkylammonium and dibenzo[24]crown-8-ether CrystEngComm, 2021, 23, 5944-5952
7243147	CIF	C43 H54 F6 Fe N O8 P0.92 Sb0.08	P -1	10.203; 11.091; 19.44 86.95; 77.515; 88.98	2144.8	Suzaki, Yuji; Fukuchi, Yugo; Tadami, Hiroko; Koizumi, Take-aki; Osakada, Kohtaro; Ide, Tomohito; Horie, Masaki; Hoshino, Norihisa; Akutagawa, Tomoyuki Further investigations of the crystal-to-crystal phase transition of a [2]pseudorotaxane composed of ferrocene-terminated dialkylammonium and dibenzo[24]crown-8-ether CrystEngComm, 2021, 23, 5944-5952
7243148	CIF	C43 H54 F6 Fe N O8 P0.35 Sb0.65	P -1	10.163; 11.824; 17.902 85.765; 86.936; 87.915	2141.2	Suzaki, Yuji; Fukuchi, Yugo; Tadami, Hiroko; Koizumi, Take-aki; Osakada, Kohtaro; Ide, Tomohito; Horie, Masaki; Hoshino, Norihisa; Akutagawa, Tomoyuki Further investigations of the crystal-to-crystal phase transition of a [2]pseudorotaxane composed of ferrocene-terminated dialkylammonium and dibenzo[24]crown-8-ether CrystEngComm, 2021, 23, 5944-5952
7243149	CIF	C43 H54 As0.36 F6 Fe N O8 P0.64	P -1	10.194; 11.112; 19.439 86.85; 77.726; 88.805	2148.3	Suzaki, Yuji; Fukuchi, Yugo; Tadami, Hiroko; Koizumi, Take-aki; Osakada, Kohtaro; Ide, Tomohito; Horie, Masaki; Hoshino, Norihisa; Akutagawa, Tomoyuki Further investigations of the crystal-to-crystal phase transition of a [2]pseudorotaxane composed of ferrocene-terminated dialkylammonium and dibenzo[24]crown-8-ether CrystEngComm, 2021, 23, 5944-5952
7243150	CIF	C43 H54 As0.72 F6 Fe N O8 P0.28	P -1	10.171; 11.182; 19.436 86.772; 77.689; 88.611	2156.1	Suzaki, Yuji; Fukuchi, Yugo; Tadami, Hiroko; Koizumi, Take-aki; Osakada, Kohtaro; Ide, Tomohito; Horie, Masaki; Hoshino, Norihisa; Akutagawa, Tomoyuki Further investigations of the crystal-to-crystal phase transition of a [2]pseudorotaxane composed of ferrocene-terminated dialkylammonium and dibenzo[24]crown-8-ether CrystEngComm, 2021, 23, 5944-5952
7243151	CIF	C43 H54 F6 Fe N O8 P0.84 Sb0.16	P -1	10.17; 11.106; 19.439 86.836; 77.378; 88.73	2139.2	Suzaki, Yuji; Fukuchi, Yugo; Tadami, Hiroko; Koizumi, Take-aki; Osakada, Kohtaro; Ide, Tomohito; Horie, Masaki; Hoshino, Norihisa; Akutagawa, Tomoyuki Further investigations of the crystal-to-crystal phase transition of a [2]pseudorotaxane composed of ferrocene-terminated dialkylammonium and dibenzo[24]crown-8-ether CrystEngComm, 2021, 23, 5944-5952
7243152	CIF	C43 H54 F6 Fe N O8 P	P 1 2/c 1	21.497; 9.893; 22.324 90; 116.199; 90	4259.9	Suzaki, Yuji; Fukuchi, Yugo; Tadami, Hiroko; Koizumi, Take-aki; Osakada, Kohtaro; Ide, Tomohito; Horie, Masaki; Hoshino, Norihisa; Akutagawa, Tomoyuki Further investigations of the crystal-to-crystal phase transition of a [2]pseudorotaxane composed of ferrocene-terminated dialkylammonium and dibenzo[24]crown-8-ether CrystEngComm, 2021, 23, 5944-5952
7243153	CIF	C43 H54 F6 Fe N O8 P0.484 Sb0.516	P -1	10.139; 11.679; 17.971 85.655; 87.434; 88.542	2119.2	Suzaki, Yuji; Fukuchi, Yugo; Tadami, Hiroko; Koizumi, Take-aki; Osakada, Kohtaro; Ide, Tomohito; Horie, Masaki; Hoshino, Norihisa; Akutagawa, Tomoyuki Further investigations of the crystal-to-crystal phase transition of a [2]pseudorotaxane composed of ferrocene-terminated dialkylammonium and dibenzo[24]crown-8-ether CrystEngComm, 2021, 23, 5944-5952
7243154	CIF	C164 H108 Co4 N28 O16	P 1 21/c 1	9.4922; 39.4939; 9.7199 90; 110.321; 90	3417.05	Ren, Zhu-Meng; Wang, Lu-Lu; Wang, Jin-Miao; Zhu, Bin; Gao, Qiang; Wang, Mei; Shao, Feng; Fan, Yu-Hua Five novel MOFs with various dimensions as efficient catalysts for oxygen evolution reactions CrystEngComm, 2021, 23, 5475-5480
7243155	CIF	C26 H20 Mn N4 O5	P -1	9.311; 10.2559; 14.891 105.346; 94.24; 115.645	1206.8	Ren, Zhu-Meng; Wang, Lu-Lu; Wang, Jin-Miao; Zhu, Bin; Gao, Qiang; Wang, Mei; Shao, Feng; Fan, Yu-Hua Five novel MOFs with various dimensions as efficient catalysts for oxygen evolution reactions CrystEngComm, 2021, 23, 5475-5480
7243156	CIF	C46 H36 Mn2 N6 O13	P -1	10.0622; 10.432; 11.9877 67.814; 71.39; 68.516	1060.07	Ren, Zhu-Meng; Wang, Lu-Lu; Wang, Jin-Miao; Zhu, Bin; Gao, Qiang; Wang, Mei; Shao, Feng; Fan, Yu-Hua Five novel MOFs with various dimensions as efficient catalysts for oxygen evolution reactions CrystEngComm, 2021, 23, 5475-5480
7243157	CIF	C27 H22 Mn N4 O5	P -1	9.2544; 10.3343; 14.8355 105.384; 93.551; 116.082	1202.28	Ren, Zhu-Meng; Wang, Lu-Lu; Wang, Jin-Miao; Zhu, Bin; Gao, Qiang; Wang, Mei; Shao, Feng; Fan, Yu-Hua Five novel MOFs with various dimensions as efficient catalysts for oxygen evolution reactions CrystEngComm, 2021, 23, 5475-5480
7243158	CIF	C23 H15 N3 Ni O5	P 1 21/n 1	13.1164; 16.1174; 14.7873 90; 109.782; 90	2941.59	Ren, Zhu-Meng; Wang, Lu-Lu; Wang, Jin-Miao; Zhu, Bin; Gao, Qiang; Wang, Mei; Shao, Feng; Fan, Yu-Hua Five novel MOFs with various dimensions as efficient catalysts for oxygen evolution reactions CrystEngComm, 2021, 23, 5475-5480
7243159	CIF	C4 H N9 O6	P 1 21 1	6.2831; 6.0046; 13.003 90; 91.56; 90	490.39	Gulyaev, Dmitry A.; Klenov, Michael S.; Churakov, Aleksandr M.; Strelenko, Yurii A.; Fedyanin, Ivan V.; Lempert, David B.; Kosareva, Ekaterina K.; Kon'kova, Tatiana S.; Matyushin, Yurii N.; Tartakovsky, Vladimir A. [(3-Nitro-1H-1,2,4-triazol-1-yl)-NNO-azoxy]furazans: energetic materials containing an N(O)N‒N fragment RSC Advances, 2021, 11, 24013-24021
7243160	CIF	C4 H3 N9 O4	P 21 21 21	4.8786; 7.9416; 22.587 90; 90; 90	875.1	Gulyaev, Dmitry A.; Klenov, Michael S.; Churakov, Aleksandr M.; Strelenko, Yurii A.; Fedyanin, Ivan V.; Lempert, David B.; Kosareva, Ekaterina K.; Kon'kova, Tatiana S.; Matyushin, Yurii N.; Tartakovsky, Vladimir A. [(3-Nitro-1H-1,2,4-triazol-1-yl)-NNO-azoxy]furazans: energetic materials containing an N(O)N‒N fragment RSC Advances, 2021, 11, 24013-24021
7243161	CIF	C8 H2 N18 O8	P b c n	17.283; 7.552; 13.411 90; 90; 90	1750.4	Gulyaev, Dmitry A.; Klenov, Michael S.; Churakov, Aleksandr M.; Strelenko, Yurii A.; Fedyanin, Ivan V.; Lempert, David B.; Kosareva, Ekaterina K.; Kon'kova, Tatiana S.; Matyushin, Yurii N.; Tartakovsky, Vladimir A. [(3-Nitro-1H-1,2,4-triazol-1-yl)-NNO-azoxy]furazans: energetic materials containing an N(O)N‒N fragment RSC Advances, 2021, 11, 24013-24021
7243162	CIF	C36 H30 N4 O8 Zn	P -1	9.764; 11.687; 15.345 106.065; 91.671; 102.175	1637.7	Yang, Xue; Ren, Yixia; Chai, Hongmei; Hou, Xiufang; Wang, Zhixiang; Wang, Jijiang Highly sensitive detection of nitrobenzene by a series of fluorescent 2D zinc(ii) metal‒organic frameworks with a flexible triangular ligand RSC Advances, 2021, 11, 23975-23984
7243163	CIF	C34 H24 N4 O8 Zn2	P 1 21/n 1	15.9212; 11.5181; 17.0439 90; 105.53; 90	3011.4	Yang, Xue; Ren, Yixia; Chai, Hongmei; Hou, Xiufang; Wang, Zhixiang; Wang, Jijiang Highly sensitive detection of nitrobenzene by a series of fluorescent 2D zinc(ii) metal‒organic frameworks with a flexible triangular ligand RSC Advances, 2021, 11, 23975-23984
7243164	CIF	C34 H26 N6 O8.5 Zn2	P -1	10.203; 11.768; 14.073 86.764; 80.749; 77.297	1626.5	Yang, Xue; Ren, Yixia; Chai, Hongmei; Hou, Xiufang; Wang, Zhixiang; Wang, Jijiang Highly sensitive detection of nitrobenzene by a series of fluorescent 2D zinc(ii) metal‒organic frameworks with a flexible triangular ligand RSC Advances, 2021, 11, 23975-23984
7243165	CIF	C26 H18 N2 O7 Zn	P -1	7.427; 12.0551; 13.0522 82.543; 86.438; 77.641	1131.16	Yang, Xue; Ren, Yixia; Chai, Hongmei; Hou, Xiufang; Wang, Zhixiang; Wang, Jijiang Highly sensitive detection of nitrobenzene by a series of fluorescent 2D zinc(ii) metal‒organic frameworks with a flexible triangular ligand RSC Advances, 2021, 11, 23975-23984
7243166	CIF	C4 H12 Cl2 Cu O2 S2	P n m a	7.9376; 11.4925; 11.3612 90; 90; 90	1036.4	Bernabé Vírseda, Ignacio; Siddiqui, Shiraz Ahmed; Prado-Roller, Alexander; Eisterer, Michael; Shiozawa, Hidetsugu Crystal engineering with copper and melamine RSC Advances, 2021, 11, 23943-23947
7243167	CIF	C6 H15 Cl Cu N6 O2 S	P -1	10.4677; 11.58; 14.375 106.116; 99.25; 102.092	1591.8	Bernabé Vírseda, Ignacio; Siddiqui, Shiraz Ahmed; Prado-Roller, Alexander; Eisterer, Michael; Shiozawa, Hidetsugu Crystal engineering with copper and melamine RSC Advances, 2021, 11, 23943-23947
7243168	CIF	C24 H26 N4 O7 Zn	P 1 2/c 1	9.9904; 6.0482; 21.616 90; 101.289; 90	1280.85	Alamgir,; Talha, Khalid; Wang, Ying-Jie; Ullah, Raza; Wang, Bin; Wang, Lu; Wu, Wei; Chen, Sha; Xie, Lin-Hua; Li, Jian-Rong Construction of a mixed ligand MOF as “green catalyst” for the photocatalytic degradation of organic dye in aqueous media RSC Advances, 2021, 11, 23838-23845
7243169	CIF	C21 H25 B10 N	P 1 21/c 1	12.573; 14.319; 13.473 90; 113.15; 90	2230.3	Lee, Seok Ho; Mun, Min Sik; Kim, Mingi; Lee, Ji Hye; Hwang, Hyonseok; Lee, Wonchul; Lee, Kang Mun Alteration of intramolecular electronic transition via deboronation of carbazole-based o-carboranyl compound and intriguing ‘turn-on’ emissive variation RSC Advances, 2021, 11, 24057-24064
7243170	CIF	C6 H16 Co N2 O6	C 1 2/c 1	16.8488; 9.3909; 6.8017 90; 97.788; 90	1066.28	Vušak, Darko; Smrečki, Neven; Muratović, Senada; Žilić, Dijana; Prugovečki, Biserka; Matković-Čalogović, Dubravka Structural diversity in the coordination compounds of cobalt, nickel and copper with N-alkylglycinates: crystallographic and ESR study in the solid state RSC Advances, 2021, 11, 23779-23790
7243171	CIF	C8 H20 Co N2 O6	P -1	5.4524; 7.1733; 8.7708 113.139; 91.989; 106.635	297.99	Vušak, Darko; Smrečki, Neven; Muratović, Senada; Žilić, Dijana; Prugovečki, Biserka; Matković-Čalogović, Dubravka Structural diversity in the coordination compounds of cobalt, nickel and copper with N-alkylglycinates: crystallographic and ESR study in the solid state RSC Advances, 2021, 11, 23779-23790
7243172	CIF	C12 H30 Co2 N4 O12	P b c a	15.5085; 14.6844; 18.0637 90; 90; 90	4113.7	Vušak, Darko; Smrečki, Neven; Muratović, Senada; Žilić, Dijana; Prugovečki, Biserka; Matković-Čalogović, Dubravka Structural diversity in the coordination compounds of cobalt, nickel and copper with N-alkylglycinates: crystallographic and ESR study in the solid state RSC Advances, 2021, 11, 23779-23790
7243173	CIF	C10 H24 Cu N2 O6	P 1 21/c 1	11.5413; 11.2713; 5.8447 90; 93.037; 90	759.24	Vušak, Darko; Smrečki, Neven; Muratović, Senada; Žilić, Dijana; Prugovečki, Biserka; Matković-Čalogović, Dubravka Structural diversity in the coordination compounds of cobalt, nickel and copper with N-alkylglycinates: crystallographic and ESR study in the solid state RSC Advances, 2021, 11, 23779-23790
7243174	CIF	C8 H20 N2 Ni O6	P -1	5.4231; 7.1382; 8.7608 113.806; 91.508; 106.771	293.11	Vušak, Darko; Smrečki, Neven; Muratović, Senada; Žilić, Dijana; Prugovečki, Biserka; Matković-Čalogović, Dubravka Structural diversity in the coordination compounds of cobalt, nickel and copper with N-alkylglycinates: crystallographic and ESR study in the solid state RSC Advances, 2021, 11, 23779-23790
7243175	CIF	C10 H24 Cu N2 O6	I 1 2/a 1	9.3725; 7.3714; 21.2849 90; 90.496; 90	1470.49	Vušak, Darko; Smrečki, Neven; Muratović, Senada; Žilić, Dijana; Prugovečki, Biserka; Matković-Čalogović, Dubravka Structural diversity in the coordination compounds of cobalt, nickel and copper with N-alkylglycinates: crystallographic and ESR study in the solid state RSC Advances, 2021, 11, 23779-23790
7243176	CIF	C10 H24 Co N2 O6	P 1 21/c 1	10.4296; 7.2609; 10.0987 90; 107.734; 90	728.42	Vušak, Darko; Smrečki, Neven; Muratović, Senada; Žilić, Dijana; Prugovečki, Biserka; Matković-Čalogović, Dubravka Structural diversity in the coordination compounds of cobalt, nickel and copper with N-alkylglycinates: crystallographic and ESR study in the solid state RSC Advances, 2021, 11, 23779-23790
7243177	CIF	C8 H20 Co N2 O6	P -1	5.4717; 7.1941; 8.8468 113.095; 92.008; 106.385	303.11	Vušak, Darko; Smrečki, Neven; Muratović, Senada; Žilić, Dijana; Prugovečki, Biserka; Matković-Čalogović, Dubravka Structural diversity in the coordination compounds of cobalt, nickel and copper with N-alkylglycinates: crystallographic and ESR study in the solid state RSC Advances, 2021, 11, 23779-23790
7243178	CIF	C8 H20 N2 Ni O6	P -1	5.44882; 7.15455; 8.83552 113.692; 91.6006; 106.561	298.32	Vušak, Darko; Smrečki, Neven; Muratović, Senada; Žilić, Dijana; Prugovečki, Biserka; Matković-Čalogović, Dubravka Structural diversity in the coordination compounds of cobalt, nickel and copper with N-alkylglycinates: crystallographic and ESR study in the solid state RSC Advances, 2021, 11, 23779-23790
7243179	CIF	C8 H16 Cu N2 O4	P 1 21/c 1	10.0467; 6.3568; 9.0286 90; 114.398; 90	525.12	Vušak, Darko; Smrečki, Neven; Muratović, Senada; Žilić, Dijana; Prugovečki, Biserka; Matković-Čalogović, Dubravka Structural diversity in the coordination compounds of cobalt, nickel and copper with N-alkylglycinates: crystallographic and ESR study in the solid state RSC Advances, 2021, 11, 23779-23790
7243180	CIF	C6 H16 Cu N2 O6	P -1	7.0311; 7.4825; 10.6021 78.541; 89.938; 78.408	535.07	Vušak, Darko; Smrečki, Neven; Muratović, Senada; Žilić, Dijana; Prugovečki, Biserka; Matković-Čalogović, Dubravka Structural diversity in the coordination compounds of cobalt, nickel and copper with N-alkylglycinates: crystallographic and ESR study in the solid state RSC Advances, 2021, 11, 23779-23790
7243181	CIF	C6 H12 Cu N2 O4	P 1 21/c 1	7.9367; 5.9953; 9.0214 90; 90.522; 90	429.247	Vušak, Darko; Smrečki, Neven; Muratović, Senada; Žilić, Dijana; Prugovečki, Biserka; Matković-Čalogović, Dubravka Structural diversity in the coordination compounds of cobalt, nickel and copper with N-alkylglycinates: crystallographic and ESR study in the solid state RSC Advances, 2021, 11, 23779-23790
7243182	CIF	Ce Na0.5 P2 Rb2.5 S8	P 1 21/c 1	9.1218; 17.4862; 9.4704 90; 91.7907; 90	1509.84	Breton, Logan S.; Smith, Mark D.; zur Loye, Hans-Conrad Trends in rare earth thiophosphate syntheses: Rb3Ln(PS4)2 (Ln = La, Ce, Pr), Rb3−xNaxLn(PS4)2 (Ln = Ce, Pr; x = 0.50, 0.55), and RbEuPS4 obtained by molten flux crystal growth CrystEngComm, 2021, 23, 5241-5248
7243183	CIF	Na0.55 P2 Pr Rb2.45 S8	P 1 21/c 1	9.057; 17.3059; 9.4252 90; 91.8396; 90	1476.54	Breton, Logan S.; Smith, Mark D.; zur Loye, Hans-Conrad Trends in rare earth thiophosphate syntheses: Rb3Ln(PS4)2 (Ln = La, Ce, Pr), Rb3−xNaxLn(PS4)2 (Ln = Ce, Pr; x = 0.50, 0.55), and RbEuPS4 obtained by molten flux crystal growth CrystEngComm, 2021, 23, 5241-5248
7243184	CIF	Ce P2 Rb3 S8	P 1 21 1	9.8512; 6.753; 11.4321 90; 90.241; 90	760.52	Breton, Logan S.; Smith, Mark D.; zur Loye, Hans-Conrad Trends in rare earth thiophosphate syntheses: Rb3Ln(PS4)2 (Ln = La, Ce, Pr), Rb3−xNaxLn(PS4)2 (Ln = Ce, Pr; x = 0.50, 0.55), and RbEuPS4 obtained by molten flux crystal growth CrystEngComm, 2021, 23, 5241-5248
7243185	CIF	Eu P Rb S4	P n m a	17.3308; 6.6787; 6.4347 90; 90; 90	744.8	Breton, Logan S.; Smith, Mark D.; zur Loye, Hans-Conrad Trends in rare earth thiophosphate syntheses: Rb3Ln(PS4)2 (Ln = La, Ce, Pr), Rb3−xNaxLn(PS4)2 (Ln = Ce, Pr; x = 0.50, 0.55), and RbEuPS4 obtained by molten flux crystal growth CrystEngComm, 2021, 23, 5241-5248
7243186	CIF	La P2 Rb3 S8	P 1 21 1	9.9053; 6.7376; 11.4553 90; 90.005; 90	764.5	Breton, Logan S.; Smith, Mark D.; zur Loye, Hans-Conrad Trends in rare earth thiophosphate syntheses: Rb3Ln(PS4)2 (Ln = La, Ce, Pr), Rb3−xNaxLn(PS4)2 (Ln = Ce, Pr; x = 0.50, 0.55), and RbEuPS4 obtained by molten flux crystal growth CrystEngComm, 2021, 23, 5241-5248
7243187	CIF	P2 Pr Rb3 S8	P 1 21 1	9.8265; 6.7613; 11.4228 90; 90.2997; 90	758.92	Breton, Logan S.; Smith, Mark D.; zur Loye, Hans-Conrad Trends in rare earth thiophosphate syntheses: Rb3Ln(PS4)2 (Ln = La, Ce, Pr), Rb3−xNaxLn(PS4)2 (Ln = Ce, Pr; x = 0.50, 0.55), and RbEuPS4 obtained by molten flux crystal growth CrystEngComm, 2021, 23, 5241-5248
7243188	CIF	C44 H24 F8 N6	P 1 21/n 1	7.1682; 8.2406; 29.792 90; 92.704; 90	1757.9	Wang, Si-Si; Li, Kechang; Ma, Xiaohui; Xue, Pengchong Acceptor-regulated luminescence in carbazole-based charge transfer complexes CrystEngComm, 2021, 23, 5314-5320
7243189	CIF	C24 H14 N5	P 1 21/c 1	15.694; 7.226; 17.313 90; 95.538; 90	1954.2	Wang, Si-Si; Li, Kechang; Ma, Xiaohui; Xue, Pengchong Acceptor-regulated luminescence in carbazole-based charge transfer complexes CrystEngComm, 2021, 23, 5314-5320
7243190	CIF	C42 H48 N6 O6 S2	P -1	10.2153; 14.5679; 16.0551 107.972; 104.609; 106.675	2019.1	Takeda, Takashi; Kasahara, Yotaro; Akutagawa, Tomoyuki Color-tunable arylaminoanthraquinone dyes through hydrogen-bond-assisted charge transfer interaction RSC Advances, 2021, 11, 24217-24231
7243191	CIF	C19 H22 Cl2 N6 Pd	P 1 c 1	12.883; 8.8827; 9.6095 90; 110.352; 90	1031.02	Kunfi, Attila; Jablonkai, István; Gazdag, Tamás; Mayer, Péter J.; Kalapos, Péter Pál; Németh, Krisztina; Holczbauer, Tamás; London, Gábor A photoresponsive palladium complex of an azopyridyl-triazole ligand: light-controlled solubility drives catalytic activity in the Suzuki coupling reaction RSC Advances, 2021, 11, 23419-23429
7243192	CIF	C20 H16 N6	P -1	5.8998; 9.3629; 15.9508 73.354; 81.87; 81.835	830.9	Kunfi, Attila; Jablonkai, István; Gazdag, Tamás; Mayer, Péter J.; Kalapos, Péter Pál; Németh, Krisztina; Holczbauer, Tamás; London, Gábor A photoresponsive palladium complex of an azopyridyl-triazole ligand: light-controlled solubility drives catalytic activity in the Suzuki coupling reaction RSC Advances, 2021, 11, 23419-23429
7243193	CIF	C30 H32 N4 O5 S	P -1	7.938; 13.3534; 14.1943 112.959; 92.287; 96.766	1369.67	Ren, Bo-Ying; Dai, Xia-Lin; Wang, Jie; Wu, Chao; Lu, Tong-Bu; Chen, Jia-Mei Cocrystallization of axitinib with carboxylic acids: preparation, crystal structures and dissolution behavior CrystEngComm, 2021, 23, 5504-5515
7243194	CIF	C31 H26 N4 O3 S	P -1	7.8512; 13.6163; 14.6035 62.989; 82.242; 79.912	1366.64	Ren, Bo-Ying; Dai, Xia-Lin; Wang, Jie; Wu, Chao; Lu, Tong-Bu; Chen, Jia-Mei Cocrystallization of axitinib with carboxylic acids: preparation, crystal structures and dissolution behavior CrystEngComm, 2021, 23, 5504-5515
7243195	CIF	C28 H24 N4 O7 S	P -1	8.1582; 13.1348; 13.1911 102.579; 105.605; 93.678	1317.35	Ren, Bo-Ying; Dai, Xia-Lin; Wang, Jie; Wu, Chao; Lu, Tong-Bu; Chen, Jia-Mei Cocrystallization of axitinib with carboxylic acids: preparation, crystal structures and dissolution behavior CrystEngComm, 2021, 23, 5504-5515
7243196	CIF	C8 H5 Cl3 O	P 1 c 1	3.6879; 11.923; 9.13 90; 97.392; 90	398.12	Kusumoto, Sotaro; Sugimoto, Akira; Kosumi, Daisuke; Kim, Yang; Sekine, Yoshihiro; Nakamura, Masaaki; Hayami, Shinya A plastically bendable and polar organic crystal CrystEngComm, 2021, 23, 5560-5563
7243197	CIF	C17 H24 Mo N2 O S4	P b c a	12.6981; 15.8799; 21.2754 90; 90; 90	4290.07	Dille, Sara A.; Colston, Kyle J.; Ratvasky, Stephen C.; Pu, Jingzhi; Basu, Partha Interligand communication in a metal mediated LL′CT system ‒ a case study RSC Advances, 2021, 11, 24381-24386
7243198	CIF	C88 H102 Cl6 O4	P 1 21/n 1	15.125; 11.8601; 21.373 90; 100.169; 90	3773.7	Tominaga, Masahide; Fujimaru, Kousuke; Hyodo, Tadashi; Yamaguchi, Kentaro Selective alkane co-inclusion by methylene- and adamantane-bridged macrocycle with biphenyl units CrystEngComm, 2021, 23, 5157-5163
7243199	CIF	C75 H73 Cl3 O4	P 1 21/c 1	14.0848; 13.6156; 15.0281 90; 92.682; 90	2878.8	Tominaga, Masahide; Fujimaru, Kousuke; Hyodo, Tadashi; Yamaguchi, Kentaro Selective alkane co-inclusion by methylene- and adamantane-bridged macrocycle with biphenyl units CrystEngComm, 2021, 23, 5157-5163
7243200	CIF	C74 H72 O4	P 1 21/c 1	12.6452; 29.23; 7.4103 90; 98.251; 90	2710.6	Tominaga, Masahide; Fujimaru, Kousuke; Hyodo, Tadashi; Yamaguchi, Kentaro Selective alkane co-inclusion by methylene- and adamantane-bridged macrocycle with biphenyl units CrystEngComm, 2021, 23, 5157-5163
7243201	CIF	C78 H80 Cl8 O4	P -1	10.238; 11.9538; 14.5269 100.417; 103.463; 93.348	1691.08	Tominaga, Masahide; Fujimaru, Kousuke; Hyodo, Tadashi; Yamaguchi, Kentaro Selective alkane co-inclusion by methylene- and adamantane-bridged macrocycle with biphenyl units CrystEngComm, 2021, 23, 5157-5163
7243202	CIF	C42 H50 N4 S2	P -1	7.7495; 33.5689; 39.6305 68.5122; 88.362; 84.7067	9551.9	Echeverri, Marcelo; Ruiz, Constanza; Gómez-Lor, Berta A high contrast mechanochromic luminescent diacetylene-linked bis-benzothiadiazole derivative CrystEngComm, 2021, 23, 5925-5930
7243203	CIF	C17 H14 O7	P 1 21/c 1	6.2678; 13.2735; 18.564 90; 90.548; 90	1544.4	Bhaskaran, Rasmi P.; Nayak, Kalinga H.; Babu, Beneesh P. Synthesis of functionalized benzo[1,3]dioxin-4-ones from salicylic acid and acetylenic esters and their direct amidation RSC Advances, 2021, 11, 24570-24574
7243204	CIF	C93 H59 Cl15 N8 O3 Ru2	P -1	13.0804; 18.3767; 18.76 78.745; 79.896; 82.809	4334.8	Iwanaga, Osamu; Fukuyama, Kazuki; Mori, Shigeki; Song, Jun Tae; Ishihara, Tatsumi; Miyazaki, Takaaki; Ishida, Masatoshi; Furuta, Hiroyuki Ruthenium(iv) N-confused porphyrin μ-oxo-bridged dimers: acid-responsive molecular rotors RSC Advances, 2021, 11, 24575-24579
7243205	CIF	C93 H58 Cl15 N8 O3 Ru2	P -1	13.0869; 18.3474; 18.8229 78.272; 79.906; 82.497	4335.54	Iwanaga, Osamu; Fukuyama, Kazuki; Mori, Shigeki; Song, Jun Tae; Ishihara, Tatsumi; Miyazaki, Takaaki; Ishida, Masatoshi; Furuta, Hiroyuki Ruthenium(iv) N-confused porphyrin μ-oxo-bridged dimers: acid-responsive molecular rotors RSC Advances, 2021, 11, 24575-24579
7243206	CIF	C28 H32 N12 O16 Sm	C 1 2/c 1	24.726; 15.346; 10.498 90; 99.982; 90	3923	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243207	CIF	C28 H27 N2 O9 Sm	P 1 21/c 1	14.496; 19.771; 9.9597 90; 91.561; 90	2853.4	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243208	CIF	C28 H32 N12 O16 Tb	C 1 2/c 1	24.6726; 15.3731; 10.4434 90; 100.17; 90	3898.9	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243209	CIF	C28 H32 Eu N12 O16	C 1 2/c 1	24.7339; 15.3481; 10.4654 90; 100.157; 90	3910.6	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243210	CIF	C28 H27 N2 O9 Pr	P 1 21/c 1	14.5239; 19.8515; 9.9728 90; 91.725; 90	2874.1	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243211	CIF	C28 H32 Dy N12 O16	C 1 2/c 1	24.6473; 15.3972; 10.429 90; 100.271; 90	3894.4	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243212	CIF	C28 H27 Eu N2 O9	P 1 21/c 1	14.468; 19.7315; 9.9544 90; 91.568; 90	2840.67	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243213	CIF	C28 H32 Gd N12 O16	C 1 2/c 1	24.6998; 15.3676; 10.455 90; 100.153; 90	3906.3	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243214	CIF	C28 H27 Gd N2 O9	P 1 21/c 1	14.447; 19.6992; 9.9464 90; 91.522; 90	2829.69	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243215	CIF	C28 H27 Er N2 O9	P 1 21/c 1	14.3923; 19.6216; 9.8933 90; 91.287; 90	2793.2	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243216	CIF	C28 H27 Dy N2 O9	P 1 21/c 1	14.4572; 19.7227; 9.944 90; 91.468; 90	2834.45	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243217	CIF	C28 H27 N2 Nd O9	P 1 21/c 1	14.5092; 19.8107; 9.9678 90; 91.713; 90	2863.84	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243218	CIF	C28 H27 N2 O9 Tb	P 1 21/c 1	14.434; 19.7062; 9.9308 90; 91.434; 90	2823.83	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243219	CIF	C63 H45 Dy3 O18	P 1 21/n 1	11.4293; 22.5089; 22.7805 90; 95.25; 90	5835.9	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243220	CIF	C21 H15 O6 Yb	P 1 21/n 1	11.2721; 22.5893; 23.0294 90; 96.111; 90	5830.6	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243221	CIF	C63 H45 Er3 O18	P 1 21/n 1	11.3816; 22.4859; 22.8587 90; 95.305; 90	5825.1	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243222	CIF	C63 H45 O18 Tb3	P 1 21/n 1	11.4419; 22.5595; 22.7629 90; 95.338; 90	5850.2	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243223	CIF	C63 H45 O18 Tm3	P 1 21/n 1	11.3218; 22.553; 22.9222 90; 95.884; 90	5822.1	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243224	CIF	C63 H45 Lu3 O18	P 1 21/n 1	11.2439; 22.591; 23.111 90; 96.311; 90	5834.9	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243225	CIF	C63 H45 Eu3 O18	P 1 21/n 1	11.4654; 22.6148; 22.7507 90; 95.35; 90	5873.3	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243226	CIF	C63 H45 Gd3 O18	P 1 21/n 1	11.4601; 22.5734; 22.7365 90; 95.327; 90	5856.4	Theppitak, Chatphorn; Kielar, Filip; Dungkaew, Winya; Sukwattanasinitt, Mongkol; Kangkaew, Laongdao; Sahasithiwat, Somboon; Zenno, Hikaru; Hayami, Shinya; Chainok, Kittipong The coordination chemistry of benzhydrazide with lanthanide(iii) ions: hydrothermal in situ ligand formation, structures, magnetic and photoluminescence sensing properties RSC Advances, 2021, 11, 24709-24721
7243227	CIF	C44 H52 N4 O8 Zn2	P 1 21/n 1	8.4459; 23.8241; 20.1246 90; 91.423; 90	4048.14	Barwiolek, Magdalena; Jankowska, Dominika; Chorobinski, Mateusz; Kaczmarek-Kędziera, Anna; Łakomska, Iwona; Wojtulewski, Slawomir; Muzioł, Tadeusz M. New dinuclear zinc(ii) complexes with Schiff bases obtained from o-phenylenediamine and their application as fluorescent materials in spin coating deposition RSC Advances, 2021, 11, 24515-24525
7243228	CIF	C31.4 H30.8 N4 O6 Zn2	P -1	8.421; 8.749; 10.713 84.53; 88.28; 65.61	715.5	Barwiolek, Magdalena; Jankowska, Dominika; Chorobinski, Mateusz; Kaczmarek-Kędziera, Anna; Łakomska, Iwona; Wojtulewski, Slawomir; Muzioł, Tadeusz M. New dinuclear zinc(ii) complexes with Schiff bases obtained from o-phenylenediamine and their application as fluorescent materials in spin coating deposition RSC Advances, 2021, 11, 24515-24525
7243229	CIF	C17 H25 N3	P 1 21/c 1	9.7065; 18.7394; 8.5024 90; 99.072; 90	1527.2	Mohlala, Reagan L.; Coyanis, E. Mabel; Fernandes, Manuel A.; Bode, Moira L. Catalyst-free synthesis of novel 1,5-benzodiazepines and 3,4-dihydroquinoxalines using isocyanide-based one-pot, three- and four-component reactions RSC Advances, 2021, 11, 24466-24473
7243230	CIF	C19 H29 N3	P 1 21/n 1	12.5443; 10.8032; 13.1304 90; 90.6124; 90	1779.31	Mohlala, Reagan L.; Coyanis, E. Mabel; Fernandes, Manuel A.; Bode, Moira L. Catalyst-free synthesis of novel 1,5-benzodiazepines and 3,4-dihydroquinoxalines using isocyanide-based one-pot, three- and four-component reactions RSC Advances, 2021, 11, 24466-24473
7243231	CIF	C18 H27 Cl2 N3	P 21 21 21	8.1778; 10.86; 21.2146 90; 90; 90	1884.09	Mohlala, Reagan L.; Coyanis, E. Mabel; Fernandes, Manuel A.; Bode, Moira L. Catalyst-free synthesis of novel 1,5-benzodiazepines and 3,4-dihydroquinoxalines using isocyanide-based one-pot, three- and four-component reactions RSC Advances, 2021, 11, 24466-24473
7243232	CIF	C14 H19 Cl2 N3	P 21 21 21	8.4799; 11.2725; 16.0259 90; 90; 90	1531.91	Mohlala, Reagan L.; Coyanis, E. Mabel; Fernandes, Manuel A.; Bode, Moira L. Catalyst-free synthesis of novel 1,5-benzodiazepines and 3,4-dihydroquinoxalines using isocyanide-based one-pot, three- and four-component reactions RSC Advances, 2021, 11, 24466-24473
7243233	CIF	C22 H34 N2 O17 Zn	P -1	7.6374; 14.0781; 14.1339 99.701; 105.305; 99.451	1409.59	Zhao, Guozheng; Liu, Jinjian The modulation effect of pi‒pi interactions on the electronic and photochromic properties of viologen complexes containing N,N′-bis(carboxyethyl)-4,4′-bipyridinium RSC Advances, 2021, 11, 24500-24507
7243234	CIF	C22 H34 Co N2 O17	P -1	7.6409; 14.075; 14.1402 99.692; 105.46; 99.329	1410.07	Zhao, Guozheng; Liu, Jinjian The modulation effect of pi‒pi interactions on the electronic and photochromic properties of viologen complexes containing N,N′-bis(carboxyethyl)-4,4′-bipyridinium RSC Advances, 2021, 11, 24500-24507
7243235	CIF	C18 H24 Cl2 N12 Re6 S8	P 1 21/c 1	11.0944; 16.4078; 20.5808 90; 99.941; 90	3690.2	Ly, Giang Thi; Choi, Jun; Kim, Youngmee; Kim, Yuna; Kim, Sujin; Yang, So-Hyeon; Kim, Sung-Jin One-dimensional lead iodide hybrid stabilized by inorganic hexarhenium cluster cations as a new broad-band emitter RSC Advances, 2021, 11, 24580-24587
7243236	CIF	C42 H80 I8 N20 O8 Pb3 Re6 S8	P -1	10.5488; 11.229; 19.1582 90.416; 93.892; 97.737	2243.18	Ly, Giang Thi; Choi, Jun; Kim, Youngmee; Kim, Yuna; Kim, Sujin; Yang, So-Hyeon; Kim, Sung-Jin One-dimensional lead iodide hybrid stabilized by inorganic hexarhenium cluster cations as a new broad-band emitter RSC Advances, 2021, 11, 24580-24587
7243237	CIF	C17 H20 Cl N3 O3	P 1 21/c 1	15.4376; 5.92226; 19.0732 90; 100.548; 90	1714.31	Zhoujin, Yunping; Zhang, Mingtao; Parkin, Sean; Li, Tonglei; Yu, Faquan; Long, Sihui A new solvate of clonixin and a comparison of the two clonixin solvates RSC Advances, 2021, 11, 24836-24842
7243238	CIF	C48 H46 N4 O10 Re2	P -1	7.9279; 9.0455; 17.152 78.981; 89.505; 75.427	1167.5	Jacobs, Frederick J. F.; Venter, Gertruida J. S.; Fourie, Eleanor; Kroon, Robin E.; Brink, Alice Substitution reactivity and structural variability induced by tryptamine on the biomimetic rhenium tricarbonyl complex RSC Advances, 2021, 11, 24443-24455
7243239	CIF	C39 H32 N2 O4 P Re	P 1 21/n 1	10.506; 26.642; 12.3068 90; 106.455; 90	3303.6	Jacobs, Frederick J. F.; Venter, Gertruida J. S.; Fourie, Eleanor; Kroon, Robin E.; Brink, Alice Substitution reactivity and structural variability induced by tryptamine on the biomimetic rhenium tricarbonyl complex RSC Advances, 2021, 11, 24443-24455
7243240	CIF	C20 H16 N4	P 1 21/m 1	7.2371; 6.8632; 16.2164 90; 101.478; 90	789.35	Ramle, Abdul Qaiyum; Fei, Chee Chin; Tiekink, Edward R. T.; Basirun, Wan Jefrey Indoleninyl-substituted pyrimido[1,2-b]indazoles via a facile condensation reaction RSC Advances, 2021, 11, 24647-24651
7243241	CIF	C40 H29 N3 O9 Zn2	C 1 2/c 1	25.237; 19.307; 15.041 90; 107.575; 90	6987	Chuang, Po-Min; Wu, Jing-Yun A highly stable Zn coordination polymer exhibiting pH-dependent fluorescence and as a visually ratiometric and on‒off fluorescent sensor CrystEngComm, 2021, 23, 5226-5240
7243242	CIF	C16 H24 Cl N O3	P 21 21 21	6.82; 8.8363; 26.14 90; 90; 90	1575.29	Bereczki, Laura; Zodge, Amit; Kőrösi, Márton; Holczbauer, Tamás; De, Sourav; Székely, Edit; Bombicz, Petra A bug in enantiomer separation: double salt formation ‒ diastereomeric and double salt structures of 1-cyclohexylethylammonium 2- and 4-chloromandelate CrystEngComm, 2021, 23, 5367-5376
7243243	CIF	C16 H24 Cl N O3	P 1 21 1	9.637; 25.3851; 13.5859 90; 90.277; 90	3323.56	Bereczki, Laura; Zodge, Amit; Kőrösi, Márton; Holczbauer, Tamás; De, Sourav; Székely, Edit; Bombicz, Petra A bug in enantiomer separation: double salt formation ‒ diastereomeric and double salt structures of 1-cyclohexylethylammonium 2- and 4-chloromandelate CrystEngComm, 2021, 23, 5367-5376
7243244	CIF	C16 H24 Cl N O3	P 1 21 1	10.464; 10.4673; 29.8915 90; 96.843; 90	3250.7	Bereczki, Laura; Zodge, Amit; Kőrösi, Márton; Holczbauer, Tamás; De, Sourav; Székely, Edit; Bombicz, Petra A bug in enantiomer separation: double salt formation ‒ diastereomeric and double salt structures of 1-cyclohexylethylammonium 2- and 4-chloromandelate CrystEngComm, 2021, 23, 5367-5376
7243245	CIF	C16 H24 Cl N O3	P 21 21 21	6.7938; 8.6704; 27.7144 90; 90; 90	1632.52	Bereczki, Laura; Zodge, Amit; Kőrösi, Márton; Holczbauer, Tamás; De, Sourav; Székely, Edit; Bombicz, Petra A bug in enantiomer separation: double salt formation ‒ diastereomeric and double salt structures of 1-cyclohexylethylammonium 2- and 4-chloromandelate CrystEngComm, 2021, 23, 5367-5376
7243246	CIF	C16 H24 Cl N O3	C 1 2 1	24.2266; 10.0661; 13.3665 90; 92.533; 90	3256.5	Bereczki, Laura; Zodge, Amit; Kőrösi, Márton; Holczbauer, Tamás; De, Sourav; Székely, Edit; Bombicz, Petra A bug in enantiomer separation: double salt formation ‒ diastereomeric and double salt structures of 1-cyclohexylethylammonium 2- and 4-chloromandelate CrystEngComm, 2021, 23, 5367-5376
7243247	CIF	C16 H24 Cl N O3	P 1 21 1	9.0572; 29.711; 12.6381 90; 93.337; 90	3395.1	Bereczki, Laura; Zodge, Amit; Kőrösi, Márton; Holczbauer, Tamás; De, Sourav; Székely, Edit; Bombicz, Petra A bug in enantiomer separation: double salt formation ‒ diastereomeric and double salt structures of 1-cyclohexylethylammonium 2- and 4-chloromandelate CrystEngComm, 2021, 23, 5367-5376
7243248	CIF	C73 H126 Fe10 N4 Na2 O41	C 1 2/c 1	25.2017; 18.1205; 24.0709 90; 105.576; 90	10588.7	Podgornii, Daniel; van Leusen, Jan; Kravtsov, Victor Ch.; Kögerler, Paul; Baca, Svetlana G. A {Na2Fe10} isobutyrate cluster, interlinked into 1D chains CrystEngComm, 2021, 23, 5153-5156
7243249	CIF	C14 H24 B Cl O3 Si2	P 1 21/n 1	7.7496; 21.2931; 11.3262 90; 96.315; 90	1857.63	Pacholak, P.; Krajewska, J.; Wińska, P.; Dunikowska, J.; Gogowska, U.; Mierzejewska, J.; Durka, K.; Woźniak, K.; Laudy, A. E.; Luliński, S. Development of structurally extended benzosiloxaboroles ‒ synthesis and in vitro biological evaluation RSC Advances, 2021, 11, 25104-25121
7243250	CIF	C9 H12 B Cl O3 Si	P -1	8.8909; 13.0768; 21.5996 105.046; 100.815; 90.79	2376.92	Pacholak, P.; Krajewska, J.; Wińska, P.; Dunikowska, J.; Gogowska, U.; Mierzejewska, J.; Durka, K.; Woźniak, K.; Laudy, A. E.; Luliński, S. Development of structurally extended benzosiloxaboroles ‒ synthesis and in vitro biological evaluation RSC Advances, 2021, 11, 25104-25121
7243251	CIF	C13 H12 B Cl F N O3 Si	P 1 21/n 1	8.456; 18.7604; 9.4974 90; 93.128; 90	1504.4	Pacholak, P.; Krajewska, J.; Wińska, P.; Dunikowska, J.; Gogowska, U.; Mierzejewska, J.; Durka, K.; Woźniak, K.; Laudy, A. E.; Luliński, S. Development of structurally extended benzosiloxaboroles ‒ synthesis and in vitro biological evaluation RSC Advances, 2021, 11, 25104-25121
7243252	CIF	C14 H14 B Cl O5 S Si	P 1 21/c 1	11.1357; 7.9341; 18.6956 90; 93.418; 90	1648.85	Pacholak, P.; Krajewska, J.; Wińska, P.; Dunikowska, J.; Gogowska, U.; Mierzejewska, J.; Durka, K.; Woźniak, K.; Laudy, A. E.; Luliński, S. Development of structurally extended benzosiloxaboroles ‒ synthesis and in vitro biological evaluation RSC Advances, 2021, 11, 25104-25121
7243253	CIF	C60 H52 B4 Cl4 F12 O20 S4 Si4	P 1 21/n 1	15.639; 7.9654; 16.704 90; 116.4; 90	1863.8	Pacholak, P.; Krajewska, J.; Wińska, P.; Dunikowska, J.; Gogowska, U.; Mierzejewska, J.; Durka, K.; Woźniak, K.; Laudy, A. E.; Luliński, S. Development of structurally extended benzosiloxaboroles ‒ synthesis and in vitro biological evaluation RSC Advances, 2021, 11, 25104-25121
7243254	CIF	C15 H14 B Cl O4 Si	P 1 21/c 1	10.1341; 12.5199; 12.6193 90; 91.705; 90	1600.4	Pacholak, P.; Krajewska, J.; Wińska, P.; Dunikowska, J.; Gogowska, U.; Mierzejewska, J.; Durka, K.; Woźniak, K.; Laudy, A. E.; Luliński, S. Development of structurally extended benzosiloxaboroles ‒ synthesis and in vitro biological evaluation RSC Advances, 2021, 11, 25104-25121
7243255	CIF	C64 H72 B8 Cl8 F16 K10 O29 Si8	P 42/m	16.7599; 16.7599; 19.4746 90; 90; 90	5470.3	Pacholak, P.; Krajewska, J.; Wińska, P.; Dunikowska, J.; Gogowska, U.; Mierzejewska, J.; Durka, K.; Woźniak, K.; Laudy, A. E.; Luliński, S. Development of structurally extended benzosiloxaboroles ‒ synthesis and in vitro biological evaluation RSC Advances, 2021, 11, 25104-25121
7243256	CIF	Ge1.35 Ho Pd0.65	P 6/m m m	6.19278; 6.19278; 8.24802 90; 90; 120	273.938	Litzbarski, Leszek S.; Klimczuk, Tomasz; Winiarski, Michał J. Ho2Pd1.3Ge2.7 ‒ a ternary AlB2-type cluster glass system RSC Advances, 2021, 11, 25187-25193
7243257	CIF	C9 H14 N O4.5	C 1 2 1	9.9671; 7.2; 14.1385 90; 92.803; 90	1013.41	Yamaguchi, Ryota; Tanaka, Rika; Maetani, Mayu; Tabe, Hiroyasu; Yamada, Yusuke Efficient capturing of hydrogen peroxide in dilute aqueous solution by co-crystallization with amino acids CrystEngComm, 2021, 23, 5456-5462
7243258	CIF	C9 H13 N O3.9675	P c a 21	11.6333; 5.9869; 28.5029 90; 90; 90	1985.15	Yamaguchi, Ryota; Tanaka, Rika; Maetani, Mayu; Tabe, Hiroyasu; Yamada, Yusuke Efficient capturing of hydrogen peroxide in dilute aqueous solution by co-crystallization with amino acids CrystEngComm, 2021, 23, 5456-5462
7243259	CIF	C4 H10 N2 O5	P -1	4.7744; 7.3961; 9.8715 90.222; 90.124; 101.127	342.03	Yamaguchi, Ryota; Tanaka, Rika; Maetani, Mayu; Tabe, Hiroyasu; Yamada, Yusuke Efficient capturing of hydrogen peroxide in dilute aqueous solution by co-crystallization with amino acids CrystEngComm, 2021, 23, 5456-5462
7243260	CIF	C4 H10 N2 O4	P 21 21 21	5.571; 9.766; 11.738 90; 90; 90	638.6	Yamaguchi, Ryota; Tanaka, Rika; Maetani, Mayu; Tabe, Hiroyasu; Yamada, Yusuke Efficient capturing of hydrogen peroxide in dilute aqueous solution by co-crystallization with amino acids CrystEngComm, 2021, 23, 5456-5462
7243261	CIF	F12 H48 N10 O30 P6 Zr6	P 1 21/n 1	15.502; 7.5316; 19.141 90; 102.593; 90	2181	Yu, Jing-Wei; Yu, Hai-Jiao; Yao, Zhi-Yuan; Li, Zi-Han; Ren, Qiu; Luo, Hong-Bin; Zou, Yang; Wang, Lifeng; Ren, Xiao-Ming A water-stable open-framework zirconium(iv) phosphate and its water-assisted high proton conductivity CrystEngComm, 2021, 23, 6093-6097
7243262	CIF	C30 H30 Cu N4 O8	P 1 21/c 1	6.7098; 21.4689; 9.428 90; 91.889; 90	1357.38	Fugu, Mohammed B.; Coley, Joe; Dickinson, Isabella F.; Orton, James B.; Klooster, Wim; Gleeson, M. Paul; Jones, Leigh F. Slight ligand modifications within multitopic linear hydroxamates promotes connectivity differences in Cu(ii) 1-D coordination polymers CrystEngComm, 2021, 23, 5531-5539
7243263	CIF	C30 H34 Cu N4 O8	P 1 21/c 1	8.6156; 11.3142; 14.8436 90; 100.887; 90	1420.89	Fugu, Mohammed B.; Coley, Joe; Dickinson, Isabella F.; Orton, James B.; Klooster, Wim; Gleeson, M. Paul; Jones, Leigh F. Slight ligand modifications within multitopic linear hydroxamates promotes connectivity differences in Cu(ii) 1-D coordination polymers CrystEngComm, 2021, 23, 5531-5539
7243264	CIF	C30 H26 N4 O4	P -1	9.4525; 11.1197; 14.5433 97.639; 108.409; 106.008	1352.99	Witte, Felix; Rietsch, Philipp; Nirmalananthan-Budau, Nithiya; Weigert, Florian; Götze, Jan Phillip; Resch-Genger, Ute; Eigler, Siegfried; Paulus, Beate Aggregation-induced emission leading to two distinct emissive species in the solid-state structure of high-dipole organic chromophores Physical Chemistry Chemical Physics, 2021
7243265	CIF	C46 H84 O16 Ti4	P 1 21/n 1	12.216; 19.637; 23.021 90; 99.56; 90	5446	Kazimierczuk, Katarzyna; Milanesio, Marco; Dołęga, Anna; Palin, Luca; Walencik, Maja; Jurkowski, Michał; Conterosito, Eleonora Solvothermal synthesis and structural characterization of three polyoxotitanium-organic acid clusters RSC Advances, 2021, 11, 25068-25078
7243266	CIF	C96 H96 O24 Ti6	P -1	12.19; 13.515; 15.26 107.574; 92.097; 105.434	2291.5	Kazimierczuk, Katarzyna; Milanesio, Marco; Dołęga, Anna; Palin, Luca; Walencik, Maja; Jurkowski, Michał; Conterosito, Eleonora Solvothermal synthesis and structural characterization of three polyoxotitanium-organic acid clusters RSC Advances, 2021, 11, 25068-25078
7243267	CIF	C80 H96 O28 Ti6	P -1	14.9415; 15.493; 20.12 72.82; 83.873; 78.346	4352.5	Kazimierczuk, Katarzyna; Milanesio, Marco; Dołęga, Anna; Palin, Luca; Walencik, Maja; Jurkowski, Michał; Conterosito, Eleonora Solvothermal synthesis and structural characterization of three polyoxotitanium-organic acid clusters RSC Advances, 2021, 11, 25068-25078
7243268	CIF	C13 H13 N O5	P n m a	10.1584; 6.6612; 18.5993 90; 90; 90	1258.56	Duan, Guiyun; Liu, Hao; Zhang, Liqing; Yuan, Chunhao; Li, Yongchao; Ge, Yanqing Access to 6-hydroxy indolizines and related imidazo[1,5-a]pyridines through the SN2 substitution/condensation/tautomerization cascade process RSC Advances, 2021, 11, 25624-25627
7243269	CIF	C69 H65 N27 O23 Zn4	P 1 21/c 1	13.506; 17.59; 18.041 90; 97.01; 90	4254	Zhou, Yan; Han, Lei; Chen, Wen-Jie Inter-ligand charge-transfer interactions in a photochromic and redox active zinc–organic framework CrystEngComm, 2021, 23, 5982-5988
7243270	CIF	C20 H17 Br2 N3	P 1 21/n 1	14.62006; 5.80584; 22.6165 90; 104.199; 90	1861.08	Yang, Jingya; Song, Menghui; Zhou, Hongyan; Qi, Yanfang; Ma, Ben; Wang, Xi-Cun Visible-light-promoted decarboxylative addition cyclization of N-aryl glycines and azobenzenes to access 1,2,4-triazolidines Green Chemistry, 2021, 23, 5806-5811
7243271	CIF	C20 H17 Br2 N3	P 1 21/n 1	14.62006; 5.80584; 22.6165 90; 104.199; 90	1861.08	Yang, Jingya; Song, Menghui; Zhou, Hongyan; Qi, Yanfang; Ma, Ben; Wang, Xi-Cun Visible-light-promoted decarboxylative addition cyclization of N-aryl glycines and azobenzenes to access 1,2,4-triazolidines Green Chemistry, 2021, 23, 5806-5811
7243272	CIF	C29 H21 Co N4 O5	P 1 21/c 1	10.3161; 14.7176; 16.3208 90; 98.968; 90	2447.67	Zhao, Dongsheng; Song, Junqi; Zhang, Xiutang; Wang, Feng; Li, Bei; Yang, Lulu; Deng, Yuxin; Li, Qingbo; Fan, Liming A pillar-layered binuclear 3D cobalt(ii) coordination polymer as an electrocatalyst for overall water splitting and as a chemosensor for Cr(vi) anion detection CrystEngComm, 2021, 23, 6245-6252
7243273	CIF	C10 H8 Hg I2 N4 O	P 1 21/c 1	4.928; 17.0736; 16.567 90; 91.691; 90	1393.32	Nezhadali Baghan, Zahra; Salimi, Alireza; Eshtiagh-Hosseini, Hossein; Oliver, Allen G. Hydrogen bond synthons affect the coordination geometry of d10-metal halide complexes: synthetic methods, theoretical studies, and supramolecular architectures CrystEngComm, 2021, 23, 6276-6290
7243274	CIF	C20 H16 Cd I2 N8 O2	F d d 2	19.052; 59.023; 4.0392 90; 90; 90	4542.1	Nezhadali Baghan, Zahra; Salimi, Alireza; Eshtiagh-Hosseini, Hossein; Oliver, Allen G. Hydrogen bond synthons affect the coordination geometry of d10-metal halide complexes: synthetic methods, theoretical studies, and supramolecular architectures CrystEngComm, 2021, 23, 6276-6290
7243275	CIF	C10 H8 Br2 Hg N4 O	P 1 21/n 1	3.9055; 34.576; 9.6848 90; 101.416; 90	1281.9	Nezhadali Baghan, Zahra; Salimi, Alireza; Eshtiagh-Hosseini, Hossein; Oliver, Allen G. Hydrogen bond synthons affect the coordination geometry of d10-metal halide complexes: synthetic methods, theoretical studies, and supramolecular architectures CrystEngComm, 2021, 23, 6276-6290
7243276	CIF	C10 H8 Cl2 Hg N4 O	P 1 21/c 1	3.8092; 33.691; 9.6053 90; 100.534; 90	1211.9	Nezhadali Baghan, Zahra; Salimi, Alireza; Eshtiagh-Hosseini, Hossein; Oliver, Allen G. Hydrogen bond synthons affect the coordination geometry of d10-metal halide complexes: synthetic methods, theoretical studies, and supramolecular architectures CrystEngComm, 2021, 23, 6276-6290
7243277	CIF	C20 H16 Cl2 N8 O2 Zn	P -1	7.5409; 11.8032; 13.1436 79.856; 89.98; 74.499	1108.35	Nezhadali Baghan, Zahra; Salimi, Alireza; Eshtiagh-Hosseini, Hossein; Oliver, Allen G. Hydrogen bond synthons affect the coordination geometry of d10-metal halide complexes: synthetic methods, theoretical studies, and supramolecular architectures CrystEngComm, 2021, 23, 6276-6290
7243278	CIF	C22 H17 F3 O3 S2	P -1	8.0894; 8.6805; 16.3072 80.083; 79.077; 79.493	1094.2	Qin, Long-Zhou; Yuan, Xin; Liu, Jie; Wu, Meng-Yu; Sun, Qi; Duan, Xiu; Zhang, Xin-Peng; Qiu, Jiang-Kai; Guo, Kai Continuous-flow processes for the S-alkynylation of cysteine-containing peptides and thioglycosides under catalyst-free, oxidant-free and mild conditions Green Chemistry, 2021, 23, 6598-6603
7243279	CIF	C24 H29 N3 O5	P 1 21/c 1	11.298; 13.398; 15.678 90; 107.247; 90	2266.5	Tantawy, Ahmed H.; Meng, Xiang-Gao; Marzouk, Adel A.; Fouad, Ali; Abdelazeem, Ahmed H.; Youssif, Bahaa G. M.; Jiang, Hong; Wang, Man-Qun Structure-based design, synthesis, and biological evaluation of novel piperine‒resveratrol hybrids as antiproliferative agents targeting SIRT-2 RSC Advances, 2021, 11, 25738-25751
7243280	CIF	C25 H18 F2 N2 O3	P -1	5.329; 10.708; 15.496 83.878; 87.608; 82.24	870.8	Tantawy, Ahmed H.; Meng, Xiang-Gao; Marzouk, Adel A.; Fouad, Ali; Abdelazeem, Ahmed H.; Youssif, Bahaa G. M.; Jiang, Hong; Wang, Man-Qun Structure-based design, synthesis, and biological evaluation of novel piperine‒resveratrol hybrids as antiproliferative agents targeting SIRT-2 RSC Advances, 2021, 11, 25738-25751
7243281	CIF	C21 H24.75 N3 O4.42	P 1 21/n 1	13.6957; 6.3687; 24.058 90; 104.09; 90	2035.3	Tantawy, Ahmed H.; Meng, Xiang-Gao; Marzouk, Adel A.; Fouad, Ali; Abdelazeem, Ahmed H.; Youssif, Bahaa G. M.; Jiang, Hong; Wang, Man-Qun Structure-based design, synthesis, and biological evaluation of novel piperine‒resveratrol hybrids as antiproliferative agents targeting SIRT-2 RSC Advances, 2021, 11, 25738-25751
7243282	CIF	C20 H20 N2 O5	P 1 21/n 1	10.9249; 6.574; 25.7341 90; 94.79; 90	1841.78	Tantawy, Ahmed H.; Meng, Xiang-Gao; Marzouk, Adel A.; Fouad, Ali; Abdelazeem, Ahmed H.; Youssif, Bahaa G. M.; Jiang, Hong; Wang, Man-Qun Structure-based design, synthesis, and biological evaluation of novel piperine‒resveratrol hybrids as antiproliferative agents targeting SIRT-2 RSC Advances, 2021, 11, 25738-25751
7243283	CIF	C20 H20 N2 O6	P 1 21/c 1	6.6192; 19.7039; 14.2723 90; 99.079; 90	1838.1	Tantawy, Ahmed H.; Meng, Xiang-Gao; Marzouk, Adel A.; Fouad, Ali; Abdelazeem, Ahmed H.; Youssif, Bahaa G. M.; Jiang, Hong; Wang, Man-Qun Structure-based design, synthesis, and biological evaluation of novel piperine‒resveratrol hybrids as antiproliferative agents targeting SIRT-2 RSC Advances, 2021, 11, 25738-25751
7243284	CIF	C20 H18 N2 O5	P 1 21/c 1	18.1988; 4.8105; 22.1672 90; 112.874; 90	1788.03	Tantawy, Ahmed H.; Meng, Xiang-Gao; Marzouk, Adel A.; Fouad, Ali; Abdelazeem, Ahmed H.; Youssif, Bahaa G. M.; Jiang, Hong; Wang, Man-Qun Structure-based design, synthesis, and biological evaluation of novel piperine‒resveratrol hybrids as antiproliferative agents targeting SIRT-2 RSC Advances, 2021, 11, 25738-25751
7243285	CIF	C56 H62 Mo12 N14 O54	P 1 21/c 1	11.0881; 33.6789; 12.0491 90; 108.137; 90	4275.99	Bebić, Nikol; Topić, Edi; Mandarić, Mirna; Hrenar, Tomica; Vrdoljak, Višnja Extending the structural landscape of Mo(vi) hydrazonato inorganic–organic POM-hybrids: an experimental and computational study CrystEngComm, 2021, 23, 6349-6358
7243286	CIF	C34 H42 Mo10 N10 O40	P -1	7.9678; 10.7556; 18.9607 83.396; 83.567; 73.581	1542.89	Bebić, Nikol; Topić, Edi; Mandarić, Mirna; Hrenar, Tomica; Vrdoljak, Višnja Extending the structural landscape of Mo(vi) hydrazonato inorganic–organic POM-hybrids: an experimental and computational study CrystEngComm, 2021, 23, 6349-6358
7243287	CIF	C56 H74 Mo12 N14 O60	P -1	9.4085; 16.2433; 17.3878 116.276; 95.232; 93.035	2359.8	Bebić, Nikol; Topić, Edi; Mandarić, Mirna; Hrenar, Tomica; Vrdoljak, Višnja Extending the structural landscape of Mo(vi) hydrazonato inorganic–organic POM-hybrids: an experimental and computational study CrystEngComm, 2021, 23, 6349-6358
7243288	CIF	C38 H38 Mo8 N12 O29	P -1	9.3622; 10.7026; 15.853 106.074; 92.475; 107.934	1437.8	Bebić, Nikol; Topić, Edi; Mandarić, Mirna; Hrenar, Tomica; Vrdoljak, Višnja Extending the structural landscape of Mo(vi) hydrazonato inorganic–organic POM-hybrids: an experimental and computational study CrystEngComm, 2021, 23, 6349-6358
7243289	CIF	C36 H40 Mo8 N10 O31	P -1	10.8617; 10.9074; 13.8765 97.652; 107.915; 114.577	1356.26	Bebić, Nikol; Topić, Edi; Mandarić, Mirna; Hrenar, Tomica; Vrdoljak, Višnja Extending the structural landscape of Mo(vi) hydrazonato inorganic–organic POM-hybrids: an experimental and computational study CrystEngComm, 2021, 23, 6349-6358
7243290	CIF	C28 H24 Mo8 N6 O29	P -1	7.5406; 8.665; 17.325 103.429; 90.359; 89.999	1101	Bebić, Nikol; Topić, Edi; Mandarić, Mirna; Hrenar, Tomica; Vrdoljak, Višnja Extending the structural landscape of Mo(vi) hydrazonato inorganic–organic POM-hybrids: an experimental and computational study CrystEngComm, 2021, 23, 6349-6358
7243291	CIF	C34 H47 Mo10 N9 O42	P -1	10.2611; 10.5249; 15.9967 100.373; 104.041; 106.41	1549.28	Bebić, Nikol; Topić, Edi; Mandarić, Mirna; Hrenar, Tomica; Vrdoljak, Višnja Extending the structural landscape of Mo(vi) hydrazonato inorganic–organic POM-hybrids: an experimental and computational study CrystEngComm, 2021, 23, 6349-6358
7243292	CIF	C26 H24 Mo8 N6 O31	P 1 21/c 1	7.6794; 9.3605; 29.2326 90; 89.706; 90	2101.3	Bebić, Nikol; Topić, Edi; Mandarić, Mirna; Hrenar, Tomica; Vrdoljak, Višnja Extending the structural landscape of Mo(vi) hydrazonato inorganic–organic POM-hybrids: an experimental and computational study CrystEngComm, 2021, 23, 6349-6358
7243293	CIF	C32 H42 Mo10 N8 O41	P -1	10.5703; 11.3121; 14.2003 107.159; 102.412; 105.877	1477.54	Bebić, Nikol; Topić, Edi; Mandarić, Mirna; Hrenar, Tomica; Vrdoljak, Višnja Extending the structural landscape of Mo(vi) hydrazonato inorganic–organic POM-hybrids: an experimental and computational study CrystEngComm, 2021, 23, 6349-6358
7243294	CIF	C34 H32 Mo8 N10 O29	C 1 2/c 1	21.0479; 8.6686; 29.2039 90; 95.92; 90	5300	Bebić, Nikol; Topić, Edi; Mandarić, Mirna; Hrenar, Tomica; Vrdoljak, Višnja Extending the structural landscape of Mo(vi) hydrazonato inorganic–organic POM-hybrids: an experimental and computational study CrystEngComm, 2021, 23, 6349-6358
7243295	CIF	C34 H36 Eu N7 O19	P -1	10.6395; 13.2614; 14.0523 94.619; 90.613; 93.445	1972.45	Rai, Sunil K.; Baidya, Debjani; Nangia, Ashwini K. Salts, solvates and hydrates of the multi-kinase inhibitor drug pazopanib with hydroxybenzoic acids CrystEngComm, 2021, 23, 5994-6011
7243296	CIF	C40 H41 Co N10 O11	P -1	10.5802; 14.8763; 15.6669 64.083; 86.853; 72.573	2107.8	Rai, Sunil K.; Baidya, Debjani; Nangia, Ashwini K. Salts, solvates and hydrates of the multi-kinase inhibitor drug pazopanib with hydroxybenzoic acids CrystEngComm, 2021, 23, 5994-6011
7243297	CIF	C75 H80 Co Eu2 N17 O32	P 1 21/c 1	10.2652; 20.5445; 39.9674 90; 96.8; 90	8369.6	Rai, Sunil K.; Baidya, Debjani; Nangia, Ashwini K. Salts, solvates and hydrates of the multi-kinase inhibitor drug pazopanib with hydroxybenzoic acids CrystEngComm, 2021, 23, 5994-6011
7243298	CIF	C34 H36 Eu N7 O19	P -1	10.6395; 13.2614; 14.0523 94.619; 90.613; 93.445	1972.45	Wang, Yi-Wen; Li, Meng-Hua; Zhang, Shu-Quan; Fang, Xin; Lin, Mei-Jin Photochromic and photocontrolled luminescent rare-earth D–A hybrid crystals based on rigid viologen acceptors CrystEngComm, 2021, 23, 6267-6275
7243299	CIF	C40 H41 Co N10 O11	P -1	10.5802; 14.8763; 15.6669 64.083; 86.853; 72.573	2107.8	Wang, Yi-Wen; Li, Meng-Hua; Zhang, Shu-Quan; Fang, Xin; Lin, Mei-Jin Photochromic and photocontrolled luminescent rare-earth D–A hybrid crystals based on rigid viologen acceptors CrystEngComm, 2021, 23, 6267-6275
7243300	CIF	C75 H80 Co Eu2 N17 O32	P 1 21/c 1	10.2652; 20.5445; 39.9674 90; 96.8; 90	8369.6	Wang, Yi-Wen; Li, Meng-Hua; Zhang, Shu-Quan; Fang, Xin; Lin, Mei-Jin Photochromic and photocontrolled luminescent rare-earth D–A hybrid crystals based on rigid viologen acceptors CrystEngComm, 2021, 23, 6267-6275
7243301	CIF	C22 H28 N2 O6 S2	P 1 21/c 1	6.3273; 12.3383; 29.2787 90; 95.255; 90	2276.1	Wu, Yanhui; Hao, Xiujia; Li, Jianting; Guan, Aiying; Zhou, Zhengzheng; Guo, Fang New insight into improving the solubility of poorly soluble drugs by preventing the formation of their hydrogen-bonds: a case of dapsone salts with camphorsulfonic and 5-sulfosalicylic acid CrystEngComm, 2021, 23, 6191-6198
7243302	CIF	C26 H24 N2 O14 S3	C 1 2/c 1	39.252; 13.2429; 11.3983 90; 103.326; 90	5765.4	Wu, Yanhui; Hao, Xiujia; Li, Jianting; Guan, Aiying; Zhou, Zhengzheng; Guo, Fang New insight into improving the solubility of poorly soluble drugs by preventing the formation of their hydrogen-bonds: a case of dapsone salts with camphorsulfonic and 5-sulfosalicylic acid CrystEngComm, 2021, 23, 6191-6198
7243303	CIF	C18 H18 N2 O3	P -1	8.4879; 9.8238; 10.6092 110.924; 95.681; 108.558	760.4	Han, Zhi-Peng; Xu, Meng-Meng; Zhang, Rui-Ying; Xu, Xiao-Ping; Ji, Shun-Jun Rh(iii)-Catalyzed C(sp2)‒H functionalization/cyclization cascade of N-carboxamide indole and iodonium reagents for access to indoloquinazolinone derivatives Green Chemistry, 2021, 23, 6337-6340
7243304	CIF	C18 H16 B F2 I2 N3	C m c m	16.724; 15.302; 7.6345 90; 90; 90	1953.7	Özcan, Emrah; Dedeoglu, Burcu; Chumakov, Yurii; Zorlu, Yunus; Çoşut, Bünyemin; Ayhan, Mehmet Menaf Modulation of supramolecular self-assembly of BODIPY tectons via halogen bonding CrystEngComm, 2021, 23, 6365-6375
7243305	CIF	C24 H21 B F2 I N3	P -1	10.8154; 15.2133; 16.0136 64.677; 83.593; 75.477	2305.5	Özcan, Emrah; Dedeoglu, Burcu; Chumakov, Yurii; Zorlu, Yunus; Çoşut, Bünyemin; Ayhan, Mehmet Menaf Modulation of supramolecular self-assembly of BODIPY tectons via halogen bonding CrystEngComm, 2021, 23, 6365-6375
7243306	CIF	C24 H21 B F2 I N3	P c a 21	16.712; 7.8829; 34.6268 90; 90; 90	4561.7	Özcan, Emrah; Dedeoglu, Burcu; Chumakov, Yurii; Zorlu, Yunus; Çoşut, Bünyemin; Ayhan, Mehmet Menaf Modulation of supramolecular self-assembly of BODIPY tectons via halogen bonding CrystEngComm, 2021, 23, 6365-6375
7243307	CIF	C12 Br2 F8	P 1 21/n 1	13.2078; 7.3883; 13.6241 90; 110.544; 90	1244.93	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243308	CIF	C20 H12 F8 I2 N2	C 1 2/c 1	13.857; 13.7638; 11.5041 90; 104.737; 90	2121.94	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243309	CIF	C18 H12 Br2 F4 N2	P -1	6.8796; 7.4209; 9.2086 82.848; 82.965; 75.554	449.67	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243310	CIF	C12 H8 F4 I2 N2	P -1	5.7357; 6.2412; 10.6257 86.11; 74.656; 77.418	357.986	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243311	CIF	C20 H6 Br2 F8 N2	P 1 21/c 1	8.0424; 7.0976; 33.8513 90; 94.497; 90	1926.34	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243312	CIF	C24 H10 Br2 F8 N2	P -1	7.3598; 11.2484; 13.8819 88.308; 78.403; 76.782	1095.78	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243313	CIF	C22 H8 F8 I2 N2	P -1	7.9217; 11.1526; 12.8382 105.19; 107.58; 90.334	1039.01	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243314	CIF	C12 H8 Br2 F4 N2	P -1	4.8003; 6.6036; 10.9521 83.796; 84.121; 79.072	337.69	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243315	CIF	C18 H8 Br2 F8 N2	P n a 21	12.9213; 12.3927; 11.7294 90; 90; 90	1878.23	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243316	CIF	C22 H8 F8 I2 N2	P 1 21/c 1	7.7281; 7.6981; 36.2272 90; 91.551; 90	2154.43	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243317	CIF	C20 H12 Br2 F8 N2	C 1 2/c 1	13.3837; 13.8699; 11.1754 90; 102.784; 90	2023.1	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243318	CIF	C24 H12 Br2 F8 N2	P -1	7.776; 10.0737; 14.895 81.781; 78.26; 83.082	1125.59	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243319	CIF	C22 H24 Br2 F4 N4	P 1 21/n 1	7.0459; 14.8959; 11.1802 90; 102.71; 90	1144.66	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243320	CIF	C36 H10 Br4 F16 N2	P -1	7.4148; 11.4097; 21.198 90.035; 90.01; 107.163	1713.5	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243321	CIF	C22 H8 Br2 F8 N2	P -1	7.7409; 11.2944; 12.7419 73.313; 72.443; 89.944	1012.9	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243322	CIF	C14 H6 Br2 F4 N2	P 1 21/n 1	11.499; 6.267; 19.965 90; 98.291; 90	1423.7	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243323	CIF	C18 H12 F8 I2 N2	P 1 21/n 1	13.5292; 10.9229; 14.122 90; 108.47; 90	1979.4	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243324	CIF	C24 H10 F8 I2 N2	P -1	7.9651; 10.8942; 14.4024 108.756; 105.483; 90.273	1134.8	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243325	CIF	C18 H12 Br2 F8 N2	P 1 21/n 1	13.1047; 10.8097; 14.146 90; 107.369; 90	1912.5	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243326	CIF	C18 H12 F4 I2 N2	A e a 2	13.1529; 18.502; 15.239 90; 90; 90	3708.5	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243327	CIF	C45 H18 Br6 F24 N3	P -1	7.938; 10.577; 29.826 91.873; 94.086; 105.304	2405.8	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243328	CIF	C24 H8 F8 I2 N2	P -1	7.7139; 12.2385; 13.5005 113.307; 99.272; 94.932	1139.37	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243329	CIF	C24 H8 Br2 F8 N2	P -1	7.6092; 12.2473; 12.89 111.115; 100.664; 95.114	1085.22	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243330	CIF	C20 H6 F8 I2 N2	P 1 21/c 1	8.2738; 6.9896; 34.5606 90; 93.006; 90	1995.9	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243331	CIF	C16 H8 Br2 F4 N2	P -1	6.8925; 7.6625; 8.623 108.019; 97.023; 109.558	394.92	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243332	CIF	C44 H16 Br4 F16 N4	P 1 21/c 1	7.6382; 15.066; 35.9783 90; 90.815; 90	4139.9	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243333	CIF	C18 H8 F8 I2 N2	P n a 21	12.6612; 12.5742; 12.2189 90; 90; 90	1945.3	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243334	CIF	C13 H10 F4 I2 N2	P -1	7.7759; 9.1295; 11.648 97.062; 95.417; 110.587	759.74	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243335	CIF	C24 H12 F8 I2 N2	P -1	7.9933; 10.05; 15.0745 80.124; 78.66; 83.953	1166.52	Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106
7243336	CIF	C24 H28 N4 O12 S4	P 1 21/c 1	30.1122; 11.7047; 8.0292 90; 96.307; 90	2812.8	Bouguerra, Manel; Mahroug, Adel; Wróbel, Agata; Trzybiński, Damian; Woźniak, Krzysztof; Belhouchet, Mohamed Physico-chemical study of new supramolecular-architectured hybrid organic‒inorganic sulfates incorporating diammoniumdiphenylsulfone cations RSC Advances, 2021, 11, 26368-26378
7243337	CIF	C24 H28 N4 O12 S4	P 1 21 1	10.6218; 9.6697; 14.1442 90; 106.322; 90	1394.2	Bouguerra, Manel; Mahroug, Adel; Wróbel, Agata; Trzybiński, Damian; Woźniak, Krzysztof; Belhouchet, Mohamed Physico-chemical study of new supramolecular-architectured hybrid organic‒inorganic sulfates incorporating diammoniumdiphenylsulfone cations RSC Advances, 2021, 11, 26368-26378
7243338	CIF	C14 H18 Co N2 O9	P 1 21/c 1	18.8828; 11.3176; 8.0387 90; 94.0405; 90	1713.66	Hsieh, Yi-Ting; Huang, Ssu-Chia; Lu, Shih-I.; Wang, Hsiao-Hsun; Chang, Tsai-Wen; Wang, Chih-Chieh; Lee, Gene-Hsiang; Chuang, Yu-Chun Electrochemical characterization of and theoretical insight into a series of 2D MOFs, [M(bipy)(C4O4)(H2O)2]·3H2O (M = Mn (1), Fe (2), Co (3) and Zn (4)), for chemical sensing applications RSC Advances, 2021, 11, 26516-26522
7243339	CIF	C25.5 H17 B Cl N2 O2	P 1 21/n 1	11.3434; 14.0488; 13.7721 90; 107.982; 90	2087.53	Hoshi, Keita; Itaya, Masami; Tahara, Koki; Matsumoto, Airi; Tabata, Atsuhi; Nagamune, Hideaki; Yoshida, Yasushi; Hase, Eiji; Minamikawa, Takeo; Yasui, Takeshi; Katayama, Tetsuro; Furube, Akihiro; Minagawa, Keiji; Imada, Yasushi; Yagishita, Fumitoshi Two-photon excitable boron complex based on tridentate imidazo[1,5-a]pyridine ligand for heavy-atom-free mitochondria-targeted photodynamic therapy RSC Advances, 2021, 11, 26403-26407
7243340	CIF	C21 H22.5 Cd2 N2 O12.75	P -1	10.3439; 11.4569; 11.9709 76.621; 64.402; 85.987	1243.97	Wen, Gui-Lin; Wu, Wei-Ping; Wang, Feng-Wu; Liu, Dao-Fu; Wang, Xiao-Ling; Rong, Jie-Wei; Wang, Yao-Yu An excellent thermostable dual-functionalized 3D fsx-type Cd(ii) MOF for the highly selective detection of Fe3+ ions and ten nitroaromatic explosives CrystEngComm, 2021, 23, 6171-6179
7243341	CIF	B4 Cu Mn4 Ni7 O20	P b a m	9.19375; 12.33041; 3.016669 90; 90; 90	341.978	Moshkina, Evgeniya; Bovina, Asya; Molokeev, Maxim; Krylov, Alexander; Shabanov, Alexander; Chernyshov, Artem; Sofronova, Svetlana Study of flux crystal growth peculiarities, structure and Raman spectra of double (Mn,Ni)3BO5 and triple (Mn,Ni,Cu)3BO5 oxyborates with ludwigite structure CrystEngComm, 2021, 23, 5624-5635
7243342	CIF	B4 Cu Mn4 Ni7 O20	P b a m	9.1828; 12.2766; 3.0091 90; 90; 90	339.227	Moshkina, Evgeniya; Bovina, Asya; Molokeev, Maxim; Krylov, Alexander; Shabanov, Alexander; Chernyshov, Artem; Sofronova, Svetlana Study of flux crystal growth peculiarities, structure and Raman spectra of double (Mn,Ni)3BO5 and triple (Mn,Ni,Cu)3BO5 oxyborates with ludwigite structure CrystEngComm, 2021, 23, 5624-5635
7243343	CIF	B2 Cu Mn2 Ni3 O10	P b a m	9.1735; 12.2939; 3.0018 90; 90; 90	338.537	Moshkina, Evgeniya; Bovina, Asya; Molokeev, Maxim; Krylov, Alexander; Shabanov, Alexander; Chernyshov, Artem; Sofronova, Svetlana Study of flux crystal growth peculiarities, structure and Raman spectra of double (Mn,Ni)3BO5 and triple (Mn,Ni,Cu)3BO5 oxyborates with ludwigite structure CrystEngComm, 2021, 23, 5624-5635
7243344	CIF	C46 H47 Cl3 N4 O10	P 1 21/c 1	14.3406; 17.5842; 19.2583 90; 105.478; 90	4680.2	Sharma, Pragati R.; Pandey, Shubham; Malik, Apoorva; Choudhary, Ganpat; Soni, Vineet K.; Sharma, Rakesh K. Calix[4]amido crown functionalized visible sensors for cyanide and iodide anions RSC Advances, 2021, 11, 26644-26654
7243345	CIF	C15 H8 F2 O2	P 1 21/n 1	3.7462; 9.557; 29.904 90; 90.357; 90	1070.6	Gately, Thomas J.; Sontising, Watit; Easley, Connor J.; Islam, Imadul; Al-Kaysi, Rabih O.; Beran, Gregory J. O.; Bardeen, Christopher J. Effect of halogen substitution on energies and dynamics of reversible photomechanical crystals based on 9-anthracenecarboxylic acid CrystEngComm, 2021, 23, 5931-5943
7243346	CIF	C15 H8.07 Cl1.93 O2	C 1 2/c 1	18.665; 3.8338; 33.213 90; 95.3374; 90	2366.3	Gately, Thomas J.; Sontising, Watit; Easley, Connor J.; Islam, Imadul; Al-Kaysi, Rabih O.; Beran, Gregory J. O.; Bardeen, Christopher J. Effect of halogen substitution on energies and dynamics of reversible photomechanical crystals based on 9-anthracenecarboxylic acid CrystEngComm, 2021, 23, 5931-5943
7243347	CIF	H32.2 Mo0.95 N3.05 Na2 O38 V9.05	P -1	8.6373; 10.47; 11.2282 69.078; 87.216; 66.729	866.21	Yao, Zhi-Yuan; Zhang, Guo-Qin; Li, Zi-Han; Shen, Lin-Jiang; Ren, Xiao-Ming Structure-directing effect of aqueous alkali metal ion (Li+, Na+ and K+) clusters on the polyoxoanion configuration in vanadium–molybdenum polyoxometalate solid solutions CrystEngComm, 2021, 23, 6533-6540
7243348	CIF	H35.48 Li2 Mo0.13 N3.87 O38 V9.87	P -1	8.5037; 10.2366; 11.0539 68.641; 87.059; 67.707	824.94	Yao, Zhi-Yuan; Zhang, Guo-Qin; Li, Zi-Han; Shen, Lin-Jiang; Ren, Xiao-Ming Structure-directing effect of aqueous alkali metal ion (Li+, Na+ and K+) clusters on the polyoxoanion configuration in vanadium–molybdenum polyoxometalate solid solutions CrystEngComm, 2021, 23, 6533-6540
7243349	CIF	C44 H54 O4 P2	P -1	10.8049; 13.8758; 14.4304 62.546; 81.232; 88.055	1895.79	Lamola, Jairus L.; Moshapo, Paseka T.; Holzapfel, Cedric W.; Maumela, Munaka Christopher Evaluation of P-bridged biaryl phosphine ligands in palladium-catalysed Suzuki‒Miyaura cross-coupling reactions RSC Advances, 2021, 11, 26883-26891
7243350	CIF	C H O P	P -1	8.0873; 9.4963; 13.1468 92.553; 105.035; 95.537	968.01	Lamola, Jairus L.; Moshapo, Paseka T.; Holzapfel, Cedric W.; Maumela, Munaka Christopher Evaluation of P-bridged biaryl phosphine ligands in palladium-catalysed Suzuki‒Miyaura cross-coupling reactions RSC Advances, 2021, 11, 26883-26891
7243351	CIF	C40 H46 P2	P 1 2/n 1	14.554; 7.222; 31.176 90; 97.878; 90	3246	Lamola, Jairus L.; Moshapo, Paseka T.; Holzapfel, Cedric W.; Maumela, Munaka Christopher Evaluation of P-bridged biaryl phosphine ligands in palladium-catalysed Suzuki‒Miyaura cross-coupling reactions RSC Advances, 2021, 11, 26883-26891
7243352	CIF	C24 H30 N O3 P	C 1 2/c 1	23.219; 8.4649; 24.795 90; 110.975; 90	4550.4	Lamola, Jairus L.; Moshapo, Paseka T.; Holzapfel, Cedric W.; Maumela, Munaka Christopher Evaluation of P-bridged biaryl phosphine ligands in palladium-catalysed Suzuki‒Miyaura cross-coupling reactions RSC Advances, 2021, 11, 26883-26891
7243353	CIF	C31 H28 Cl N5 O	P -1	8.695; 11.849; 13.515 71.182; 88.994; 80.25	1298	Dhir, Abhimanew; Rajkumar, Madhu; Desiraju, Gautam R. Cocrystal hydrate of Bandrowski's base and clotrimazole: a prospective ingredient for hair dye formulations CrystEngComm, 2021, 23, 5421-5424
7243354	CIF	C78 H38 N20	P -1	7.7083; 17.6112; 23.3347 96.381; 96.351; 94.418	3115.98	Ando, Rempei; Jin, Mingoo; Ito, Hajime Charge-transfer crystal with segregated packing structure constructed with hexaarylbenzene and tetracyanoquinodimethane CrystEngComm, 2021, 23, 5564-5568
7243355	CIF	C39 H19 N10	P -1	7.7403; 17.6776; 23.7797 96.408; 96.97; 94.633	3194.85	Ando, Rempei; Jin, Mingoo; Ito, Hajime Charge-transfer crystal with segregated packing structure constructed with hexaarylbenzene and tetracyanoquinodimethane CrystEngComm, 2021, 23, 5564-5568
7243356	CIF	Hg K2 Se4 Sn	I 4/m c m	8.0531; 8.0531; 6.9501 90; 90; 90	450.73	Teri, Gele; Li, Na; Bai, Sagala; E., Namila; Baiyin, Menghe Synthesis, crystal structure, photocatalysis, photocurrent response: one-dimensional K2HgSnSe4 and three-dimensional Na6Cu8Sn3Se13 CrystEngComm, 2021, 23, 6079-6085
7243357	CIF	Cu8 Na6 Se13 Sn3	F m -3 c	18.4754; 18.4754; 18.4754 90; 90; 90	6306.4	Teri, Gele; Li, Na; Bai, Sagala; E., Namila; Baiyin, Menghe Synthesis, crystal structure, photocatalysis, photocurrent response: one-dimensional K2HgSnSe4 and three-dimensional Na6Cu8Sn3Se13 CrystEngComm, 2021, 23, 6079-6085
7243358	CIF	C13 H14 N2 O3 S	P b c a	11.774; 12.4266; 17.269 90; 90; 90	2526.6	Kowalik, Mateusz; Brzeski, Jakub; Gawrońska, Małgorzata; Kazimierczuk, Katarzyna; Makowski, Mariusz Experimental and theoretical investigation of conformational states and noncovalent interactions in crystalline sulfonamides with a methoxyphenyl moiety CrystEngComm, 2021
7243359	CIF	C15 H16 N2 O4 S	P b c a	12.7104; 10.0355; 23.7593 90; 90; 90	3030.6	Kowalik, Mateusz; Brzeski, Jakub; Gawrońska, Małgorzata; Kazimierczuk, Katarzyna; Makowski, Mariusz Experimental and theoretical investigation of conformational states and noncovalent interactions in crystalline sulfonamides with a methoxyphenyl moiety CrystEngComm, 2021
7243360	CIF	C13 H14 N2 O3 S	P b c a	6.0734; 15.4472; 27.066 90; 90; 90	2539.3	Kowalik, Mateusz; Brzeski, Jakub; Gawrońska, Małgorzata; Kazimierczuk, Katarzyna; Makowski, Mariusz Experimental and theoretical investigation of conformational states and noncovalent interactions in crystalline sulfonamides with a methoxyphenyl moiety CrystEngComm, 2021
7243361	CIF	C15 H16 N2 O4 S	P b c a	15.6551; 11.7852; 16.3034 90; 90; 90	3008	Kowalik, Mateusz; Brzeski, Jakub; Gawrońska, Małgorzata; Kazimierczuk, Katarzyna; Makowski, Mariusz Experimental and theoretical investigation of conformational states and noncovalent interactions in crystalline sulfonamides with a methoxyphenyl moiety CrystEngComm, 2021
7243362	CIF	C2 H6 B12 K Li Na8 O30	R -3 :H	9.606; 9.606; 23.5219 90; 90; 120	1879.7	Qiu, Qi-Ming; Yang, Guo-Yu Three mixed-alkaline-metal borates with {Li@B12Ox(OH)24−x} (x = 18, 22) clusters: from isolated oxoboron cluster to unusual layer CrystEngComm, 2021, 23, 6518-6525
7243363	CIF	B12 Cs5 H8 Li O25	P 1 c 1	9.3037; 10.863; 13.007 90; 96.316; 90	1306.6	Qiu, Qi-Ming; Yang, Guo-Yu Three mixed-alkaline-metal borates with {Li@B12Ox(OH)24−x} (x = 18, 22) clusters: from isolated oxoboron cluster to unusual layer CrystEngComm, 2021, 23, 6518-6525
7243364	CIF	B24 Cs10 H16 Li2 O50	P 1 21/c 1	18.5529; 10.8877; 13.0326 90; 96.274; 90	2616.8	Qiu, Qi-Ming; Yang, Guo-Yu Three mixed-alkaline-metal borates with {Li@B12Ox(OH)24−x} (x = 18, 22) clusters: from isolated oxoboron cluster to unusual layer CrystEngComm, 2021, 23, 6518-6525
7243365	CIF	C60 H56 N8 O12 Zn4	I 1 2/a 1	23.5031; 14.9393; 33.0899 90; 106.97; 90	11112.6	Dasgupta, Souradip; Banerjee, Shrobona; Das, Sharmistha; Datta, Anindya From fluorogen to fluorophore by elucidation and suppression of ultrafast excited state processes of a Schiff base Physical Chemistry Chemical Physics, 2021
7243366	CIF	C54 H56 Cl2 N7 O17 Zn2	C 1 2/c 1	27.9433; 13.2179; 31.7637 90; 107.063; 90	11215.6	Dasgupta, Souradip; Banerjee, Shrobona; Das, Sharmistha; Datta, Anindya From fluorogen to fluorophore by elucidation and suppression of ultrafast excited state processes of a Schiff base Physical Chemistry Chemical Physics, 2021
7243367	CIF	C43 H53 N5 Ni2 O10 S	P -1	12.2879; 13.4691; 15.8572 67.268; 89.258; 63.953	2135.5	Roy, Sourav; Sutradhar, Dipankar; Drew, Michael G. B.; Chattopadhyay, Shouvik Theoretical insights on the encapsulated hydronium ion mediated supramolecular assembly of nickel(ii) Schiff base complexes: strong hydrogen bonding interaction due to charge transfer from the lone pair of oxygen to the antibonding orbital of the O–H bond CrystEngComm, 2021, 23, 6724-6735
7243368	CIF	C21 H15 Eu N6 O8	P -1	9.9901; 10.1477; 11.9438 64.998; 76.806; 82.831	1067.84	Deng, Liming; Zhao, Huihui; Liu, Kang; Ma, Dingxuan Efficient luminescence sensing in two lanthanide metal–organic frameworks with rich uncoordinated Lewis basic sites CrystEngComm, 2021, 23, 6591-6598
7243369	CIF	C15 H10 N4 O7 Tb	P -1	8.2132; 9.955; 11.4034 101.681; 102.242; 107.25	834.27	Deng, Liming; Zhao, Huihui; Liu, Kang; Ma, Dingxuan Efficient luminescence sensing in two lanthanide metal–organic frameworks with rich uncoordinated Lewis basic sites CrystEngComm, 2021, 23, 6591-6598
7243370	CIF	C9 H10 B F2 N O3	P 1 21/c 1	6.5253; 11.9; 13.029 90; 100.248; 90	995.6	Wang, Huayi; Schrage, Briana; Takematsu, Kana; Ziegler, Christopher Photophysical properties of a boron analogue of coumarin Physical Chemistry Chemical Physics, 2021
7243371	CIF	C12 H8 Br Cl N2 O	P 1 21/c 1	4.4398; 19.0129; 13.8958 90; 92.18; 90	1172.14	Feiler, Torvid; Bhattacharya, Biswajit; Michalchuk, Adam A. L.; Rhim, Seon-Young; Schröder, Vincent; List-Kratochvil, Emil; Emmerling, Franziska Tuning the mechanical flexibility of organic molecular crystals by polymorphism for flexible optical waveguides CrystEngComm, 2021, 23, 5815-5825
7243372	CIF	C12 H8 Br Cl N2 O	P c a 21	25.1344; 3.8736; 11.9831 90; 90; 90	1166.68	Feiler, Torvid; Bhattacharya, Biswajit; Michalchuk, Adam A. L.; Rhim, Seon-Young; Schröder, Vincent; List-Kratochvil, Emil; Emmerling, Franziska Tuning the mechanical flexibility of organic molecular crystals by polymorphism for flexible optical waveguides CrystEngComm, 2021, 23, 5815-5825
7243373	CIF	C10 H12 N4 O7	P b c a	19.1729; 5.8157; 22.9536 90; 90; 90	2559.41	Saunders, Lucy K.; Pallipurath, Anuradha R.; Gutmann, Matthias J.; Nowell, Harriott; Zhang, Ningjin; Allan, David R. A quantum crystallographic approach to short hydrogen bonds. CrystEngComm, 2021, 23, 6180-6190
7243374	CIF	C10 H12 N4 O7	P b c a	19.157; 5.791; 22.956 90; 90; 90	2546.7	Saunders, Lucy K.; Pallipurath, Anuradha R.; Gutmann, Matthias J.; Nowell, Harriott; Zhang, Ningjin; Allan, David R. A quantum crystallographic approach to short hydrogen bonds. CrystEngComm, 2021, 23, 6180-6190
7243375	CIF	C4 H9 N2 O3	P 1 21/n 1	3.8179; 13.2171; 12.408 90; 94.614; 90	624.1	Saunders, Lucy K.; Pallipurath, Anuradha R.; Gutmann, Matthias J.; Nowell, Harriott; Zhang, Ningjin; Allan, David R. A quantum crystallographic approach to short hydrogen bonds. CrystEngComm, 2021, 23, 6180-6190
7243376	CIF	C4 H9 N2 O3	P 1 21/n 1	3.8179; 13.2171; 12.408 90; 94.614; 90	624.1	Saunders, Lucy K.; Pallipurath, Anuradha R.; Gutmann, Matthias J.; Nowell, Harriott; Zhang, Ningjin; Allan, David R. A quantum crystallographic approach to short hydrogen bonds. CrystEngComm, 2021, 23, 6180-6190
7243377	CIF	C20 H24 N8 O14	C 1 2/c 1	28.3783; 6.0988; 29.7998 90; 92.511; 90	5152.6	Saunders, Lucy K.; Pallipurath, Anuradha R.; Gutmann, Matthias J.; Nowell, Harriott; Zhang, Ningjin; Allan, David R. A quantum crystallographic approach to short hydrogen bonds. CrystEngComm, 2021, 23, 6180-6190
7243378	CIF	C20 H24 N8 O14	C 1 2/c 1	28.3783; 6.0988; 29.7998 90; 92.511; 90	5152.6	Saunders, Lucy K.; Pallipurath, Anuradha R.; Gutmann, Matthias J.; Nowell, Harriott; Zhang, Ningjin; Allan, David R. A quantum crystallographic approach to short hydrogen bonds. CrystEngComm, 2021, 23, 6180-6190
7243379	CIF	C5 H6 N2 Ni O6	P -1	6.8169; 7.3756; 8.5055 105.538; 90.512; 111.867	379.54	Ahmad, M. Shahwaz; Khalid, Mohd; Khan, M. Shahnawaz; Shahid, M.; Ahmad, Musheer Ni(ii)-Based one dimensional coordination polymers for environmental remediation: design, topology, magnetism and the selective adsorption of cationic dyes CrystEngComm, 2021, 23, 6253-6266
7243380	CIF	C10 H8 N4 Ni O5	P 21 21 21	7.7733; 9.819; 14.7763 90; 90; 90	1127.82	Ahmad, M. Shahwaz; Khalid, Mohd; Khan, M. Shahnawaz; Shahid, M.; Ahmad, Musheer Ni(ii)-Based one dimensional coordination polymers for environmental remediation: design, topology, magnetism and the selective adsorption of cationic dyes CrystEngComm, 2021, 23, 6253-6266
7243381	CIF	C28 H42 N4 O4 Pt	P n a 21	20.7074; 4.9052; 28.1381 90; 90; 90	2858.1	Richardson, Jonathan G.; Broadhurst, Edward T.; Benjamin, Helen; Morrison, Carole A.; Moggach, Stephen A.; Robertson, Neil Evaluating the crystalline orbital hierarchy and high-pressure structure–property response of an extended-ligand platinum(ii) bis(1,2-dioximato) complex CrystEngComm, 2021, 23, 6359-6364
7243382	CIF	C28 H43 N4 O4 Pt	P n a 21	20.3217; 4.7007; 27.4573 90; 90; 90	2622.89	Richardson, Jonathan G.; Broadhurst, Edward T.; Benjamin, Helen; Morrison, Carole A.; Moggach, Stephen A.; Robertson, Neil Evaluating the crystalline orbital hierarchy and high-pressure structure–property response of an extended-ligand platinum(ii) bis(1,2-dioximato) complex CrystEngComm, 2021, 23, 6359-6364
7243383	CIF	C28 H42 N4 O4 Pt	P n a 21	20.088; 4.6778; 27.3616 90; 90; 90	2571.1	Richardson, Jonathan G.; Broadhurst, Edward T.; Benjamin, Helen; Morrison, Carole A.; Moggach, Stephen A.; Robertson, Neil Evaluating the crystalline orbital hierarchy and high-pressure structure–property response of an extended-ligand platinum(ii) bis(1,2-dioximato) complex CrystEngComm, 2021, 23, 6359-6364
7243384	CIF	C28 H42 N4 O4 Pt	P n a 21	20.602; 4.8431; 27.9031 90; 90; 90	2784.1	Richardson, Jonathan G.; Broadhurst, Edward T.; Benjamin, Helen; Morrison, Carole A.; Moggach, Stephen A.; Robertson, Neil Evaluating the crystalline orbital hierarchy and high-pressure structure–property response of an extended-ligand platinum(ii) bis(1,2-dioximato) complex CrystEngComm, 2021, 23, 6359-6364
7243385	CIF	C84 H58 Cd2 N14 O10	P 1 21/n 1	18.0232; 18.0621; 24.6633 90; 90.917; 90	8027.8	Ni, Jian-Ling; Liang, Yu; Shao, Juan-Juan; Li, Jun-Feng; Li, Guang-Jun; Chen, Li-Zhuang; Wang, Fang-Ming TIPA-ligand-based luminescent Cd(ii) organic frameworks as an outstanding sensor for detecting Fe3+ in an aqueous medium CrystEngComm, 2021, 23, 5516-5521
7243386	CIF	C82 H58 Cd2 N14 O10	P 1 21/n 1	18.151; 18.053; 24.485 90; 90.522; 90	8023	Ni, Jian-Ling; Liang, Yu; Shao, Juan-Juan; Li, Jun-Feng; Li, Guang-Jun; Chen, Li-Zhuang; Wang, Fang-Ming TIPA-ligand-based luminescent Cd(ii) organic frameworks as an outstanding sensor for detecting Fe3+ in an aqueous medium CrystEngComm, 2021, 23, 5516-5521
7243387	CIF	C27 H25 N3 O6 Zn	P 1 21/n 1	14.0509; 10.1555; 17.9303 90; 103.03; 90	2492.7	Ejarque, Daniel; Calvet, Teresa; Font-Bardia, Mercè; Pons, Josefina Steric crowding of a series of pyridine based ligands influencing the photophysical properties of Zn(II) complexes CrystEngComm, 2021, 23, 6199-6213
7243388	CIF	C46 H44 N4 O7 Zn	C 1 2/c 1	31.098; 5.719; 23.853 90; 106.322; 90	4071.3	Ejarque, Daniel; Calvet, Teresa; Font-Bardia, Mercè; Pons, Josefina Steric crowding of a series of pyridine based ligands influencing the photophysical properties of Zn(II) complexes CrystEngComm, 2021, 23, 6199-6213
7243389	CIF	C43 H45 N7 O8 Zn	C 1 2/c 1	33.183; 8.9246; 15.409 90; 115.059; 90	4133.8	Ejarque, Daniel; Calvet, Teresa; Font-Bardia, Mercè; Pons, Josefina Steric crowding of a series of pyridine based ligands influencing the photophysical properties of Zn(II) complexes CrystEngComm, 2021, 23, 6199-6213
7243390	CIF	C40 H52 N4 O10 Zn	P 1 21/c 1	16.763; 15.8859; 16.337 90; 108.155; 90	4133.9	Ejarque, Daniel; Calvet, Teresa; Font-Bardia, Mercè; Pons, Josefina Steric crowding of a series of pyridine based ligands influencing the photophysical properties of Zn(II) complexes CrystEngComm, 2021, 23, 6199-6213
7243391	CIF	C48 H53 N5 O10 Zn	P -1	11.8153; 12.2801; 17.4928 108.449; 96.437; 102.812	2301.7	Ejarque, Daniel; Calvet, Teresa; Font-Bardia, Mercè; Pons, Josefina Steric crowding of a series of pyridine based ligands influencing the photophysical properties of Zn(II) complexes CrystEngComm, 2021, 23, 6199-6213
7243392	CIF	C74 H74 N8 O15 Zn2	P c a 21	16.8072; 16.4259; 24.7605 90; 90; 90	6835.7	Ejarque, Daniel; Calvet, Teresa; Font-Bardia, Mercè; Pons, Josefina Steric crowding of a series of pyridine based ligands influencing the photophysical properties of Zn(II) complexes CrystEngComm, 2021, 23, 6199-6213
7243393	CIF	B12 Cu5.994 Ni0.006 O24	I -4 2 d	11.4978; 11.4978; 5.62608 90; 90; 90	743.764	Moshkina, Evgeniya; Molokeev, Maxim; Belskaya, Nadejda; Nemtsev, Ivan; Molchanova, Anastasiia; Boldyrev, Kirill Metastable growth and infrared spectra of CuB2O4:Ni single crystals CrystEngComm, 2021, 23, 6761-6768
7243394	CIF	B24 Cu11.88 Ni0.12 O48	I -4 2 d	11.49731; 11.49731; 5.62593 90; 90; 90	743.681	Moshkina, Evgeniya; Molokeev, Maxim; Belskaya, Nadejda; Nemtsev, Ivan; Molchanova, Anastasiia; Boldyrev, Kirill Metastable growth and infrared spectra of CuB2O4:Ni single crystals CrystEngComm, 2021, 23, 6761-6768
7243395	CIF	C43 H80 Cr K2 N6 O17	P 1	10.9523; 11.63; 12.6749 63.886; 66.66; 86.853	1316.98	Pei, Gerui; Shu, Cong-Cong; Li, Mengyang; Sun, Zhong-Ming; Yang, Tao Electronic structures and properties of dianionic pentacarbonyls [TM(CO)5]2− (TM = Cr, Mo, W) Physical Chemistry Chemical Physics, 2021
7243396	CIF	C41 H72 K2 Mo N4 O17	P 1	10.884; 11.6242; 12.7269 64.679; 68.734; 88.596	1339.97	Pei, Gerui; Shu, Cong-Cong; Li, Mengyang; Sun, Zhong-Ming; Yang, Tao Electronic structures and properties of dianionic pentacarbonyls [TM(CO)5]2− (TM = Cr, Mo, W) Physical Chemistry Chemical Physics, 2021
7243397	CIF	C22 H18 N2	C 1 c 1	10.7445; 19.4078; 8.7809 90; 112.949; 90	1686.13	Asressu, Kesatebrhan Haile; Chan, Chieh-Kai; Wang, Cheng-Chung TMSOTf-catalyzed synthesis of trisubstituted imidazoles using hexamethyldisilazane as a nitrogen source under neat and microwave irradiation conditions RSC Advances, 2021, 11, 28061-28071
7243398	CIF	C19 H20 N2	P b c a	16.5878; 9.2549; 20.0075 90; 90; 90	3071.52	Asressu, Kesatebrhan Haile; Chan, Chieh-Kai; Wang, Cheng-Chung TMSOTf-catalyzed synthesis of trisubstituted imidazoles using hexamethyldisilazane as a nitrogen source under neat and microwave irradiation conditions RSC Advances, 2021, 11, 28061-28071
7243399	CIF	C17 H12 N2 S2	P 1 21/c 1	11.1404; 14.6012; 9.2447 90; 104.497; 90	1455.89	Asressu, Kesatebrhan Haile; Chan, Chieh-Kai; Wang, Cheng-Chung TMSOTf-catalyzed synthesis of trisubstituted imidazoles using hexamethyldisilazane as a nitrogen source under neat and microwave irradiation conditions RSC Advances, 2021, 11, 28061-28071
7243400	CIF	C23 H19 Br N2 O2	P 1 21/c 1	9.2089; 19.8306; 10.4519 90; 101.492; 90	1870.44	Asressu, Kesatebrhan Haile; Chan, Chieh-Kai; Wang, Cheng-Chung TMSOTf-catalyzed synthesis of trisubstituted imidazoles using hexamethyldisilazane as a nitrogen source under neat and microwave irradiation conditions RSC Advances, 2021, 11, 28061-28071
7243401	CIF	C38 H28 N4 O2	P n a 21	8.9585; 11.3947; 28.7859 90; 90; 90	2938.4	Asressu, Kesatebrhan Haile; Chan, Chieh-Kai; Wang, Cheng-Chung TMSOTf-catalyzed synthesis of trisubstituted imidazoles using hexamethyldisilazane as a nitrogen source under neat and microwave irradiation conditions RSC Advances, 2021, 11, 28061-28071
7243402	CIF	C47 H41 Cl3 N4 O4	P 1 21/c 1	10.237; 18.3683; 22.354 90; 95.807; 90	4181.8	Asressu, Kesatebrhan Haile; Chan, Chieh-Kai; Wang, Cheng-Chung TMSOTf-catalyzed synthesis of trisubstituted imidazoles using hexamethyldisilazane as a nitrogen source under neat and microwave irradiation conditions RSC Advances, 2021, 11, 28061-28071
7243403	CIF	C16 H8 N4 O2	P -1	6.312; 7.4057; 8.1661 108.309; 109.791; 92.81	335.79	Sanda Bawa, Ali; Meunier-Prest, Rita; Rousselin, Yoann; Couvercelle, Jean-Pierre; Christine, Stern; Malézieux, Bernard; Bouvet, Marcel Series of charge transfer complexes obtained as crystals in a confined environment CrystEngComm, 2021
7243404	CIF	C24 H18 N4 O6	P -1	7.0977; 7.7054; 10.1834 79.516; 85.59; 70.03	514.64	Sanda Bawa, Ali; Meunier-Prest, Rita; Rousselin, Yoann; Couvercelle, Jean-Pierre; Christine, Stern; Malézieux, Bernard; Bouvet, Marcel Series of charge transfer complexes obtained as crystals in a confined environment CrystEngComm, 2021
7243405	CIF	C26 H22 N4 O8	C 1 2/c 1	18.781; 7.6668; 17.9141 90; 112.728; 90	2379.2	Sanda Bawa, Ali; Meunier-Prest, Rita; Rousselin, Yoann; Couvercelle, Jean-Pierre; Christine, Stern; Malézieux, Bernard; Bouvet, Marcel Series of charge transfer complexes obtained as crystals in a confined environment CrystEngComm, 2021
7243406	CIF	C23 H14 N2 O6 S Zn	P 1 21/n 1	10.146; 13.915; 14.641 90; 96.29; 90	2054.6	Li, Zhao-Hao; Xue, Li-Ping; Liu, Si-Rui; Wang, Si-Jin Construction of a viologen-derived 2D material with photochromism, photoswitchable luminescence and inkless and erasable prints via sunlight irradiation CrystEngComm, 2021, 23, 6315-6321
7243407	CIF	C19 H14 N2 O6	P 21 21 21	8.125; 13.7648; 15.2241 90; 90; 90	1702.6	Aryaeifar, Mahnaz; Amiri Rudbari, Hadi; Blacque, Olivier; Islam, Mohammad Khairul; Scopelliti, Rosario; Braun, Jason D.; Herbert, David E.; Bruno, Giuseppe; Janiak, Christoph; Enamullah, Mohammed Schiff base ligands derived from 1,2-bis(2′-nitro-/amino-phenoxy)-3-R-benzene and 2-hydroxy-1-naphthaldehyde and their Cu/Zn(ii) complexes: synthesis, characterization, X-ray structures and computational studies CrystEngComm, 2021, 23, 6322-6339
7243408	CIF	C19 H18 N2 O2	P 1 21/c 1	11.0804; 18.793; 7.5692 90; 98.945; 90	1557	Aryaeifar, Mahnaz; Amiri Rudbari, Hadi; Blacque, Olivier; Islam, Mohammad Khairul; Scopelliti, Rosario; Braun, Jason D.; Herbert, David E.; Bruno, Giuseppe; Janiak, Christoph; Enamullah, Mohammed Schiff base ligands derived from 1,2-bis(2′-nitro-/amino-phenoxy)-3-R-benzene and 2-hydroxy-1-naphthaldehyde and their Cu/Zn(ii) complexes: synthesis, characterization, X-ray structures and computational studies CrystEngComm, 2021, 23, 6322-6339
7243409	CIF	C84 H58 Cu2 N4 O10.5	P -1	12.9151; 14.7249; 17.8978 76.037; 76.919; 82.899	3208.8	Aryaeifar, Mahnaz; Amiri Rudbari, Hadi; Blacque, Olivier; Islam, Mohammad Khairul; Scopelliti, Rosario; Braun, Jason D.; Herbert, David E.; Bruno, Giuseppe; Janiak, Christoph; Enamullah, Mohammed Schiff base ligands derived from 1,2-bis(2′-nitro-/amino-phenoxy)-3-R-benzene and 2-hydroxy-1-naphthaldehyde and their Cu/Zn(ii) complexes: synthesis, characterization, X-ray structures and computational studies CrystEngComm, 2021, 23, 6322-6339
7243410	CIF	C41 H28 N2 O5 Zn	P 1 21/n 1	11.41009; 16.18167; 16.91043 90; 92.4308; 90	3119.44	Aryaeifar, Mahnaz; Amiri Rudbari, Hadi; Blacque, Olivier; Islam, Mohammad Khairul; Scopelliti, Rosario; Braun, Jason D.; Herbert, David E.; Bruno, Giuseppe; Janiak, Christoph; Enamullah, Mohammed Schiff base ligands derived from 1,2-bis(2′-nitro-/amino-phenoxy)-3-R-benzene and 2-hydroxy-1-naphthaldehyde and their Cu/Zn(ii) complexes: synthesis, characterization, X-ray structures and computational studies CrystEngComm, 2021, 23, 6322-6339
7243411	CIF	C41 H30 N2 O4	P -1	7.639; 14.165; 14.697 95.51; 104.51; 96.46	1517	Aryaeifar, Mahnaz; Amiri Rudbari, Hadi; Blacque, Olivier; Islam, Mohammad Khairul; Scopelliti, Rosario; Braun, Jason D.; Herbert, David E.; Bruno, Giuseppe; Janiak, Christoph; Enamullah, Mohammed Schiff base ligands derived from 1,2-bis(2′-nitro-/amino-phenoxy)-3-R-benzene and 2-hydroxy-1-naphthaldehyde and their Cu/Zn(ii) complexes: synthesis, characterization, X-ray structures and computational studies CrystEngComm, 2021, 23, 6322-6339
7243412	CIF	C41 H28 N2 O4 Zn	P 1 21/n 1	11.3049; 17.2598; 15.7727 90; 92.748; 90	3074	Aryaeifar, Mahnaz; Amiri Rudbari, Hadi; Blacque, Olivier; Islam, Mohammad Khairul; Scopelliti, Rosario; Braun, Jason D.; Herbert, David E.; Bruno, Giuseppe; Janiak, Christoph; Enamullah, Mohammed Schiff base ligands derived from 1,2-bis(2′-nitro-/amino-phenoxy)-3-R-benzene and 2-hydroxy-1-naphthaldehyde and their Cu/Zn(ii) complexes: synthesis, characterization, X-ray structures and computational studies CrystEngComm, 2021, 23, 6322-6339
7243413	CIF	C40 H28 N2 O4	C 1 2/c 1	14.023; 15.366; 14.628 90; 109.68; 90	2967.9	Aryaeifar, Mahnaz; Amiri Rudbari, Hadi; Blacque, Olivier; Islam, Mohammad Khairul; Scopelliti, Rosario; Braun, Jason D.; Herbert, David E.; Bruno, Giuseppe; Janiak, Christoph; Enamullah, Mohammed Schiff base ligands derived from 1,2-bis(2′-nitro-/amino-phenoxy)-3-R-benzene and 2-hydroxy-1-naphthaldehyde and their Cu/Zn(ii) complexes: synthesis, characterization, X-ray structures and computational studies CrystEngComm, 2021, 23, 6322-6339
7243414	CIF	C14 H17 N5 O2 S	P 1 21/c 1	16.2034; 9.9224; 10.1872 90; 102.899; 90	1596.53	Vinogradova, Ekaterina E.; Gazieva, Galina A.; Izmest'ev, Alexei N.; Karnoukhova, Valentina A.; Kravchenko, Angelina N. Dimroth-type N/S-interchange of N-aminothioglycolurils in the synthesis of 2-hydrazonoimidazo[4,5-d]thiazolones RSC Advances, 2021, 11, 28395-28400
7243415	CIF	C13 H15 N5 O S	P b c a	9.7481; 9.6628; 30.3545 90; 90; 90	2859.2	Vinogradova, Ekaterina E.; Gazieva, Galina A.; Izmest'ev, Alexei N.; Karnoukhova, Valentina A.; Kravchenko, Angelina N. Dimroth-type N/S-interchange of N-aminothioglycolurils in the synthesis of 2-hydrazonoimidazo[4,5-d]thiazolones RSC Advances, 2021, 11, 28395-28400
7243416	CIF	C80 H294 Cl10 N16 O179 Y14	I 41 2 2	30.983; 30.983; 31.523 90; 90; 90	30260	Lu, Tian-Qi; Yin, Jia-Jia; Chen, Cheng; Shi, Hai-Yan; Zheng, Jun; Liu, Zhengjie; Fang, Xiaolong; Zheng, Xiu-Ying Two pairs of chiral lanthanide–oxo clusters Ln14 induced by amino acid derivatives CrystEngComm, 2021, 23, 6923-6929
7243417	CIF	C80 H318 Cl10 Dy14 N16 O191	I 41 2 2	31.0292; 31.0292; 31.3898 90; 90; 90	30222.5	Lu, Tian-Qi; Yin, Jia-Jia; Chen, Cheng; Shi, Hai-Yan; Zheng, Jun; Liu, Zhengjie; Fang, Xiaolong; Zheng, Xiu-Ying Two pairs of chiral lanthanide–oxo clusters Ln14 induced by amino acid derivatives CrystEngComm, 2021, 23, 6923-6929
7243418	CIF	C80 H294 Cl10 N16 O179 Y14	I 41 2 2	31.008; 31.008; 30.85 90; 90; 90	29662	Lu, Tian-Qi; Yin, Jia-Jia; Chen, Cheng; Shi, Hai-Yan; Zheng, Jun; Liu, Zhengjie; Fang, Xiaolong; Zheng, Xiu-Ying Two pairs of chiral lanthanide–oxo clusters Ln14 induced by amino acid derivatives CrystEngComm, 2021, 23, 6923-6929
7243419	CIF	C80 H318 Cl10 Dy14 N16 O191	I 41 2 2	31.0353; 31.0353; 31.3981 90; 90; 90	30242.3	Lu, Tian-Qi; Yin, Jia-Jia; Chen, Cheng; Shi, Hai-Yan; Zheng, Jun; Liu, Zhengjie; Fang, Xiaolong; Zheng, Xiu-Ying Two pairs of chiral lanthanide–oxo clusters Ln14 induced by amino acid derivatives CrystEngComm, 2021, 23, 6923-6929
7243420	CIF	C25 H32 N2 O7	I 1 2 1	20.206; 6.6378; 20.461 90; 116.74; 90	2450.8	Divya, Indira S.; Amrutha, Surendran; SeethaLekshmi, Sunil; Varughese, Sunil Molecular salts of quinine: a crystal engineering route to enhance the aqueous solubility CrystEngComm, 2021, 23, 6942-6951
7243421	CIF	C27 H32 N2 O6	P 21 21 21	6.943; 17.066; 20.466 90; 90; 90	2425	Divya, Indira S.; Amrutha, Surendran; SeethaLekshmi, Sunil; Varughese, Sunil Molecular salts of quinine: a crystal engineering route to enhance the aqueous solubility CrystEngComm, 2021, 23, 6942-6951
7243422	CIF	C23 H29 N2 O7	C 1 2 1	19.945; 6.698; 18.303 90; 94.98; 90	2436	Divya, Indira S.; Amrutha, Surendran; SeethaLekshmi, Sunil; Varughese, Sunil Molecular salts of quinine: a crystal engineering route to enhance the aqueous solubility CrystEngComm, 2021, 23, 6942-6951
7243423	CIF	C21 H25 N2 O7	C 1 2 1	21.387; 6.419; 18.467 90; 121.541; 90	2160.7	Divya, Indira S.; Amrutha, Surendran; SeethaLekshmi, Sunil; Varughese, Sunil Molecular salts of quinine: a crystal engineering route to enhance the aqueous solubility CrystEngComm, 2021, 23, 6942-6951
7243424	CIF	C23 H28 N2 O6	P 21 21 21	6.6594; 11.845; 26.345 90; 90; 90	2078.11	Divya, Indira S.; Amrutha, Surendran; SeethaLekshmi, Sunil; Varughese, Sunil Molecular salts of quinine: a crystal engineering route to enhance the aqueous solubility CrystEngComm, 2021, 23, 6942-6951
7243425	CIF	C27 H30 N2 O6	P 21 21 21	8.978; 9.713; 28.903 90; 90; 90	2520	Divya, Indira S.; Amrutha, Surendran; SeethaLekshmi, Sunil; Varughese, Sunil Molecular salts of quinine: a crystal engineering route to enhance the aqueous solubility CrystEngComm, 2021, 23, 6942-6951
7243426	CIF	C48 H62 N4 O15	P 1	6.5187; 10.9299; 17.6311 99.531; 97.444; 106.711	1165.47	Divya, Indira S.; Amrutha, Surendran; SeethaLekshmi, Sunil; Varughese, Sunil Molecular salts of quinine: a crystal engineering route to enhance the aqueous solubility CrystEngComm, 2021, 23, 6942-6951
7243427	CIF	C24 H28 F6 N2 O7	P 21 21 21	6.722; 19.671; 20.29 90; 90; 90	2682.9	Divya, Indira S.; Amrutha, Surendran; SeethaLekshmi, Sunil; Varughese, Sunil Molecular salts of quinine: a crystal engineering route to enhance the aqueous solubility CrystEngComm, 2021, 23, 6942-6951
7243428	CIF	C28 H34 N2 O6	P 21 21 21	6.5291; 19.368; 20.431 90; 90; 90	2583.6	Divya, Indira S.; Amrutha, Surendran; SeethaLekshmi, Sunil; Varughese, Sunil Molecular salts of quinine: a crystal engineering route to enhance the aqueous solubility CrystEngComm, 2021, 23, 6942-6951
7243429	CIF	C58 H66 N6 O15 S2	P 21 21 21	15.5984; 15.7897; 23.5416 90; 90; 90	5798.2	Divya, Indira S.; Amrutha, Surendran; SeethaLekshmi, Sunil; Varughese, Sunil Molecular salts of quinine: a crystal engineering route to enhance the aqueous solubility CrystEngComm, 2021, 23, 6942-6951
7243430	CIF	C38 H50 N2 O9	C 1 2 1	30.0476; 6.6972; 21.922 90; 127.752; 90	3488	Jiang, Qi; Hirsh, David A.; Tu, Yifan; Luo, Laibin Multicomponent crystals of an artemisinin derivative and cinchona alkaloids for use as antimalarial drugs CrystEngComm, 2021, 23, 6843-6847
7243431	CIF	C20 H29 Cl N2 O4	P 1	6.7848; 10.6171; 15.4805 98.689; 97.586; 108.323	1027.12	Jiang, Qi; Hirsh, David A.; Tu, Yifan; Luo, Laibin Multicomponent crystals of an artemisinin derivative and cinchona alkaloids for use as antimalarial drugs CrystEngComm, 2021, 23, 6843-6847
7243432	CIF	C25 H23 N3 O3 Se	P -1	7.573; 11.91; 15.396 69.978; 81.094; 78.524	1272.9	Lima, Daisy J. B.; Almeida, Renata G.; Jardim, Guilherme A. M.; Barbosa, Breno P. A.; Santos, Augusto C. C.; Valença, Wagner O.; Scheide, Marcos R.; Gatto, Claudia C.; de Carvalho, Guilherme G. C.; Costa, Pedro M. S.; Pessoa, Claudia; Pereira, Cynthia L. M.; Jacob, Claus; Braga, Antonio L.; da Silva Júnior, Eufrânio N. It takes two to tango: synthesis of cytotoxic quinones containing two redox active centers with potential antitumor activity RSC Medicinal Chemistry, 2021
7243433	CIF	C25 H23 N3 O3 Se	P -1	9.364; 10.472; 12.433 72.327; 75.582; 80.655	1120.1	Lima, Daisy J. B.; Almeida, Renata G.; Jardim, Guilherme A. M.; Barbosa, Breno P. A.; Santos, Augusto C. C.; Valença, Wagner O.; Scheide, Marcos R.; Gatto, Claudia C.; de Carvalho, Guilherme G. C.; Costa, Pedro M. S.; Pessoa, Claudia; Pereira, Cynthia L. M.; Jacob, Claus; Braga, Antonio L.; da Silva Júnior, Eufrânio N. It takes two to tango: synthesis of cytotoxic quinones containing two redox active centers with potential antitumor activity RSC Medicinal Chemistry, 2021
7243434	CIF	C16 H15 N3 O3	P -1	7.89; 9.75; 9.847 96.739; 103.567; 91.493	730.2	Lima, Daisy J. B.; Almeida, Renata G.; Jardim, Guilherme A. M.; Barbosa, Breno P. A.; Santos, Augusto C. C.; Valença, Wagner O.; Scheide, Marcos R.; Gatto, Claudia C.; de Carvalho, Guilherme G. C.; Costa, Pedro M. S.; Pessoa, Claudia; Pereira, Cynthia L. M.; Jacob, Claus; Braga, Antonio L.; da Silva Júnior, Eufrânio N. It takes two to tango: synthesis of cytotoxic quinones containing two redox active centers with potential antitumor activity RSC Medicinal Chemistry, 2021
7243435	CIF	C72 H56 Co4 N12 O20	P 1 21/n 1	11.0719; 13.1489; 11.7587 90; 98.256; 90	1694.13	Wei, Yaoyi; Zhu, Bin; Wang, Jinmiao; Wang, Lulu; Wu, Ruixue; Liu, Wenbo; Ma, Bingxiang; Yang, Dong; Fan, Yuhua; Zhang, Xia A series of novel Co(ii)-based MOFs: syntheses, structural diversity, and various properties CrystEngComm, 2021, 23, 6376-6387
7243436	CIF	C22 H14 Co N3 O5	P -1	9.4348; 9.9705; 11.5494 68.346; 83.463; 76.625	981.9	Wei, Yaoyi; Zhu, Bin; Wang, Jinmiao; Wang, Lulu; Wu, Ruixue; Liu, Wenbo; Ma, Bingxiang; Yang, Dong; Fan, Yuhua; Zhang, Xia A series of novel Co(ii)-based MOFs: syntheses, structural diversity, and various properties CrystEngComm, 2021, 23, 6376-6387
7243437	CIF	C50 H34 Co3 N8 O17	P -1	10.0359; 14.6155; 19.1561 76.537; 89.864; 89.195	2732.3	Wei, Yaoyi; Zhu, Bin; Wang, Jinmiao; Wang, Lulu; Wu, Ruixue; Liu, Wenbo; Ma, Bingxiang; Yang, Dong; Fan, Yuhua; Zhang, Xia A series of novel Co(ii)-based MOFs: syntheses, structural diversity, and various properties CrystEngComm, 2021, 23, 6376-6387
7243438	CIF	C54 H42 Cd3 O24	P -1	7.908; 9.0612; 18.642 95.133; 100.853; 107.104	1238.88	Du, Lin; Lu, Lu; Shi, Chuncheng; Wang, Hong-Yan; Wang, Jun; Singh, Amita; Kumar, Abhinav New Cd(ii) coordination polymers bearing Y-shaped tricarboxylate ligands as photocatalysts for dye degradation CrystEngComm, 2021, 23, 6400-6408
7243439	CIF	C78 H52 Cd2 N4 O22	P -1	6.1936; 15.2015; 18.859 71.913; 89.28; 89.947	1687.7	Du, Lin; Lu, Lu; Shi, Chuncheng; Wang, Hong-Yan; Wang, Jun; Singh, Amita; Kumar, Abhinav New Cd(ii) coordination polymers bearing Y-shaped tricarboxylate ligands as photocatalysts for dye degradation CrystEngComm, 2021, 23, 6400-6408
7243440	CIF	C22 H14 Fe N2 S	P 1 21/c 1	7.4489; 7.4086; 32.085 90; 93.571; 90	1767.2	Boulhaoua, Mohammed; Pasinszki, Tibor; Torvisco, Ana; Oláh-Szabó, Rita; Bősze, Szilvia; Csámpai, Antal Synthesis, structure and in vitro antiproliferative effects of alkyne-linked 1,2,4-thiadiazole hybrids including erlotinib- and ferrocene-containing derivatives RSC Advances, 2021, 11, 28685-28697
7243441	CIF	C14 H9 Fe I N2 S	P 1 21/c 1	12.0436; 14.8358; 7.5107 90; 91.413; 90	1341.58	Boulhaoua, Mohammed; Pasinszki, Tibor; Torvisco, Ana; Oláh-Szabó, Rita; Bősze, Szilvia; Csámpai, Antal Synthesis, structure and in vitro antiproliferative effects of alkyne-linked 1,2,4-thiadiazole hybrids including erlotinib- and ferrocene-containing derivatives RSC Advances, 2021, 11, 28685-28697
7243442	CIF	C14 H9 Cl Fe N2 S	P -1	7.4925; 7.5319; 11.801 102.546; 103.317; 92.575	629.4	Boulhaoua, Mohammed; Pasinszki, Tibor; Torvisco, Ana; Oláh-Szabó, Rita; Bősze, Szilvia; Csámpai, Antal Synthesis, structure and in vitro antiproliferative effects of alkyne-linked 1,2,4-thiadiazole hybrids including erlotinib- and ferrocene-containing derivatives RSC Advances, 2021, 11, 28685-28697
7243443	CIF	C22 H14 Fe N2 S	P 1 21/c 1	11.395; 19.7263; 7.6124 90; 92.122; 90	1710	Boulhaoua, Mohammed; Pasinszki, Tibor; Torvisco, Ana; Oláh-Szabó, Rita; Bősze, Szilvia; Csámpai, Antal Synthesis, structure and in vitro antiproliferative effects of alkyne-linked 1,2,4-thiadiazole hybrids including erlotinib- and ferrocene-containing derivatives RSC Advances, 2021, 11, 28685-28697
7243444	CIF	C12 H9 Cl Fe N2 S	P 1 21/c 1	9.7781; 21.088; 11.3518 90; 99.46; 90	2308.9	Boulhaoua, Mohammed; Pasinszki, Tibor; Torvisco, Ana; Oláh-Szabó, Rita; Bősze, Szilvia; Csámpai, Antal Synthesis, structure and in vitro antiproliferative effects of alkyne-linked 1,2,4-thiadiazole hybrids including erlotinib- and ferrocene-containing derivatives RSC Advances, 2021, 11, 28685-28697
7243445	CIF	C26 H18 Fe2 N2 S	P 1 21/c 1	9.8936; 8.8451; 23.085 90; 99.728; 90	1991.1	Boulhaoua, Mohammed; Pasinszki, Tibor; Torvisco, Ana; Oláh-Szabó, Rita; Bősze, Szilvia; Csámpai, Antal Synthesis, structure and in vitro antiproliferative effects of alkyne-linked 1,2,4-thiadiazole hybrids including erlotinib- and ferrocene-containing derivatives RSC Advances, 2021, 11, 28685-28697
7243446	CIF	C14 H9 Br F12 O2	P 1 21/n 1	11.9324; 12.4694; 12.4948 90; 116.905; 90	1657.9	Chinen, Beatrice L.; Hyvl, Jakub; Brayton, Daniel F.; Riek, Matthew M.; Yoshida, Wesley Y.; Chapp, Timothy W.; Rheingold, Arnold L.; Cain, Matthew F. Trimerization and cyclization of reactive P-functionalities confined within OCO pincers RSC Advances, 2021, 11, 28602-28613
7243447	CIF	C20 H13 F12 O2 P	P 1 21 1	6.4519; 14.303; 11.4008 90; 92.203; 90	1051.31	Chinen, Beatrice L.; Hyvl, Jakub; Brayton, Daniel F.; Riek, Matthew M.; Yoshida, Wesley Y.; Chapp, Timothy W.; Rheingold, Arnold L.; Cain, Matthew F. Trimerization and cyclization of reactive P-functionalities confined within OCO pincers RSC Advances, 2021, 11, 28602-28613
7243448	CIF	C11 H7 Br F6 O3	C 1 c 1	13.9233; 14.4415; 12.9349 90; 100.826; 90	2554.6	Chinen, Beatrice L.; Hyvl, Jakub; Brayton, Daniel F.; Riek, Matthew M.; Yoshida, Wesley Y.; Chapp, Timothy W.; Rheingold, Arnold L.; Cain, Matthew F. Trimerization and cyclization of reactive P-functionalities confined within OCO pincers RSC Advances, 2021, 11, 28602-28613
7243449	CIF	C26 H29 Br O2	P -1	7.4093; 8.2707; 18.706 101.293; 100.471; 94.032	1098.7	Chinen, Beatrice L.; Hyvl, Jakub; Brayton, Daniel F.; Riek, Matthew M.; Yoshida, Wesley Y.; Chapp, Timothy W.; Rheingold, Arnold L.; Cain, Matthew F. Trimerization and cyclization of reactive P-functionalities confined within OCO pincers RSC Advances, 2021, 11, 28602-28613
7243450	CIF	C78 H87 O6 P3	P -1	10.515; 15.037; 22.719 100.8; 94.78; 103.351	3403	Chinen, Beatrice L.; Hyvl, Jakub; Brayton, Daniel F.; Riek, Matthew M.; Yoshida, Wesley Y.; Chapp, Timothy W.; Rheingold, Arnold L.; Cain, Matthew F. Trimerization and cyclization of reactive P-functionalities confined within OCO pincers RSC Advances, 2021, 11, 28602-28613
7243451	CIF	C17 H88 Ce2.5 N2.5 O91 P4 W16	C 1 2 1	25.85; 13.375; 27.037 90; 91.89; 90	9343	Wang, Wenyan; Izarova, Natalya V.; van Leusen, Jan; Kögerler, Paul A phosphonate–lanthanoid polyoxometalate coordination polymer: {Ce2P2W16O60L2}n zipper chains CrystEngComm, 2021, 23, 5989-5993
7243452	CIF	C24 H28 N4 O2 S2	P -1	7.177; 7.455; 11.03 105.64; 97.57; 90.8	562.6	Gayathri, Parthasarathy; Kanagajothi, Karuppaiah; Nag, Probal; Anand, Neethu; Reddy, Vennapusa Sivaranjana; Moon, Dohyun; Anthony, Savarimuthu Philip; Madhu, Vedichi Symmetrical and unsymmetrical thiazole based ESIPT derivatives: Highly selective fluorescence sensing of Cu2+ and structure controlled reversible mechanofluorochromism CrystEngComm, 2021
7243453	CIF	C24 H30 N4 O2 S	P 1 21 1	6.633; 8.53; 19.929 90; 94.24; 90	1124.5	Gayathri, Parthasarathy; Kanagajothi, Karuppaiah; Nag, Probal; Anand, Neethu; Reddy, Vennapusa Sivaranjana; Moon, Dohyun; Anthony, Savarimuthu Philip; Madhu, Vedichi Symmetrical and unsymmetrical thiazole based ESIPT derivatives: Highly selective fluorescence sensing of Cu2+ and structure controlled reversible mechanofluorochromism CrystEngComm, 2021
7243454	CIF	C32 H18 F12 N4 O10 S	P 1 21/n 1	8.1467; 21.3962; 20.1733 90; 90.509; 90	3516.24	Broumidis, Emmanouil; Jones, Callum M. S.; Koyioni, Maria; Kourtellaris, Andreas; Lloyd, Gareth O.; Marques-Hueso, Jose; Koutentis, Panayiotis A.; Vilela, Filipe 8,8′-(Benzo[c][1,2,5]thiadiazole-4,7-diyl)bis(quinolin-4(1H)-one): a twisted photosensitizer with AIE properties RSC Advances, 2021, 11, 29102-29107
7243455	CIF	C28 H24 N2 O5	P -1	8.748; 8.7951; 15.4152 96.274; 97.889; 98.627	1151.3	Sendh, Jagajiban; Singh, Munendra Pal; Baruah, Jubaraj B. 5-[(Pyren-9-ylmethyl)amino]isophthalic acid with nitrogen containing heterocycles: stacking, N–H⋯π interactions and photoluminescence CrystEngComm, 2021, 23, 6952-6966
7243456	CIF	C31 H26 N4 O4	P -1	7.9646; 12.144; 14.685 112.558; 90.032; 99.526	1290.4	Sendh, Jagajiban; Singh, Munendra Pal; Baruah, Jubaraj B. 5-[(Pyren-9-ylmethyl)amino]isophthalic acid with nitrogen containing heterocycles: stacking, N–H⋯π interactions and photoluminescence CrystEngComm, 2021, 23, 6952-6966
7243457	CIF	C31 H21 N2 O4	P -1	8.8551; 9.9074; 14.9941 103.891; 95.539; 112.603	1152.44	Sendh, Jagajiban; Singh, Munendra Pal; Baruah, Jubaraj B. 5-[(Pyren-9-ylmethyl)amino]isophthalic acid with nitrogen containing heterocycles: stacking, N–H⋯π interactions and photoluminescence CrystEngComm, 2021, 23, 6952-6966
7243458	CIF	C35 H25 N3 O4	P -1	9.065; 12.112; 13.231 110.005; 94.095; 105.378	1294.9	Sendh, Jagajiban; Singh, Munendra Pal; Baruah, Jubaraj B. 5-[(Pyren-9-ylmethyl)amino]isophthalic acid with nitrogen containing heterocycles: stacking, N–H⋯π interactions and photoluminescence CrystEngComm, 2021, 23, 6952-6966
7243459	CIF	C34 H26 N6 O4	P -1	7.6359; 13.6124; 14.8657 103.866; 103.123; 100.924	1411.53	Sendh, Jagajiban; Singh, Munendra Pal; Baruah, Jubaraj B. 5-[(Pyren-9-ylmethyl)amino]isophthalic acid with nitrogen containing heterocycles: stacking, N–H⋯π interactions and photoluminescence CrystEngComm, 2021, 23, 6952-6966
7243460	CIF	C33 H29 N5 O9	P -1	7.1375; 12.3754; 19.214 94.647; 98.852; 98.195	1650.6	Sendh, Jagajiban; Singh, Munendra Pal; Baruah, Jubaraj B. 5-[(Pyren-9-ylmethyl)amino]isophthalic acid with nitrogen containing heterocycles: stacking, N–H⋯π interactions and photoluminescence CrystEngComm, 2021, 23, 6952-6966
7243461	CIF	C46 H36 Br4 Cl2 S32 Zn	I 41/a :2	9.7458; 9.7458; 74.416 90; 90; 90	7068.1	Shilov, Gennady V.; Zhilyaeva, Elena I.; Aldoshin, Sergey M.; Flakina, Alexandra M.; Lyubovskii, Rustem B.; Pesotskii, Sergei I.; Lyubovskaya, Rimma N. Evolution of crystal structure of dual layered molecular conductor (ET)4ZnBr4(C6H4Cl2) with temperature CrystEngComm, 2021, 23, 6620-6625
7243462	CIF	C46 H36 Br4 Cl2 S32 Zn	I -1	9.478; 9.9772; 74.311 91.03; 90.423; 90.136	7025.8	Shilov, Gennady V.; Zhilyaeva, Elena I.; Aldoshin, Sergey M.; Flakina, Alexandra M.; Lyubovskii, Rustem B.; Pesotskii, Sergei I.; Lyubovskaya, Rimma N. Evolution of crystal structure of dual layered molecular conductor (ET)4ZnBr4(C6H4Cl2) with temperature CrystEngComm, 2021, 23, 6620-6625
7243463	CIF	C46 H36 Br4 Cl2 S32 Zn	I -1	9.31052; 9.9603; 74.2011 91.3016; 90.4551; 90.3631	6878.9	Shilov, Gennady V.; Zhilyaeva, Elena I.; Aldoshin, Sergey M.; Flakina, Alexandra M.; Lyubovskii, Rustem B.; Pesotskii, Sergei I.; Lyubovskaya, Rimma N. Evolution of crystal structure of dual layered molecular conductor (ET)4ZnBr4(C6H4Cl2) with temperature CrystEngComm, 2021, 23, 6620-6625
7243464	CIF	C46 H36 Br4 Cl2 S32 Zn	I -1	9.38534; 9.99249; 74.2113 91.1767; 90.4551; 90.1829	6958	Shilov, Gennady V.; Zhilyaeva, Elena I.; Aldoshin, Sergey M.; Flakina, Alexandra M.; Lyubovskii, Rustem B.; Pesotskii, Sergei I.; Lyubovskaya, Rimma N. Evolution of crystal structure of dual layered molecular conductor (ET)4ZnBr4(C6H4Cl2) with temperature CrystEngComm, 2021, 23, 6620-6625
7243465	CIF	C46 H36 Br4 Cl2 S32 Zn	I -1	9.28488; 9.9294; 74.1606 91.2956; 90.4755; 90.4013	6834.9	Shilov, Gennady V.; Zhilyaeva, Elena I.; Aldoshin, Sergey M.; Flakina, Alexandra M.; Lyubovskii, Rustem B.; Pesotskii, Sergei I.; Lyubovskaya, Rimma N. Evolution of crystal structure of dual layered molecular conductor (ET)4ZnBr4(C6H4Cl2) with temperature CrystEngComm, 2021, 23, 6620-6625
7243466	CIF	C46 H36 Br4 Cl2 S32 Zn	I -1	9.3549; 9.9886; 74.2441 91.25; 90.478; 90.243	6935.6	Shilov, Gennady V.; Zhilyaeva, Elena I.; Aldoshin, Sergey M.; Flakina, Alexandra M.; Lyubovskii, Rustem B.; Pesotskii, Sergei I.; Lyubovskaya, Rimma N. Evolution of crystal structure of dual layered molecular conductor (ET)4ZnBr4(C6H4Cl2) with temperature CrystEngComm, 2021, 23, 6620-6625
7243467	CIF	C4 Ca3 K2 O12	P 21 21 21	7.3905; 8.8156; 16.4817 90; 90; 90	1073.81	Rashchenko, Sergey V.; Shatskiy, Anton F.; Ignatov, Mark A.; Arefiev, Anton V.; Litasov, Konstantin D. High-pressure synthesis and crystal structure of non-centrosymmetric K2Ca3(CO3)4 CrystEngComm, 2021, 23, 6675-6681
7243468	CIF	C31 H23 Cl N2 O6	P -1	9.0827; 9.5303; 15.2656 81.275; 78.069; 85.015	1275.79	Li, Chang; Wu, Di; Li, Jiulong; Ji, Xu; Qi, Luguang; Sun, Qin; Wang, Aiyu; Xie, Chuang; Gong, Junbo; Chen, Wei Multicomponent crystals of clotrimazole: a combined theoretical and experimental study CrystEngComm, 2021, 23, 6977-6993
7243469	CIF	C29 H21 Cl N4 O7	P -1	9.1618; 10.0986; 14.4711 80.377; 78.44; 86.267	1292.58	Li, Chang; Wu, Di; Li, Jiulong; Ji, Xu; Qi, Luguang; Sun, Qin; Wang, Aiyu; Xie, Chuang; Gong, Junbo; Chen, Wei Multicomponent crystals of clotrimazole: a combined theoretical and experimental study CrystEngComm, 2021, 23, 6977-6993
7243470	CIF	C36 H31 Cl N2 O5	P -1	9.4734; 12.1901; 13.6109 78.39; 71.852; 89.207	1461.05	Li, Chang; Wu, Di; Li, Jiulong; Ji, Xu; Qi, Luguang; Sun, Qin; Wang, Aiyu; Xie, Chuang; Gong, Junbo; Chen, Wei Multicomponent crystals of clotrimazole: a combined theoretical and experimental study CrystEngComm, 2021, 23, 6977-6993
7243471	CIF	C29 H22 Cl N3 O4	P -1	8.7637; 9.2884; 15.7219 106.107; 103.639; 90.928	1190.29	Li, Chang; Wu, Di; Li, Jiulong; Ji, Xu; Qi, Luguang; Sun, Qin; Wang, Aiyu; Xie, Chuang; Gong, Junbo; Chen, Wei Multicomponent crystals of clotrimazole: a combined theoretical and experimental study CrystEngComm, 2021, 23, 6977-6993
7243472	CIF	C31 H24 Cl N3 O2	P -1	8.6793; 10.6795; 13.6524 95.603; 95.284; 97.549	1241.41	Li, Chang; Wu, Di; Li, Jiulong; Ji, Xu; Qi, Luguang; Sun, Qin; Wang, Aiyu; Xie, Chuang; Gong, Junbo; Chen, Wei Multicomponent crystals of clotrimazole: a combined theoretical and experimental study CrystEngComm, 2021, 23, 6977-6993
7243473	CIF	C33 H30 Cl N3 O5	P -1	9.0175; 9.9958; 16.7343 86.397; 75.472; 86.959	1456.18	Li, Chang; Wu, Di; Li, Jiulong; Ji, Xu; Qi, Luguang; Sun, Qin; Wang, Aiyu; Xie, Chuang; Gong, Junbo; Chen, Wei Multicomponent crystals of clotrimazole: a combined theoretical and experimental study CrystEngComm, 2021, 23, 6977-6993
7243474	CIF	C29 H23 Cl N2 O4	P n a 21	21.0772; 8.2738; 13.8978 90; 90; 90	2423.62	Li, Chang; Wu, Di; Li, Jiulong; Ji, Xu; Qi, Luguang; Sun, Qin; Wang, Aiyu; Xie, Chuang; Gong, Junbo; Chen, Wei Multicomponent crystals of clotrimazole: a combined theoretical and experimental study CrystEngComm, 2021, 23, 6977-6993
7243475	CIF	C32 H23 Cl N2 O8	P -1	11.7142; 15.503; 16.6489 69.389; 89.642; 89.69	2829.9	Li, Chang; Wu, Di; Li, Jiulong; Ji, Xu; Qi, Luguang; Sun, Qin; Wang, Aiyu; Xie, Chuang; Gong, Junbo; Chen, Wei Multicomponent crystals of clotrimazole: a combined theoretical and experimental study CrystEngComm, 2021, 23, 6977-6993
7243476	CIF	C31 H27 Cl N4 O7	P -1	8.8976; 12.8529; 13.9071 102.931; 98.041; 106.569	1449.97	Li, Chang; Wu, Di; Li, Jiulong; Ji, Xu; Qi, Luguang; Sun, Qin; Wang, Aiyu; Xie, Chuang; Gong, Junbo; Chen, Wei Multicomponent crystals of clotrimazole: a combined theoretical and experimental study CrystEngComm, 2021, 23, 6977-6993
7243477	CIF	C21 H12 Cd O7 P	P b c a	23.728; 13.165; 30.085 90; 90; 90	9398	Peng, Shuang; Qi, Yan-Jie; Li, Xin-Hao; Sun, Cai; Li, Ling-Yun; Li, Xin-Xiong; Zheng, Shou-Tian; Zhang, Qichun Two isomeric zeolite-like metal‒organic frameworks with mechanically responsive luminescence emission and gas adsorption properties CrystEngComm, 2021, 23, 5753-5757
7243478	CIF	C23 H20 Cd O7 P	P 1 21/c 1	15.135; 22.028; 18.37 90; 101.248; 90	6007	Peng, Shuang; Qi, Yan-Jie; Li, Xin-Hao; Sun, Cai; Li, Ling-Yun; Li, Xin-Xiong; Zheng, Shou-Tian; Zhang, Qichun Two isomeric zeolite-like metal‒organic frameworks with mechanically responsive luminescence emission and gas adsorption properties CrystEngComm, 2021, 23, 5753-5757
7243479	CIF	C30 H28 I6 N6 Pb	C 1 2/m 1	13.0069; 14.6783; 10.1587 90; 107.854; 90	1846.09	Yuan, Yaxuan; Xian, Yeming; Long, Yi; Zhang, Yangyi; Rahman, Naveed Ur; Zhang, Yongli; Fan, Jiandong; Li, Wenzhe Terpyridine-derived perovskite single crystals with tunable structures and electronic dimensionality RSC Advances, 2021, 11, 24816-24821
7243480	CIF	C30 H22 I6 N6 Pb3	P b c n	22.4598; 12.1864; 14.4057 90; 90; 90	3942.9	Yuan, Yaxuan; Xian, Yeming; Long, Yi; Zhang, Yangyi; Rahman, Naveed Ur; Zhang, Yongli; Fan, Jiandong; Li, Wenzhe Terpyridine-derived perovskite single crystals with tunable structures and electronic dimensionality RSC Advances, 2021, 11, 24816-24821
7243481	CIF	C60 H52 I18 N12 Pb5	P -1	12.8492; 12.89296; 15.7151 86.4469; 70.5166; 72.3962	2337.22	Yuan, Yaxuan; Xian, Yeming; Long, Yi; Zhang, Yangyi; Rahman, Naveed Ur; Zhang, Yongli; Fan, Jiandong; Li, Wenzhe Terpyridine-derived perovskite single crystals with tunable structures and electronic dimensionality RSC Advances, 2021, 11, 24816-24821
7243482	CIF	C22 H14 Cl N O4	P 1 21/c 1	20.415; 5.9806; 15.39 90; 105.234; 90	1813	Chen, Rongxiang; Liu, Bing; Li, Wenbo; Wang, Kai-Kai; Miao, Changqing; Li, Zhizhuang; Lv, Yingjie; Liu, Lantao Synthesis of N-alkoxyphthalimide derivatives via PIDA-promoted cross dehydrogenative coupling reaction RSC Advances, 2021, 11, 8051-8054
7243483	CIF	B3 Ca4 Ho O10	C 1 m 1	8.09; 16.018; 3.5317 90; 101.284; 90	448.8	Yu, Pingzhang; Pan, Xiaobo; Wu, Guangda; Liu, Yanqing; Yu, Fapeng; Wang, Zhengping; Xu, Xinguang Crystal growth, optical, thermal and piezoelectric properties of HoCa4O(BO3)3 crystal CrystEngComm, 2021, 23, 6574-6581
7243484	CIF	C100 H210 O93	C 1 2 1	19.133; 24.566; 15.782 90; 108.873; 90	7019	Vicatos, A. I.; Caira, M. R. Cyclodextrin complexes of the anticonvulsant agent valproic acid CrystEngComm, 2021, 23, 6582-6590
7243485	CIF	C129 H237.8 O77.88	P 1	10.396; 15.111; 25.494 83.247; 81.556; 89.475	3933.9	Vicatos, A. I.; Caira, M. R. Cyclodextrin complexes of the anticonvulsant agent valproic acid CrystEngComm, 2021, 23, 6582-6590
7243486	CIF	C62 H114.4 O33.2	P 21 21 21	15.337; 20.728; 23.104 90; 90; 90	7345	Vicatos, A. I.; Caira, M. R. Cyclodextrin complexes of the anticonvulsant agent valproic acid CrystEngComm, 2021, 23, 6582-6590
7243487	CIF	C176 H402 O177	P 4 21 2	23.745; 23.745; 23.1 90; 90; 90	13024	Vicatos, A. I.; Caira, M. R. Cyclodextrin complexes of the anticonvulsant agent valproic acid CrystEngComm, 2021, 23, 6582-6590
7243488	CIF	B7 Ba12 F4 Li O21	P 42/m b c	13.5174; 13.5174; 14.9399 90; 90; 90	2729.82	Bekker, T. B.; Yelisseyev, A. P.; Solntsev, V. P.; Davydov, A. V.; Inerbaev, T. M.; Rashchenko, S. V.; Kostyukov, A. I. The influence of co-doping on the luminescence and thermoluminescence properties of Cu-containing fluoride borate crystals CrystEngComm, 2021, 23, 6599-6609
7243489	CIF	C94 H83 N8 O18 Zn3	P -1	15.186; 15.21; 26.964 91.53; 102.04; 91.69	6085	Mazzeo, Paolo P.; Balestri, Davide; Bacchi, Alessia; Pelagatti, Paolo Stabilization of liquid active guests via nanoconfinement into a flexible microporous metal–organic framework CrystEngComm, 2021, 23, 7262-7269
7243490	CIF	C130.35 H132.3 N8.95 O22.3 Zn3	P -1	21.473; 21.553; 26.886 94.896; 102.406; 89.986	12106	Mazzeo, Paolo P.; Balestri, Davide; Bacchi, Alessia; Pelagatti, Paolo Stabilization of liquid active guests via nanoconfinement into a flexible microporous metal–organic framework CrystEngComm, 2021, 23, 7262-7269
7243491	CIF	C126.62 H125.75 N7.62 O20.25 Zn3	P -1	15.263; 30.497; 26.95 89.2; 82.16; 87.8	12418	Mazzeo, Paolo P.; Balestri, Davide; Bacchi, Alessia; Pelagatti, Paolo Stabilization of liquid active guests via nanoconfinement into a flexible microporous metal–organic framework CrystEngComm, 2021, 23, 7262-7269
7243492	CIF	C39 H15 N6	P -1	7.3212; 9.9861; 19.292 78.231; 89.49; 77.581	1347.6	Mandal, Arkalekha; Kim, Youngmee; Kim, Sung-Jin; Park, JaeHong Unravelling the fluorescence and semiconductor properties of a new coronene:TCNB charge transfer cocrystal polymorph CrystEngComm, 2021, 23, 7132-7140
7243493	CIF	C17 H29 N O3	P 1 21 1	9.706; 24.576; 14.6471 90; 109.129; 90	3300.9	Li, Wei; Zhao, Lin; Sun, Li-Tong; Xie, Ze-Ping; Zhang, Shu-Min; Yue, Xi-Dian; Dai, Sheng-Jun Trinorlabdane diterpenoid alkaloids featuring an unprecedented skeleton with anti-inflammatory and anti-viral activities from Forsythia suspensa RSC Advances, 2021, 11, 29684-29689
7243494	CIF	C13 H15 N O2	P 1 21/n 1	6.8238; 14.8389; 10.849 90; 96.975; 90	1090.41	Su, Ziqi; Chai, Hongxin; Xu, Juan; Li, Jiarong ZnCl2-promoted domino reaction of 2-hydroxybenzonitriles with ketones for synthesis of 1,3-benzoxazin-4-ones RSC Advances, 2021, 11, 29906-29911
7243495	CIF	C7 H10 Br N5 O2	P 1 21/c 1	15.2177; 6.7634; 11.0057 90; 109.445; 90	1068.13	Bąchor, Urszula; Drozd-Szczygieł, Ewa; Bąchor, Remigiusz; Jerzykiewicz, Lucjan; Wieczorek, Robert; Mączyński, Marcin New water-soluble isoxazole-linked 1,3,4-oxadiazole derivative with delocalized positive charge RSC Advances, 2021, 11, 29668-29674
7243496	CIF	C16 H11 N O2	C 1 c 1	52.556; 3.8744; 24.2104 90; 103.315; 90	4797.3	Ikeda, Kazuho; Yoo, Dongho; Nishikawa, Ryu; Kawamoto, Tadashi; Mori, Takehiko Charge injected proton transfer in indigo derivatives Physical Chemistry Chemical Physics, 2021
7243497	CIF	C6 H7 Co0.5 N3 O4	P -1	7.385; 7.98; 8.186 65.269; 89.12; 70.156	407.6	Ma, Zhi Long; Wang, Meng Chen; Tian, Li; Liu, Zhong Yi Solvent-controlled metal coordination polymers of Co(ii) with different topological structures and properties CrystEngComm, 2021, 23, 7253-7261
7243498	CIF	C24 H14 Co N12 O8	P -1	7.1998; 10.346; 12.6281 73.713; 84.815; 79.798	887.8	Ma, Zhi Long; Wang, Meng Chen; Tian, Li; Liu, Zhong Yi Solvent-controlled metal coordination polymers of Co(ii) with different topological structures and properties CrystEngComm, 2021, 23, 7253-7261
7243499	CIF	C36 H22 Co3 N18 O14	P -1	10.3709; 10.4034; 13.8572 71.806; 86.047; 88.735	1416.96	Ma, Zhi Long; Wang, Meng Chen; Tian, Li; Liu, Zhong Yi Solvent-controlled metal coordination polymers of Co(ii) with different topological structures and properties CrystEngComm, 2021, 23, 7253-7261
7243500	CIF	C21 H14 Cl I O	P -1	8.1585; 10.0268; 11.7398 82.2199; 69.7716; 70.2331	847.84	Al-Zoubi, Raed M.; Al-Jammal, Walid K.; Ferguson, Michael J.; Murphy, Graham K. Domino C‒C/C‒O bond formation: palladium-catalyzed regioselective synthesis of 7-iodobenzo[b]furans using 1,2,3-triiodobenzenes and benzylketones RSC Advances, 2021, 11, 30069-30077
7243501	CIF	C20 H12 Cl I O	P -1	9.244; 9.988; 10.515 86.607; 65.448; 70.67	829.8	Al-Zoubi, Raed M.; Al-Jammal, Walid K.; Ferguson, Michael J.; Murphy, Graham K. Domino C‒C/C‒O bond formation: palladium-catalyzed regioselective synthesis of 7-iodobenzo[b]furans using 1,2,3-triiodobenzenes and benzylketones RSC Advances, 2021, 11, 30069-30077
7243502	CIF	C9 H19 O11 Y	P 1 21 1	10.578; 5.739; 13.2053 90; 97.765; 90	794.31	Yapryntsev, A. D.; Baranchikov, A. E.; Churakov, A. V.; Kopitsa, G. P.; Silvestrova, A. A.; Golikova, M. V.; Ivanova, O. S.; Gorshkova, Yu. E.; Ivanov, V. K. The first amorphous and crystalline yttrium lactate: synthesis and structural features RSC Advances, 2021, 11, 30195-30205
7243503	CIF	C28 H21 N3 O2	C 1 c 1	10.5012; 21.4163; 10.7561 90; 116.366; 90	2167.4	Thadem, Nagender; Rajesh, Manda; Das, Saibal Activator free diastereoselective 1,3-dipolar cycloaddition: a quick access to coumarin based spiro multi heterocyclic adducts RSC Advances, 2021, 11, 29934-29938
7243504	CIF	C25 H25 N3 O3	P n a 21	10.5361; 20.5984; 9.9179 90; 90; 90	2152.45	Thadem, Nagender; Rajesh, Manda; Das, Saibal Activator free diastereoselective 1,3-dipolar cycloaddition: a quick access to coumarin based spiro multi heterocyclic adducts RSC Advances, 2021, 11, 29934-29938
7243505	CIF	C22 H20 N2 O3	P 1 21/c 1	14.0372; 9.4978; 14.4733 90; 113.232; 90	1773.15	Thadem, Nagender; Rajesh, Manda; Das, Saibal Activator free diastereoselective 1,3-dipolar cycloaddition: a quick access to coumarin based spiro multi heterocyclic adducts RSC Advances, 2021, 11, 29934-29938
7243506	CIF	C44 H56 N9 O9 Zn2	A e a 2	26.205; 25.903; 14.652 90; 90; 90	9946	Basak, Tanmoy; Frontera, Antonio; Chattopadhyay, Shouvik Synthesis and characterization of a mononuclear zinc(ii) Schiff base complex: on the importance of C‒H⋯π interactions RSC Advances, 2021, 11, 30148-30155
7243507	CIF	C27 H26 P4 Pd	P -1	8.4671; 10.5451; 14.4131 88.379; 80.098; 73.608	1215.92	Xia, Shu-Mei; Yang, Zhi-Wen; Yao, Xiang-Yang; Chen, Kai-Hong; Qiu, Li-Qi; He, Liang-Nian The synergistic copper/ppm Pd-catalyzed hydrocarboxylation of alkynes with formic acid as a CO surrogate as well as a hydrogen source: an alternative indirect utilization of CO2 Green Chemistry, 2021, 23, 8089-8095
7243508	CIF	C17 H10 F6 O2	P 1 21/c 1	5.5094; 15.212; 18.2863 90; 96.429; 90	1522.92	Xia, Shu-Mei; Yang, Zhi-Wen; Yao, Xiang-Yang; Chen, Kai-Hong; Qiu, Li-Qi; He, Liang-Nian The synergistic copper/ppm Pd-catalyzed hydrocarboxylation of alkynes with formic acid as a CO surrogate as well as a hydrogen source: an alternative indirect utilization of CO2 Green Chemistry, 2021, 23, 8089-8095
7243509	CIF	C28 H36 Li N4 O8	C 1 2/c 1	16.8468; 20.5523; 8.3102 90; 90.541; 90	2877.2	Yan, Bingjia; Horton, Peter N.; Weston, Simon C.; Russell, Andrea E.; Grossel, Martin C. Novel TCNQ-stacking motifs in (12-crown-4)-complexes of alkali metal TCNQ salts CrystEngComm, 2021, 23, 6755-6760
7243510	CIF	C40 H40 K N8 O8	P -1	8.0221; 13.6455; 18.3816 80.507; 85.505; 85.457	1973.99	Yan, Bingjia; Horton, Peter N.; Weston, Simon C.; Russell, Andrea E.; Grossel, Martin C. Novel TCNQ-stacking motifs in (12-crown-4)-complexes of alkali metal TCNQ salts CrystEngComm, 2021, 23, 6755-6760
7243511	CIF	C40 H40 N8 Na O8	P -1	8.1103; 13.6858; 17.7029 78.737; 86.244; 85.714	1919.11	Yan, Bingjia; Horton, Peter N.; Weston, Simon C.; Russell, Andrea E.; Grossel, Martin C. Novel TCNQ-stacking motifs in (12-crown-4)-complexes of alkali metal TCNQ salts CrystEngComm, 2021, 23, 6755-6760
7243512	CIF	C28 H36 N4 Na O8	C 1 2/c 1	17.191; 20.518; 8.3079 90; 90.131; 90	2930.4	Yan, Bingjia; Horton, Peter N.; Weston, Simon C.; Russell, Andrea E.; Grossel, Martin C. Novel TCNQ-stacking motifs in (12-crown-4)-complexes of alkali metal TCNQ salts CrystEngComm, 2021, 23, 6755-6760
7243513	CIF	C40 H40 Li N8 O8	P -1	8.2066; 13.7299; 17.8792 72.441; 83.006; 86.623	1905.87	Yan, Bingjia; Horton, Peter N.; Weston, Simon C.; Russell, Andrea E.; Grossel, Martin C. Novel TCNQ-stacking motifs in (12-crown-4)-complexes of alkali metal TCNQ salts CrystEngComm, 2021, 23, 6755-6760
7243514	CIF	Cs H2 Mn O10 V3	P b c m	6.869; 9.873; 15.041 90; 90; 90	1020	Zou, Yan-Min; Lan, Xiao-Yun; Ma, Wen; Jin, Jian-Ce; Sun, Hai-Yan; Li, Ji-Long; Feng, Mei-Ling; Huang, Xiao-Ying Towards new cesium containing manganese vanadates via a precursor method CrystEngComm, 2021, 23, 6909-6914
7243515	CIF	Cs4.34 H5.93 Mn1.83 O26.97 V8	P 4/m n c	13.569; 13.569; 8.5361 90; 90; 90	1571.65	Zou, Yan-Min; Lan, Xiao-Yun; Ma, Wen; Jin, Jian-Ce; Sun, Hai-Yan; Li, Ji-Long; Feng, Mei-Ling; Huang, Xiao-Ying Towards new cesium containing manganese vanadates via a precursor method CrystEngComm, 2021, 23, 6909-6914
7243516	CIF	C20 H28 Ag2 B2 F8 N8 S4	P -1	10.7972; 13.496; 13.6852 62.208; 86.974; 67.181	1605.91	Soleymani-Babadi, Susan; Beheshti, Azizolla; Bahrani-Pour, Maryam; Salahshournia, Behrang; Zafarian, Hamid-Reza; Trzybiński, Damian; Mayer, Peter; Wozniak, Krzysztof Involvement of various anions in tuning the structure of silver(i) coordination polymers based on a S-donor ligand: syntheses, crystal structure and uptake properties CrystEngComm, 2021, 23, 7502-7516
7243517	CIF	C10 H14 Ag Cl N4 O4 S2	P 1 21/c 1	10.0969; 18.6753; 7.9739 90; 92.264; 90	1502.41	Soleymani-Babadi, Susan; Beheshti, Azizolla; Bahrani-Pour, Maryam; Salahshournia, Behrang; Zafarian, Hamid-Reza; Trzybiński, Damian; Mayer, Peter; Wozniak, Krzysztof Involvement of various anions in tuning the structure of silver(i) coordination polymers based on a S-donor ligand: syntheses, crystal structure and uptake properties CrystEngComm, 2021, 23, 7502-7516
7243518	CIF	C10 H14 Ag2 N6 O6 S2	P 1 21/n 1	12.0332; 6.5856; 22.1176 90; 102.28; 90	1712.63	Soleymani-Babadi, Susan; Beheshti, Azizolla; Bahrani-Pour, Maryam; Salahshournia, Behrang; Zafarian, Hamid-Reza; Trzybiński, Damian; Mayer, Peter; Wozniak, Krzysztof Involvement of various anions in tuning the structure of silver(i) coordination polymers based on a S-donor ligand: syntheses, crystal structure and uptake properties CrystEngComm, 2021, 23, 7502-7516
7243519	CIF	C12 H14 Ag2 F6 N4 O6 S4	P -1	8.7766; 10.4029; 11.8505 86.302; 81.916; 86.791	1067.79	Soleymani-Babadi, Susan; Beheshti, Azizolla; Bahrani-Pour, Maryam; Salahshournia, Behrang; Zafarian, Hamid-Reza; Trzybiński, Damian; Mayer, Peter; Wozniak, Krzysztof Involvement of various anions in tuning the structure of silver(i) coordination polymers based on a S-donor ligand: syntheses, crystal structure and uptake properties CrystEngComm, 2021, 23, 7502-7516
7243520	CIF	C30 H42 Ag3 F18 N12 P3 S6	P 1 21/n 1	16.532; 11.115; 27.2509 90; 99.442; 90	4939.6	Soleymani-Babadi, Susan; Beheshti, Azizolla; Bahrani-Pour, Maryam; Salahshournia, Behrang; Zafarian, Hamid-Reza; Trzybiński, Damian; Mayer, Peter; Wozniak, Krzysztof Involvement of various anions in tuning the structure of silver(i) coordination polymers based on a S-donor ligand: syntheses, crystal structure and uptake properties CrystEngComm, 2021, 23, 7502-7516
7243521	CIF	C32 H8 F42 I2 N4 O	P 1 21/c 1	28.89; 5.5858; 28.523 90; 104.4; 90	4458.3	Saccone, Marco; Pace, Andrea; Pibiri, Ivana; Cavallo, Gabriella; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Terraneo, Giancarlo Dissecting the packing forces in mixed perfluorocarbon/aromatic co-crystals CrystEngComm, 2021, 23, 7324-7333
7243522	CIF	C26 H47 N O2 S	P 1 21/n 1	7.5329; 10.6912; 34.1 90; 95.908; 90	2731.7	Bisz, Elwira; Koston, Martina; Szostak, Michal N-Butylpyrrolidone (NBP) as a non-toxic substitute for NMP in iron-catalyzed C(sp2)‒C(sp3) cross-coupling of aryl chlorides Green Chemistry, 2021
7243523	CIF	C84 H54 N16 O6 S3	R -3 :H	21.023; 21.023; 30.595 90; 90; 120	11710.4	Ripoche, Nicolas; Betou, Marie; Philippe, Clotilde; Trolez, Yann; Mongin, Olivier; Dudek, Marta; Pokladek, Ziemowit; Matczyszyn, Katarzyna; Samoc, Marek; Sahnoune, Hiba; Halet, Jean-François; Roisnel, Thierry; Toupet, Loic; Cordier, Marie; Moxey, Graeme; Humphrey, Mark G.; Paul, Frédéric Two-Photon Absorption Properties of Multipolar Triarylamino/ Tosylamido 1,1,4,4-Tetracyanobutadienes Physical Chemistry Chemical Physics, 2021
7243524	CIF	C34 H15 N9	P 1 2/a 1	10.7358; 9.7979; 13.1395 90; 93.928; 90	1378.87	Ripoche, Nicolas; Betou, Marie; Philippe, Clotilde; Trolez, Yann; Mongin, Olivier; Dudek, Marta; Pokladek, Ziemowit; Matczyszyn, Katarzyna; Samoc, Marek; Sahnoune, Hiba; Halet, Jean-François; Roisnel, Thierry; Toupet, Loic; Cordier, Marie; Moxey, Graeme; Humphrey, Mark G.; Paul, Frédéric Two-Photon Absorption Properties of Multipolar Triarylamino/ Tosylamido 1,1,4,4-Tetracyanobutadienes Physical Chemistry Chemical Physics, 2021
7243525	CIF	C77 H76 N10 O4 S2	P -1	12.2334; 16.0882; 18.7919 107.984; 97.849; 90.566	3479.5	Ripoche, Nicolas; Betou, Marie; Philippe, Clotilde; Trolez, Yann; Mongin, Olivier; Dudek, Marta; Pokladek, Ziemowit; Matczyszyn, Katarzyna; Samoc, Marek; Sahnoune, Hiba; Halet, Jean-François; Roisnel, Thierry; Toupet, Loic; Cordier, Marie; Moxey, Graeme; Humphrey, Mark G.; Paul, Frédéric Two-Photon Absorption Properties of Multipolar Triarylamino/ Tosylamido 1,1,4,4-Tetracyanobutadienes Physical Chemistry Chemical Physics, 2021
7243526	CIF	C20 H16 Br N3 O	P 1 21/c 1	13.4703; 14.2884; 9.0192 90; 97.198; 90	1722.24	Zhao, Mengfei; Qin, Zengxin; Zhang, Kaixin; Li, Jizhen Metal-free site-selective C‒H cyanoalkylation of 8-aminoquinoline and aniline-derived amides with azobisisobutyronitrile RSC Advances, 2021, 11, 30719-30724
7243527	CIF	C17 H33 F6 Mo N4 O3 P	P b c a	17.1434; 14.9459; 18.1606 90; 90; 90	4653.2	Gessner, Niklas; Bäck, Anna Karina; Knorr, Johannes; Nagel, Christoph; Marquetand, Philipp; Schatzschneider, Ulrich; González, Leticia; Nuernberger, Patrick Ultrafast Photochemistry of a Molybdenum Carbonyl-Nitrosyl Complex with a Triazacyclononane Coligand Physical Chemistry Chemical Physics, 2021
7243528	CIF	C18 H18 Cl F2 N3 O4	P 1 21/n 1	10.248; 9.092; 20.307 90; 92.102; 90	1890.8	Glinyanaya, Nataliya V.; Rayenko, Gennady F.; Korotkikh, Nikolai I.; Rusanov, Eduard B.; Ryabitsky, Alexey B.; Shvaika, Oles P. Halogen-containing heteroaromatic carbenes of the 1,2,4-triazole series and their transformations RSC Advances, 2021, 11, 30841-30848
7243529	CIF	C19 H18 Cu F3 I N3	P 1 21/n 1	12.6541; 19.843; 18.004 90; 109.426; 90	4263.4	Glinyanaya, Nataliya V.; Rayenko, Gennady F.; Korotkikh, Nikolai I.; Rusanov, Eduard B.; Ryabitsky, Alexey B.; Shvaika, Oles P. Halogen-containing heteroaromatic carbenes of the 1,2,4-triazole series and their transformations RSC Advances, 2021, 11, 30841-30848
7243530	CIF	C18 H17 Cu F2 I N3	P b c a	10.4747; 16.568; 23.0336 90; 90; 90	3997.36	Glinyanaya, Nataliya V.; Rayenko, Gennady F.; Korotkikh, Nikolai I.; Rusanov, Eduard B.; Ryabitsky, Alexey B.; Shvaika, Oles P. Halogen-containing heteroaromatic carbenes of the 1,2,4-triazole series and their transformations RSC Advances, 2021, 11, 30841-30848
7243531	CIF	C18 H17 F2 N3	P -1	5.4869; 10.1446; 14.6445 101.552; 93.625; 93.431	794.84	Glinyanaya, Nataliya V.; Rayenko, Gennady F.; Korotkikh, Nikolai I.; Rusanov, Eduard B.; Ryabitsky, Alexey B.; Shvaika, Oles P. Halogen-containing heteroaromatic carbenes of the 1,2,4-triazole series and their transformations RSC Advances, 2021, 11, 30841-30848
7243532	CIF	C21 H31 Br N3 O6.5 S	C 1 2/c 1	18.9632; 18.2169; 14.9312 90; 110.55; 90	4829.8	Glinyanaya, Nataliya V.; Rayenko, Gennady F.; Korotkikh, Nikolai I.; Rusanov, Eduard B.; Ryabitsky, Alexey B.; Shvaika, Oles P. Halogen-containing heteroaromatic carbenes of the 1,2,4-triazole series and their transformations RSC Advances, 2021, 11, 30841-30848
7243533	CIF	C29 H16 Ce O8	P -1	12.1829; 14.9798; 15.5382 67.68; 69.005; 67.206	2343.1	Wu, Xiaoling; Li, Zi-Jian; Zhou, He; Li, Lin; Qian, Zhenghua; Qian, Nan; Chu, Xinxin; Liu, Wei A microporous Ce-based MOF with the octahedron cage for highly selective adsorption towards xenon over krypton RSC Advances, 2021, 11, 30918-30924
7243534	CIF	C20 H12 I2 N2	P 1 21/n 1	8.6398; 19.4072; 10.7039 90; 101.237; 90	1760.36	Saidykhan, Amie; Fenwick, Nathan W.; Bowen, Richard D.; Telford, Richard; Seaton, Colin C. Isostructurality of quinoxaline crystal phases: the interplay of weak hydrogen bonds and halogen bonding CrystEngComm, 2021, 23, 7108-7117
7243535	CIF	C20 H12 Cl2 N2	P 1 21/n 1	13.368; 7.5374; 16.175 90; 104.64; 90	1576.9	Saidykhan, Amie; Fenwick, Nathan W.; Bowen, Richard D.; Telford, Richard; Seaton, Colin C. Isostructurality of quinoxaline crystal phases: the interplay of weak hydrogen bonds and halogen bonding CrystEngComm, 2021, 23, 7108-7117
7243536	CIF	C20 H12 F2 N2	P 1 21/n 1	12.7621; 7.6916; 15.439 90; 101.23; 90	1486.5	Saidykhan, Amie; Fenwick, Nathan W.; Bowen, Richard D.; Telford, Richard; Seaton, Colin C. Isostructurality of quinoxaline crystal phases: the interplay of weak hydrogen bonds and halogen bonding CrystEngComm, 2021, 23, 7108-7117
7243537	CIF	C22 H18 N2	P 1 21/n 1	12.313; 7.563; 17.916 90; 102.333; 90	1629.9	Saidykhan, Amie; Fenwick, Nathan W.; Bowen, Richard D.; Telford, Richard; Seaton, Colin C. Isostructurality of quinoxaline crystal phases: the interplay of weak hydrogen bonds and halogen bonding CrystEngComm, 2021, 23, 7108-7117
7243538	CIF	C15 H13 Cd N2 O5 S	P -1	6.2638; 10.7726; 12.388 111.317; 96.567; 105.524	729.15	Fu, Miao-Miao; Liu, Ce; Dong, Gui-Ying Two Cd(ii)-based metal–organic frameworks for the highly effective detection of Fe3+ ions and levofloxacin in aqueous media CrystEngComm, 2021, 23, 7397-7405
7243539	CIF	C15 H10 Cd N O4	P -1	7.5153; 9.8544; 10.3104 62.368; 76.205; 67.714	624.13	Fu, Miao-Miao; Liu, Ce; Dong, Gui-Ying Two Cd(ii)-based metal–organic frameworks for the highly effective detection of Fe3+ ions and levofloxacin in aqueous media CrystEngComm, 2021, 23, 7397-7405
7243540	CIF	C39 H37 N7 O13 Zn2	P 1 21/n 1	9.4083; 13.686; 18.288 90; 99.846; 90	2320.1	Wu, Qi; Yang, Xiao-Li; Ding, Ze-Yu; Meng, Xiao-Yun; Zhang, Wen-Yan; Yan, Yang-Tian; Yang, Guo-Ping; Wang, Yao-Yu A multi-functional two-dimensional Zn(ii)-organic framework for selective carbon dioxide adsorption, sensing of nitrobenzene and Cr2O72− CrystEngComm, 2021, 23, 7643-7649
7243541	CIF	C24 H16 Co N2 O4	P 1 21/c 1	10.3931; 16.027; 14.996 90; 98.243; 90	2472.1	Ndamyabera, Christophe A.; Chatterjee, Nabanita; Oliver, Clive L.; Bourne, Susan A. Robust pyridylbenzoate metal–organic frameworks as sorbents for volatile solvents and gases CrystEngComm, 2021, 23, 7162-7170
7243542	CIF	C24 H16 Co N2 O4	P 1 21/c 1	10.4014; 16.133; 14.6878 90; 98.482; 90	2437.7	Ndamyabera, Christophe A.; Chatterjee, Nabanita; Oliver, Clive L.; Bourne, Susan A. Robust pyridylbenzoate metal–organic frameworks as sorbents for volatile solvents and gases CrystEngComm, 2021, 23, 7162-7170
7243543	CIF	C24 H16 Co I1.6 N2 O4	P 1 21/c 1	10.114; 16.501; 14.7 90; 97.159; 90	2434.2	Ndamyabera, Christophe A.; Chatterjee, Nabanita; Oliver, Clive L.; Bourne, Susan A. Robust pyridylbenzoate metal–organic frameworks as sorbents for volatile solvents and gases CrystEngComm, 2021, 23, 7162-7170
7243544	CIF	C24 H16.5 N2 O4.25 Zn	P 1 21/c 1	10.2197; 16.1263; 14.8826 90; 98.059; 90	2428.5	Ndamyabera, Christophe A.; Chatterjee, Nabanita; Oliver, Clive L.; Bourne, Susan A. Robust pyridylbenzoate metal–organic frameworks as sorbents for volatile solvents and gases CrystEngComm, 2021, 23, 7162-7170
7243545	CIF	C21 H16 Cl N3 O3 S	P -1	8.3414; 10.8615; 11.6407 69.332; 87.543; 76.539	958.77	Kumar, Navaneet; Bhadoria, Deepak; Kumar, Atul Visible-light-promoted three-component cycloaddition reaction: synthesis of 4-functionalized 1,5-disubstituted 1,2,3-triazoles Green Chemistry, 2021, 23, 7987-7995
7243546	CIF	C22 H14 Co N2 O4	R -3 :H	27.0844; 27.0844; 22.219 90; 90; 120	14115.4	Liu, Qing; Zhang, Lin-Yan; Bao, Yu-Mei; Zhang, Na; Zhang, Jian-Yong; Xing, Yuan-Yuan; Deng, Wei; Liu, Zhen-Jiang Structures and catalytic oxidative coupling reaction of four Co-MOFs modified with R-isophthalic acid (RH, OH and COOH) and trigonal ligands CrystEngComm, 2021, 23, 7590-7601
7243547	CIF	C29 H19 Co N3 O5	C 1 2/c 1	25.1587; 12.6586; 16.9319 90; 102.447; 90	5265.6	Liu, Qing; Zhang, Lin-Yan; Bao, Yu-Mei; Zhang, Na; Zhang, Jian-Yong; Xing, Yuan-Yuan; Deng, Wei; Liu, Zhen-Jiang Structures and catalytic oxidative coupling reaction of four Co-MOFs modified with R-isophthalic acid (RH, OH and COOH) and trigonal ligands CrystEngComm, 2021, 23, 7590-7601
7243548	CIF	C60 H40 Co3 N6 O14	P -1	10.1206; 13.677; 15.8965 70.383; 78.221; 83.458	2026.56	Liu, Qing; Zhang, Lin-Yan; Bao, Yu-Mei; Zhang, Na; Zhang, Jian-Yong; Xing, Yuan-Yuan; Deng, Wei; Liu, Zhen-Jiang Structures and catalytic oxidative coupling reaction of four Co-MOFs modified with R-isophthalic acid (RH, OH and COOH) and trigonal ligands CrystEngComm, 2021, 23, 7590-7601
7243549	CIF	C22 H14 Co N2 O5	R -3 :H	27.0648; 27.0648; 22.965 90; 90; 120	14568	Liu, Qing; Zhang, Lin-Yan; Bao, Yu-Mei; Zhang, Na; Zhang, Jian-Yong; Xing, Yuan-Yuan; Deng, Wei; Liu, Zhen-Jiang Structures and catalytic oxidative coupling reaction of four Co-MOFs modified with R-isophthalic acid (RH, OH and COOH) and trigonal ligands CrystEngComm, 2021, 23, 7590-7601
7243550	CIF	C6 H14 Cl4 Cu2 N2	P 1 21/n 1	6.4278; 13.986; 12.7277 90; 91.79; 90	1143.65	Goreshnik, Evgeny Influence of the synthetic conditions on a formation of 1-D, 2-D and 3-D copper–chloride coordination polymers CrystEngComm, 2021, 23, 7171-7178
7243551	CIF	C6 H18 Cl7 Cu7 S3	P 63 m c	13.9585; 13.9585; 6.4715 90; 90; 120	1091.98	Goreshnik, Evgeny Influence of the synthetic conditions on a formation of 1-D, 2-D and 3-D copper–chloride coordination polymers CrystEngComm, 2021, 23, 7171-7178
7243552	CIF	C6 H14 Cl6 Cu2 N2	P 1 2/n 1	6.9394; 8.4624; 12.2504 90; 104.482; 90	696.53	Goreshnik, Evgeny Influence of the synthetic conditions on a formation of 1-D, 2-D and 3-D copper–chloride coordination polymers CrystEngComm, 2021, 23, 7171-7178
7243553	CIF	C6 H14 Cl5 Cu3 N2	P n m a	17.3198; 7.5743; 10.1087 90; 90; 90	1326.11	Goreshnik, Evgeny Influence of the synthetic conditions on a formation of 1-D, 2-D and 3-D copper–chloride coordination polymers CrystEngComm, 2021, 23, 7171-7178
7243554	CIF	C4 H2 K2 N10 O5	P 1 21/c 1	12.1233; 8.2762; 11.5289 90; 99.076; 90	1142.27	Wang, Yu; Ye, Jin; Yang, Na; Ma, Haixia; Zhang, Yazhou; Guo, Zhaoqi Strong intermolecular interaction induced methylene-bridged asymmetric heterocyclic explosives CrystEngComm, 2021, 23, 7635-7642
7243555	CIF	C4 H10 N12 O5	P 1 21/c 1	12.6801; 8.2805; 11.665 90; 97.819; 90	1213.41	Wang, Yu; Ye, Jin; Yang, Na; Ma, Haixia; Zhang, Yazhou; Guo, Zhaoqi Strong intermolecular interaction induced methylene-bridged asymmetric heterocyclic explosives CrystEngComm, 2021, 23, 7635-7642
7243556	CIF	C4 H4 N10 O5	P b c a	9.4839; 9.0436; 22.4984 90; 90; 90	1929.66	Wang, Yu; Ye, Jin; Yang, Na; Ma, Haixia; Zhang, Yazhou; Guo, Zhaoqi Strong intermolecular interaction induced methylene-bridged asymmetric heterocyclic explosives CrystEngComm, 2021, 23, 7635-7642
7243557	CIF	C6 H14 Cl4 Cu2 N2	P 1 21/n 1	6.4278; 13.986; 12.7277 90; 91.79; 90	1143.65	Sun, Tingting; Lin, Shuang-Yan; Xu, Zhikun; Li, L. In-situ growth of Fe doped NiCo-MOF electrocatalyst from layered double hydroxide effectively enhances electrocatalytic oxygen evolution performance CrystEngComm, 2021
7243558	CIF	C6 H18 Cl7 Cu7 S3	P 63 m c	13.9585; 13.9585; 6.4715 90; 90; 120	1091.98	Sun, Tingting; Lin, Shuang-Yan; Xu, Zhikun; Li, L. In-situ growth of Fe doped NiCo-MOF electrocatalyst from layered double hydroxide effectively enhances electrocatalytic oxygen evolution performance CrystEngComm, 2021
7243559	CIF	C6 H14 Cl6 Cu2 N2	P 1 2/n 1	6.9394; 8.4624; 12.2504 90; 104.482; 90	696.53	Sun, Tingting; Lin, Shuang-Yan; Xu, Zhikun; Li, L. In-situ growth of Fe doped NiCo-MOF electrocatalyst from layered double hydroxide effectively enhances electrocatalytic oxygen evolution performance CrystEngComm, 2021
7243560	CIF	C6 H14 Cl5 Cu3 N2	P n m a	17.3198; 7.5743; 10.1087 90; 90; 90	1326.11	Sun, Tingting; Lin, Shuang-Yan; Xu, Zhikun; Li, L. In-situ growth of Fe doped NiCo-MOF electrocatalyst from layered double hydroxide effectively enhances electrocatalytic oxygen evolution performance CrystEngComm, 2021
7243561	CIF	B12 H12 Na O27 Rb5	R 3 2 :H	11.1487; 11.1487; 20.6785 90; 90; 120	2225.9	Qiu, Qi-Ming; Sun, Ke-Ning; Yang, Guo-Yu Five new rubidium borates with 0D clusters, 1D chains, 2D layers and 3D frameworks CrystEngComm, 2021, 23, 7081-7089
7243562	CIF	B12 H4 O22 Rb4	P 1 21/c 1	9.154; 6.6585; 18.6325 90; 117.594; 90	1006.5	Qiu, Qi-Ming; Sun, Ke-Ning; Yang, Guo-Yu Five new rubidium borates with 0D clusters, 1D chains, 2D layers and 3D frameworks CrystEngComm, 2021, 23, 7081-7089
7243563	CIF	B12 Ba H4 O22 Rb2	P 1 21/c 1	9.058; 6.62; 18.294 90; 117.603; 90	972.1	Qiu, Qi-Ming; Sun, Ke-Ning; Yang, Guo-Yu Five new rubidium borates with 0D clusters, 1D chains, 2D layers and 3D frameworks CrystEngComm, 2021, 23, 7081-7089
7243564	CIF	B5 H O9 Rb2	P c a 21	8.5942; 7.6284; 13.1321 90; 90; 90	860.94	Qiu, Qi-Ming; Sun, Ke-Ning; Yang, Guo-Yu Five new rubidium borates with 0D clusters, 1D chains, 2D layers and 3D frameworks CrystEngComm, 2021, 23, 7081-7089
7243565	CIF	B12 H3 Na2 O21 Rb	P a -3	12.3596; 12.3596; 12.3596 90; 90; 90	1888	Qiu, Qi-Ming; Sun, Ke-Ning; Yang, Guo-Yu Five new rubidium borates with 0D clusters, 1D chains, 2D layers and 3D frameworks CrystEngComm, 2021, 23, 7081-7089
7243566	CIF	C37 H32 Cl2 O	P -1	9.76; 10.85; 15.146 98.37; 96.251; 103.375	1526.8	Barton, Benita; Barnardo, Brandon; Hosten, Eric C. Selectivity behaviour of two roof-shaped host compounds in the presence of xylene and ethylbenzene guest mixtures CrystEngComm, 2021, 23, 7278-7288
7243567	CIF	C37 H32 Cl2 O	P -1	9.83; 10.658; 15.343 96.197; 96.104; 105.604	1523.7	Barton, Benita; Barnardo, Brandon; Hosten, Eric C. Selectivity behaviour of two roof-shaped host compounds in the presence of xylene and ethylbenzene guest mixtures CrystEngComm, 2021, 23, 7278-7288
7243568	CIF	C37 H32 Cl2 O	P -1	10.3172; 12.742; 13.082 67.795; 71.424; 72.877	1479.3	Barton, Benita; Barnardo, Brandon; Hosten, Eric C. Selectivity behaviour of two roof-shaped host compounds in the presence of xylene and ethylbenzene guest mixtures CrystEngComm, 2021, 23, 7278-7288
7243569	CIF	C37 H32 Cl2 O	P -1	9.8151; 10.9036; 14.5415 94.486; 97.7538; 104.653	1481.57	Barton, Benita; Barnardo, Brandon; Hosten, Eric C. Selectivity behaviour of two roof-shaped host compounds in the presence of xylene and ethylbenzene guest mixtures CrystEngComm, 2021, 23, 7278-7288
7243570	CIF	C19 H20 O6	P n a 21	21.521; 11.299; 6.774 90; 90; 90	1647.2	Wang, Tingshu; Zhang, Miao; Zheng, Yifan; Seong, Junmo; Lah, Myoung Soo; Koo, Sangho Furan oxidation by Mn(iii)/Co(ii) catalysts ‒ application to benzofuran synthesis RSC Advances, 2021, 11, 31395-31399
7243571	CIF	C115 H110 O30	P 1 21 1	7.6292; 18.955; 27.164 90; 91.56; 90	3926.8	Wang, Tingshu; Zhang, Miao; Zheng, Yifan; Seong, Junmo; Lah, Myoung Soo; Koo, Sangho Furan oxidation by Mn(iii)/Co(ii) catalysts ‒ application to benzofuran synthesis RSC Advances, 2021, 11, 31395-31399
7243572	CIF	C19 H19 N O8	P 1 21/n 1	7.9677; 8.9993; 24.879 90; 98.37; 90	1764.9	Wang, Tingshu; Zhang, Miao; Zheng, Yifan; Seong, Junmo; Lah, Myoung Soo; Koo, Sangho Furan oxidation by Mn(iii)/Co(ii) catalysts ‒ application to benzofuran synthesis RSC Advances, 2021, 11, 31395-31399
7243573	CIF	C14 H20 O2	P 21 21 21	5.0851; 13.6181; 18.784 90; 90; 90	1300.8	Gamidi, Rama Krishna; Dandawate, Monica; Choudhury, Rahul; Tothadi, Srinu; Nangia, Ashwini; Reddy, D. Srinivasa Separation of a diastereomeric diol pair using mechanical properties of crystals CrystEngComm, 2021
7243574	CIF	C14 H20 O2	P 1 21 1	12.4314; 5.0981; 20.634 90; 106.37; 90	1254.7	Gamidi, Rama Krishna; Dandawate, Monica; Choudhury, Rahul; Tothadi, Srinu; Nangia, Ashwini; Reddy, D. Srinivasa Separation of a diastereomeric diol pair using mechanical properties of crystals CrystEngComm, 2021
7243575	CIF	Ca10.42 Gd0.58 Sb9.69	I 4/m m m	11.9737; 11.9737; 17.3326 90; 90; 90	2485	Sa, Hayeon; Lee, Junsu; Hong, Yeongjin; Han, Mi-Kyung; Jo, Hongil; Moon, Dohyun; Ok, Kang Min; Kim, Sung-Jin; You, Tae-Soo Early stage of the single-crystal growth and tipping point of the cationic site preference in Gd-doped Zintl phase thermoelectric materials CrystEngComm, 2021, 23, 7097-7107
7243576	CIF	Ca10.63 Gd0.37 Sb9.74	I 4/m m m	11.9875; 11.9875; 17.36 90; 90; 90	2494.6	Sa, Hayeon; Lee, Junsu; Hong, Yeongjin; Han, Mi-Kyung; Jo, Hongil; Moon, Dohyun; Ok, Kang Min; Kim, Sung-Jin; You, Tae-Soo Early stage of the single-crystal growth and tipping point of the cationic site preference in Gd-doped Zintl phase thermoelectric materials CrystEngComm, 2021, 23, 7097-7107
7243577	CIF	Ca10.64 Gd0.36 Sb9.63	I 4/m m m	11.985; 11.985; 17.2845 90; 90; 90	2482.7	Sa, Hayeon; Lee, Junsu; Hong, Yeongjin; Han, Mi-Kyung; Jo, Hongil; Moon, Dohyun; Ok, Kang Min; Kim, Sung-Jin; You, Tae-Soo Early stage of the single-crystal growth and tipping point of the cationic site preference in Gd-doped Zintl phase thermoelectric materials CrystEngComm, 2021, 23, 7097-7107
7243578	CIF	C31 H38 N O7.5 S2	I 1 2 1	21.8237; 6.3425; 23.2717 90; 112.529; 90	2975.4	Chen, Yifu; Jing, Bo; Chang, Zewei; Gong, Junbo Desolvation induced crystal jumping: reversible hydration and dehydration of a spironolactone–saccharin cocrystal with water as the jumping-mate CrystEngComm, 2021, 23, 6838-6842
7243579	CIF	C31 H38 N O7.5 S2	C 1 2 1	25.2663; 6.3994; 22.1324 90; 120.785; 90	3074.33	Chen, Yifu; Jing, Bo; Chang, Zewei; Gong, Junbo Desolvation induced crystal jumping: reversible hydration and dehydration of a spironolactone–saccharin cocrystal with water as the jumping-mate CrystEngComm, 2021, 23, 6838-6842
7243580	CIF	C31 H37.25 N O7.12 S2	C 1 2 1	25.321; 6.4135; 22.097 90; 121.404; 90	3062.8	Chen, Yifu; Jing, Bo; Chang, Zewei; Gong, Junbo Desolvation induced crystal jumping: reversible hydration and dehydration of a spironolactone–saccharin cocrystal with water as the jumping-mate CrystEngComm, 2021, 23, 6838-6842
7243581	CIF	C31 H37 N O7 S2	C 1 2 1	25.208; 6.3747; 21.98 90; 121.001; 90	3027.5	Chen, Yifu; Jing, Bo; Chang, Zewei; Gong, Junbo Desolvation induced crystal jumping: reversible hydration and dehydration of a spironolactone–saccharin cocrystal with water as the jumping-mate CrystEngComm, 2021, 23, 6838-6842
7243582	CIF	C31 H37.5 N O7.25 S2	C 1 2 1	25.2658; 6.3976; 22.0858 90; 121.138; 90	3055.6	Chen, Yifu; Jing, Bo; Chang, Zewei; Gong, Junbo Desolvation induced crystal jumping: reversible hydration and dehydration of a spironolactone–saccharin cocrystal with water as the jumping-mate CrystEngComm, 2021, 23, 6838-6842
7243583	CIF	C27 H20 Co N4 O6	C 1 2/c 1	17.714; 17.989; 15.344 90; 105.098; 90	4721	Liu, Ya; Ren, Li; Cui, Guang-Hua Two Co(ii)-based coordination polymers as multi-responsive luminescent sensors for the detection of levofloxacin, benzaldehyde and Fe3+ ions in water media CrystEngComm, 2021, 23, 7485-7495
7243584	CIF	C28.5 H21 Co N3 O5	C 1 2/c 1	12.6009; 30.1566; 13.5693 90; 107.237; 90	4924.8	Liu, Ya; Ren, Li; Cui, Guang-Hua Two Co(ii)-based coordination polymers as multi-responsive luminescent sensors for the detection of levofloxacin, benzaldehyde and Fe3+ ions in water media CrystEngComm, 2021, 23, 7485-7495
7243585	CIF	C64 H32 N16 Nd	P 4/n n c :2	19.937; 19.937; 6.4202 90; 90; 90	2551.9	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243586	CIF	C64 H32 N16 Tb	C 1 2/c 1	28.086; 14.16; 13.1416 90; 115.708; 90	4709.1	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243587	CIF	C65 H34 Cl2 N16 Sm	P n m a	28.1354; 22.945; 7.8933 90; 90; 90	5095.7	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243588	CIF	C64 H32 La N16	P 4/n n c :2	19.9227; 19.9227; 6.3925 90; 90; 90	2537.27	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243589	CIF	C64 H32 Gd N16	P 21 21 21	8.8412; 10.5892; 50.762 90; 90; 90	4752.4	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243590	CIF	C65 H34 Cl2 N16 Nd	P n m a	28.0851; 22.9636; 7.8897 90; 90; 90	5088.3	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243591	CIF	C65 H34 Cl2 Gd N16	P n m a	28.356; 22.882; 8.046 90; 90; 90	5220.6	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243592	CIF	C64 H32 Dy N16	P 21 21 21	8.8171; 10.5671; 50.648 90; 90; 90	4718.9	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243593	CIF	C65 H34 Cl2 Dy N16	P n m a	28.01; 22.923; 7.8994 90; 90; 90	5072	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243594	CIF	C65 H34 Cl2 N16 Yb	P n m a	27.955; 22.921; 7.8802 90; 90; 90	5049.3	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243595	CIF	C64 H32 N16 Tb	P 21 21 21	8.8136; 10.5756; 50.713 90; 90; 90	4726.9	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243596	CIF	C64 H32 N16 Yb	P 21 21 21	8.7901; 10.5965; 50.568 90; 90; 90	4710.1	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243597	CIF	C64 H32 Dy N16	P 4/n n c :2	19.548; 19.548; 6.477 90; 90; 90	2475	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243598	CIF	C65 H34 Cl2 La N16	P n m a	28.0409; 22.944; 7.8783 90; 90; 90	5068.7	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243599	CIF	C64 H32 N16 Nd	C 1 2/c 1	28.103; 14.1751; 13.1851 90; 115.596; 90	4737	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243600	CIF	C64 H32 N16 Sm	C 1 2/c 1	28.1112; 14.2031; 13.1654 90; 115.574; 90	4741.5	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243601	CIF	C65 H34 Cl2 Er N16	P n m a	28.016; 22.942; 7.8678 90; 90; 90	5057	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243602	CIF	C64 H32 N16 Pr	C 1 2/c 1	28.106; 14.1593; 13.1975 90; 115.551; 90	4738.4	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243603	CIF	C64 H32 N16 Sm	P 21 21 21	8.8201; 10.6092; 50.7567 90; 90; 90	4749.5	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243604	CIF	C64 H32 Gd N16	C 1 2/c 1	28.125; 14.1663; 13.1416 90; 115.688; 90	4718.5	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243605	CIF	C65 H34 Cl2 N16 Tb	P n m a	28.0516; 22.9642; 7.8827 90; 90; 90	5077.9	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243606	CIF	C64 H32 N16 Nd	P 21 21 21	8.852; 10.604; 50.844 90; 90; 90	4772.6	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243607	CIF	C65 H34 Cl2 N16 Pr	P n m a	28.1128; 22.9663; 7.8883 90; 90; 90	5093.1	Dailey, Maegan; Besson, Claire Selective crystallization of four bis(phthalocyaninato)lanthanoid(iii) polymorphs CrystEngComm, 2021, 23, 7151-7161
7243608	CIF	C13 H11 Cl2 N3 O4	P 1 21/n 1	3.8492; 25.618; 15.127 90; 96.92; 90	1480.8	Fang, Lan; Xiao, Yuntian; Zhang, Chengtian; Gao, Zhenguo; Wu, Songgu; Gong, Junbo; Rohani, Sohrab Intermolecular interactions and solubility behavior of multicomponent crystal forms of 2,4-D: design, structure analysis, and solid-state characterization CrystEngComm, 2021, 23, 7615-7627
7243609	CIF	C13 H12 Cl2 N2 O3	P 1 21/n 1	11.1527; 5.1499; 24.1986 90; 94.245; 90	1386.04	Fang, Lan; Xiao, Yuntian; Zhang, Chengtian; Gao, Zhenguo; Wu, Songgu; Gong, Junbo; Rohani, Sohrab Intermolecular interactions and solubility behavior of multicomponent crystal forms of 2,4-D: design, structure analysis, and solid-state characterization CrystEngComm, 2021, 23, 7615-7627
7243610	CIF	C11 H10 Cl2 N2 O3	P 1 21/c 1	4.9189; 12.7069; 19.7761 90; 90.777; 90	1235.97	Fang, Lan; Xiao, Yuntian; Zhang, Chengtian; Gao, Zhenguo; Wu, Songgu; Gong, Junbo; Rohani, Sohrab Intermolecular interactions and solubility behavior of multicomponent crystal forms of 2,4-D: design, structure analysis, and solid-state characterization CrystEngComm, 2021, 23, 7615-7627
7243611	CIF	C13 H12 Cl2 N2 O3	P 1 21/n 1	10.5164; 5.3915; 24.4188 90; 90.966; 90	1384.33	Fang, Lan; Xiao, Yuntian; Zhang, Chengtian; Gao, Zhenguo; Wu, Songgu; Gong, Junbo; Rohani, Sohrab Intermolecular interactions and solubility behavior of multicomponent crystal forms of 2,4-D: design, structure analysis, and solid-state characterization CrystEngComm, 2021, 23, 7615-7627
7243612	CIF	C14 H12 Cl2 N2 O4	P -1	3.9581; 10.518; 17.6996 79.048; 84.886; 85.843	719.39	Fang, Lan; Xiao, Yuntian; Zhang, Chengtian; Gao, Zhenguo; Wu, Songgu; Gong, Junbo; Rohani, Sohrab Intermolecular interactions and solubility behavior of multicomponent crystal forms of 2,4-D: design, structure analysis, and solid-state characterization CrystEngComm, 2021, 23, 7615-7627
7243613	CIF	C19 H17 F8 N5 O3	C 1 2 1	11.1446; 6.5924; 29.135 90; 93.968; 90	2135.4	Ning, Yongquan; Wang, Hongwei; Sivaguru, Paramasivam; Li, Shuang; Zanoni, Giuseppe; Nolan, Steven P.; Bi, Xihe Defluorinative [4 + 1] annulation of perfluoroalkyl N-mesylhydrazones with primary amines provides 5-fluoroalkyl 1,2,3-triazoles Green Chemistry, 2021, 23, 7976-7981
7243614	CIF	C30 H19 P S6 Se	P -1	8.8726; 12.5498; 25.9772 92.616; 97.874; 100.725	2807.7	Yang, Zi; Zhang, Zhikai; Xue, CeCe; Yang, Kai; Gao, Rong; Yu, Na; Ren, Yi Excited-State Engineering of Oligothiophenes via Phosphorus Chemistry towards Strong Fluorescent Materials Physical Chemistry Chemical Physics, 2021
7243615	CIF	C16 H21 N2 O6 Zn	P n m a	18.3597; 30.8839; 11.3262 90; 90; 90	6422.2	Chen, Mao-Long; Qi, Zhen-Li; Jin, Wan-Ting; Xu, Zhou; Cheng, Yun-Hui; Zhou, Zhao-Hui Cation exchange in a fluorescent zinc-based metal–organic framework for cadmium ion detection CrystEngComm, 2021, 23, 7442-7449
7243616	CIF	C7 H6 In N O8 P	P -1	6.6218; 9.3168; 9.4721 114.317; 95.498; 105.293	499.59	Huang, Lijuan; Xu, Haiping; Zhao, Yan; Huang, Ling; Bi, Jian; Zeng, Hongmei; Zou, Guohong; Gao, Daojiang; Lin, Zhien Isonicotinic acid-templated metal phosphate–oxalates: solvent-free synthesis, luminescence, and proton conduction CrystEngComm, 2021, 23, 6855-6858
7243617	CIF	C8 H9 Ga N O11 P	C 1 2/c 1	7.8667; 16.1141; 21.1102 90; 90.836; 90	2675.7	Huang, Lijuan; Xu, Haiping; Zhao, Yan; Huang, Ling; Bi, Jian; Zeng, Hongmei; Zou, Guohong; Gao, Daojiang; Lin, Zhien Isonicotinic acid-templated metal phosphate–oxalates: solvent-free synthesis, luminescence, and proton conduction CrystEngComm, 2021, 23, 6855-6858
7243618	CIF	C19 H11 F2 N	C 1 c 1	3.8635; 26.708; 12.5375 90; 90.609; 90	1293.63	Xiang, Shiqun; Fan, Weibin; Zhang, Wei; Li, Yinghua; Guo, Shiwei; Huang, Deguang Aqueous CO2 fixation: construction of pyridine skeletons in cooperation with ammonium cations Green Chemistry, 2021, 23, 7950-7955
7243619	CIF	C23 H21 N	P b c n	11.0913; 16.1163; 9.1839 90; 90; 90	1641.6	Xiang, Shiqun; Fan, Weibin; Zhang, Wei; Li, Yinghua; Guo, Shiwei; Huang, Deguang Aqueous CO2 fixation: construction of pyridine skeletons in cooperation with ammonium cations Green Chemistry, 2021, 23, 7950-7955
7243620	CIF	C19 H11 Cl2 N	P -1	7.1916; 8.2658; 13.5299 87.021; 75.797; 68.795	726.3	Xiang, Shiqun; Fan, Weibin; Zhang, Wei; Li, Yinghua; Guo, Shiwei; Huang, Deguang Aqueous CO2 fixation: construction of pyridine skeletons in cooperation with ammonium cations Green Chemistry, 2021, 23, 7950-7955
7243621	CIF	C21 H17 N O2	P 1 21/c 1	12.6441; 17.5664; 15.456 90; 114.037; 90	3135.26	Xiang, Shiqun; Fan, Weibin; Zhang, Wei; Li, Yinghua; Guo, Shiwei; Huang, Deguang Aqueous CO2 fixation: construction of pyridine skeletons in cooperation with ammonium cations Green Chemistry, 2021, 23, 7950-7955
7243622	CIF	C172 H352 N24 O117 Pt4 S4	I -4 3 d	39.9546; 39.9546; 39.9546 90; 90; 90	63782.3	Aoki, Kentaro; Otsubo, Kazuya; Kitagawa, Hiroshi A square-shaped complex with an electron-acceptor ligand: unique cubic crystal symmetry and similarity to the inorganic mineral katoite CrystEngComm, 2021, 23, 7691-7697
7243623	CIF	C28 H30 Eu N2 O19.5	P n n a	27.0123; 21.1322; 11.5913 90; 90; 90	6616.7	Wang, Cui-Li; Zheng, Ya-Xin; Chen, Le; Zhu, Cai-Yong; Gao, Wei; Li, Peng; Jie-Ping, Liu; Zhang, Xiu-Mei The construction of a multifunctional luminescent Eu-MOF for the sensing of Fe3+, Cr2O72− and amines in aqueous solution CrystEngComm, 2021, 23, 7581-7589
7243624	CIF	C57 H120 N15 O6 V3	P 1 21/n 1	8.24; 34.3199; 12.7556 90; 93.197; 90	3601.62	Kikukawa, Yuji; Kawabata, Hiroko; Hayashi, Yoshihito Synthesis of cyanooxovanadate and cyanosilylation of ketones RSC Advances, 2021, 11, 31688-31692
7243625	CIF	C31 H32 Cd N4 O7	P -1	10.4592; 11.9988; 12.1578 95.789; 97.053; 91.219	1505.63	Chi, Jie; Mu, Yajun; Li, Yan; Shao, Pengpeng; Liu, Guocheng; Cai, Bin; Xu, Na; Chen, Yongqiang Polytorsional-amide/carboxylates-directed Cd(ii) coordination polymers exhibiting multi-functional sensing behaviors RSC Advances, 2021, 11, 31756-31765
7243626	CIF	C31.03 H30.55 Cd Cl0.24 N4 O5.52	P -1	9.3563; 9.873; 17.234 77.943; 75.068; 71.533	1444.9	Chi, Jie; Mu, Yajun; Li, Yan; Shao, Pengpeng; Liu, Guocheng; Cai, Bin; Xu, Na; Chen, Yongqiang Polytorsional-amide/carboxylates-directed Cd(ii) coordination polymers exhibiting multi-functional sensing behaviors RSC Advances, 2021, 11, 31756-31765
7243627	CIF	C30 H30 Cd N4 O7	P -1	8.9887; 10.5199; 17.3822 79.35; 76.852; 67.523	1470.22	Chi, Jie; Mu, Yajun; Li, Yan; Shao, Pengpeng; Liu, Guocheng; Cai, Bin; Xu, Na; Chen, Yongqiang Polytorsional-amide/carboxylates-directed Cd(ii) coordination polymers exhibiting multi-functional sensing behaviors RSC Advances, 2021, 11, 31756-31765
7243628	CIF	C18 H22 N O10.5	P -1	11.287; 11.583; 15.893 74.88; 86.45; 66.47	1837	Le , Anh T.; Tran, Thanh Van Thi; Le, Duan T.; Gomila, Rosa Maria; Frontera, Antonio; Zubkov, Fedor Ivanovich Synthesis, X-ray characterization and theoretical study of all-cis 1,4:2,3:5,8:6,7-tetraepoxynaphthalenes: on the importance of through-space α-effect CrystEngComm, 2021
7243629	CIF	C16 H16 O9	P 1 21/n 1	9.4396; 11.62; 13.907 90; 91.59; 90	1524.8	Le , Anh T.; Tran, Thanh Van Thi; Le, Duan T.; Gomila, Rosa Maria; Frontera, Antonio; Zubkov, Fedor Ivanovich Synthesis, X-ray characterization and theoretical study of all-cis 1,4:2,3:5,8:6,7-tetraepoxynaphthalenes: on the importance of through-space α-effect CrystEngComm, 2021
7243630	CIF	C16 H16 O10 S	P 1 21/c 1	8.4936; 16.17; 11.847 90; 109.38; 90	1534.9	Le , Anh T.; Tran, Thanh Van Thi; Le, Duan T.; Gomila, Rosa Maria; Frontera, Antonio; Zubkov, Fedor Ivanovich Synthesis, X-ray characterization and theoretical study of all-cis 1,4:2,3:5,8:6,7-tetraepoxynaphthalenes: on the importance of through-space α-effect CrystEngComm, 2021
7243631	CIF	C55 H50 Br4 Cl6 N4 O4	P -1	10.6218; 11.3383; 12.3181 68.588; 88.724; 85.755	1377.31	Tominaga, Masahide; Shinkawa, Shoyo; Hyodo, Tadashi; Yamaguchi, Kentaro Dynamic behavior of macrocycle-based organic frameworks in single-crystal to single-crystal guest exchanges CrystEngComm, 2021, 23, 7039-7043
7243632	CIF	C60 H64 Br4 N4 O6	P -1	7.803; 11.554; 15.741 72.604; 89.478; 83.484	1345	Tominaga, Masahide; Shinkawa, Shoyo; Hyodo, Tadashi; Yamaguchi, Kentaro Dynamic behavior of macrocycle-based organic frameworks in single-crystal to single-crystal guest exchanges CrystEngComm, 2021, 23, 7039-7043
7243633	CIF	C68 H76 Br4 N4 O12	P -1	11.3807; 11.6442; 13.1925 83.978; 66.041; 86.807	1588.64	Tominaga, Masahide; Shinkawa, Shoyo; Hyodo, Tadashi; Yamaguchi, Kentaro Dynamic behavior of macrocycle-based organic frameworks in single-crystal to single-crystal guest exchanges CrystEngComm, 2021, 23, 7039-7043
7243634	CIF	C55 H51 Br4 Cl N4 O4	P -1	6.588; 14.1875; 15.2526 64.022; 82.732; 85.997	1271.11	Tominaga, Masahide; Shinkawa, Shoyo; Hyodo, Tadashi; Yamaguchi, Kentaro Dynamic behavior of macrocycle-based organic frameworks in single-crystal to single-crystal guest exchanges CrystEngComm, 2021, 23, 7039-7043
7243635	CIF	C56 H54 Br4 N4 O5	P -1	6.5928; 14.239; 15.231 63.995; 82.597; 85.988	1274.2	Tominaga, Masahide; Shinkawa, Shoyo; Hyodo, Tadashi; Yamaguchi, Kentaro Dynamic behavior of macrocycle-based organic frameworks in single-crystal to single-crystal guest exchanges CrystEngComm, 2021, 23, 7039-7043
7243636	CIF	C360 H312 Cu15 I19 N24 O48 S24	P 63/m	32.1757; 32.1757; 13.5257 90; 90; 120	12126.8	Hu, Chu-Xing; Xuan, Ya-Hui; Jiang, Zi-Hao; Lu, Tao; Yang, Jie; Yuan, Hui; Tian, You-Ping; Sun, Zheng-Guang; Jiang, Xuan-Feng Self-assembly of cuprous iodide cluster-based calix[4]resorcinarenes and photocatalytic properties CrystEngComm, 2021, 23, 7179-7185
7243637	CIF	C124 H110 Cu8 I8 N10 O16 S8	P 1 21/n 1	21.5046; 16.0447; 23.0476 90; 115.557; 90	7174.2	Hu, Chu-Xing; Xuan, Ya-Hui; Jiang, Zi-Hao; Lu, Tao; Yang, Jie; Yuan, Hui; Tian, You-Ping; Sun, Zheng-Guang; Jiang, Xuan-Feng Self-assembly of cuprous iodide cluster-based calix[4]resorcinarenes and photocatalytic properties CrystEngComm, 2021, 23, 7179-7185
7243638	CIF	C15 H15 Cu Fe N2 S2	P 1 21/c 1	18.1803; 9.4604; 9.0591 90; 99.762; 90	1535.54	Singh, Ayushi; Trivedi, Manoj; Kociok-Köhn, Gabriele; Singh, Ashish Kumar; Muddassir, Mohd.; Kumar, Abhinav Ferrocenyl thiazolidine-2-thione ornamented 1D coordination polymers derived from coinage metal halides and pseudohalides CrystEngComm, 2021, 23, 7794-7804
7243639	CIF	C15 H15 Ag Fe N2 S2	P 1 21/c 1	18.0463; 9.80453; 9.3793 90; 100.689; 90	1630.74	Singh, Ayushi; Trivedi, Manoj; Kociok-Köhn, Gabriele; Singh, Ashish Kumar; Muddassir, Mohd.; Kumar, Abhinav Ferrocenyl thiazolidine-2-thione ornamented 1D coordination polymers derived from coinage metal halides and pseudohalides CrystEngComm, 2021, 23, 7794-7804
7243640	CIF	C29 H31 Cl3 Cu2 Fe2 I2 N2 S4	P -1	5.9876; 17.204; 17.2608 89.062; 84.677; 87.989	1769.13	Singh, Ayushi; Trivedi, Manoj; Kociok-Köhn, Gabriele; Singh, Ashish Kumar; Muddassir, Mohd.; Kumar, Abhinav Ferrocenyl thiazolidine-2-thione ornamented 1D coordination polymers derived from coinage metal halides and pseudohalides CrystEngComm, 2021, 23, 7794-7804
7243641	CIF	C8 H41 Cu2 Mo7 N7 O31.5 V	P 1 21/n 1	9.8374; 13.8773; 14.1652 90; 93.26; 90	1930.65	Buvailo, Halyna I.; Makhankova, Valeriya G.; Kokozay, Vladimir N.; Omelchenko, Iryna V.; Shishkina, Svitlana V.; Bieńko, Alina; Pavliuk, Mariia V.; Shylin, Sergii I. Hybrid compound based on diethylenetriaminecopper(ii) cations and scarce V-monosubstituted β-octamolybdate as water oxidation catalyst RSC Advances, 2021, 11, 32119-32125
7243642	CIF	C19 H18 N2 O3 S	P -1	7.7587; 18.0168; 19.756 104.844; 98.14; 92.385	2633.8	Luo, Xiai; Zhao, Yu; Tao, Susu; Yang, Zhong-Tao; Luo, Hui; Yang, Weiguang A simple and efficient copper-catalyzed three-component reaction to synthesize (Z)-1,2-dihydro-2-iminoquinolines RSC Advances, 2021, 11, 31152-31158
7243643	CIF	C20 H23 N2 O4 S	C 1 2/c 1	33.074; 7.648; 16.25 90; 111.766; 90	3817	Luo, Xiai; Zhao, Yu; Tao, Susu; Yang, Zhong-Tao; Luo, Hui; Yang, Weiguang A simple and efficient copper-catalyzed three-component reaction to synthesize (Z)-1,2-dihydro-2-iminoquinolines RSC Advances, 2021, 11, 31152-31158
7243644	CIF	C19 H18 N2 O3 S	P 1 21/c 1	10.929; 10.763; 15.62 90; 109.953; 90	1727	Luo, Xiai; Zhao, Yu; Tao, Susu; Yang, Zhong-Tao; Luo, Hui; Yang, Weiguang A simple and efficient copper-catalyzed three-component reaction to synthesize (Z)-1,2-dihydro-2-iminoquinolines RSC Advances, 2021, 11, 31152-31158
7243645	CIF	C12 H21 Cl2 Fe N2 P	P 1 21/c 1	12.3959; 23.352; 11.4368 90; 95.28; 90	3296.6	Blahut, Jan; Benda, Ladislav; Lejeune, Arthur L.; Sanders, Kevin J.; Burcher, Benjamin; Jeanneau, Erwann; Proriol, David; Catita, Leonor; Breuil, Pierre-Alain R.; Quoineaud, Anne-Agathe; Pell, Andrew J.; Pintacuda, Guido Proton-detected fast-magic-angle spinning NMR of paramagnetic inorganic solids RSC Advances, 2021, 11, 29870-29876
7243646	CIF	C25 H33 Cl2 K N6 O3 Pt	P -1	7.4967; 10.2891; 20.1177 79.821; 87.171; 74.152	1469.28	Shigeta, Yasuhiro; Nanko, Ryota; Amemori, Shogo; Mizuno, Motohiro Coordination-based vapochromic behavior of a luminescent Pt(ii) complex with potassium ions RSC Advances, 2021, 11, 30046-30053
7243647	CIF	C15.25 H11.25 Cl2 K N3.75 O0.75 Pt	C 1 c 1	41.7895; 8.5044; 21.2104 90; 107.837; 90	7175.7	Shigeta, Yasuhiro; Nanko, Ryota; Amemori, Shogo; Mizuno, Motohiro Coordination-based vapochromic behavior of a luminescent Pt(ii) complex with potassium ions RSC Advances, 2021, 11, 30046-30053
7243648	CIF	C18 H12 Cl2 N2 O	P 1 21/c 1	14.8126; 11.5893; 18.701 90; 91.746; 90	3208.9	Orecchia, Patrizio; Petkova, Desislava Slavcheva; Goetz, Roland; Rominger, Frank; Hashmi, A. Stephen K.; Schaub, Thomas Pd-Catalysed Suzuki‒Miyaura cross-coupling of aryl chlorides at low catalyst loadings in water for the synthesis of industrially important fungicides Green Chemistry, 2021
7243649	CIF	C18 H12 F5 N3 O	P b c a	12.8826; 9.2515; 28.4963 90; 90; 90	3396.3	Orecchia, Patrizio; Petkova, Desislava Slavcheva; Goetz, Roland; Rominger, Frank; Hashmi, A. Stephen K.; Schaub, Thomas Pd-Catalysed Suzuki‒Miyaura cross-coupling of aryl chlorides at low catalyst loadings in water for the synthesis of industrially important fungicides Green Chemistry, 2021
7243650	CIF	C18 H12 Cl2 F3 N3 O	P 1 21/c 1	11.8929; 18.0476; 8.6239 90; 110.092; 90	1738.37	Orecchia, Patrizio; Petkova, Desislava Slavcheva; Goetz, Roland; Rominger, Frank; Hashmi, A. Stephen K.; Schaub, Thomas Pd-Catalysed Suzuki‒Miyaura cross-coupling of aryl chlorides at low catalyst loadings in water for the synthesis of industrially important fungicides Green Chemistry, 2021
7243651	CIF	C21 H23 N3	P 1 21/n 1	15.4459; 7.45856; 16.2431 90; 118.081; 90	1650.99	Wang, Lin-Xuan; Qiu, Bin; An, Xiao-De; Dong, Pei-Zhen; Liu, Rui-Bin; Xiao, Jian Organocatalytic cascade aldimine condensation/[1,6]-hydride transfer/Mannich-type cyclization: sustainable access to indole-2,3-fused diazocanes Green Chemistry, 2021, 23, 8181-8186
7243652	CIF	Fe2.667 O8 W1.333	P b c n	4.57964; 5.58662; 4.9692 90; 90; 90	127.136	Quarez, Éric; Espinosa-Angeles, Julio César; Crosnier, Olivier; Joubert, Olivier; Brousse, Thierry Revisiting the five-decade-old structure of the Fe2WO6 powder with incommensurate modulations CrystEngComm, 2021, 23, 7298-7304
7243653	CIF	C18 H19 Co N2 O9	P -1	9.8424; 9.9803; 10.836 95.012; 109.791; 107.971	930.5	Hu, Ji-Hong; Liu, Yuan-Chin; Chen, Jhy-Der Cobalt(ii) coordination polymers constructed from bis(N-pyrid-3-ylmethyl)adipoamide and polycarboxylic acids: reversible structural transformation upon proton delivery and removal CrystEngComm, 2021, 23, 7471-7478
7243654	CIF	C30 H38 Co N4 O8	P -1	10.4474; 12.2491; 13.1227 77.35; 76.486; 74.932	1554.1	Hu, Ji-Hong; Liu, Yuan-Chin; Chen, Jhy-Der Cobalt(ii) coordination polymers constructed from bis(N-pyrid-3-ylmethyl)adipoamide and polycarboxylic acids: reversible structural transformation upon proton delivery and removal CrystEngComm, 2021, 23, 7471-7478
7243655	CIF	C17 H18 Co N3 O6	P 1 21/c 1	10.4957; 10.1234; 16.807 90; 106.706; 90	1710.41	Hu, Ji-Hong; Liu, Yuan-Chin; Chen, Jhy-Der Cobalt(ii) coordination polymers constructed from bis(N-pyrid-3-ylmethyl)adipoamide and polycarboxylic acids: reversible structural transformation upon proton delivery and removal CrystEngComm, 2021, 23, 7471-7478
7243656	CIF	C36 H52 Co1.5 N6 O17	P -1	9.1047; 11.1545; 22.7393 99.678; 93.31; 106.073	2174.2	Hu, Ji-Hong; Liu, Yuan-Chin; Chen, Jhy-Der Cobalt(ii) coordination polymers constructed from bis(N-pyrid-3-ylmethyl)adipoamide and polycarboxylic acids: reversible structural transformation upon proton delivery and removal CrystEngComm, 2021, 23, 7471-7478
7243657	CIF	C124 H108 N4 Ni O8	P 42/n :2	22.271; 22.271; 12.529 90; 90; 90	6214.4	Chen, Chen; Li, Dan; Cao, Guanyue; Qin, Zhonghe; Xu, Yi; Liu, Xiujun; Li, Qizhao; Xie, Yongshu; Li, Chengjie Solvent-regulated biomorphs from the intense π,π-mediated assemblies of tetracenequinone fused porphyrin CrystEngComm, 2021, 23, 7565-7569
7243658	CIF	C140.3 H117.1 N4 Ni O8	P -4	20.4751; 20.4751; 13.4593 90; 90; 90	5642.5	Chen, Chen; Li, Dan; Cao, Guanyue; Qin, Zhonghe; Xu, Yi; Liu, Xiujun; Li, Qizhao; Xie, Yongshu; Li, Chengjie Solvent-regulated biomorphs from the intense π,π-mediated assemblies of tetracenequinone fused porphyrin CrystEngComm, 2021, 23, 7565-7569
7243659	CIF	C21 H23 N7 O2 S	P -1	7.3361; 11.8575; 12.8075 70.641; 78.588; 76.401	1012.86	Rai, Sunil K.; Baidya, Debjani; Nangia, Ashwini K. Salts, solvates and hydrates of the multi-kinase inhibitor drug pazopanib with hydroxybenzoic acids CrystEngComm, 2021, 23, 5994-6011
7243660	CIF	C28 H31 N7 O6 S	P 1 21/c 1	16.2967; 8.5063; 21.3502 90; 108.21; 90	2811.4	Rai, Sunil K.; Baidya, Debjani; Nangia, Ashwini K. Salts, solvates and hydrates of the multi-kinase inhibitor drug pazopanib with hydroxybenzoic acids CrystEngComm, 2021, 23, 5994-6011
7243661	CIF	C30 H35 N7 O7 S	P b c a	8.6083; 21.2446; 33.276 90; 90; 90	6085.5	Rai, Sunil K.; Baidya, Debjani; Nangia, Ashwini K. Salts, solvates and hydrates of the multi-kinase inhibitor drug pazopanib with hydroxybenzoic acids CrystEngComm, 2021, 23, 5994-6011
7243662	CIF	C29 H33 N7 O6 S	C 1 2/c 1	36.464; 8.7361; 24.937 90; 132.658; 90	5842	Rai, Sunil K.; Baidya, Debjani; Nangia, Ashwini K. Salts, solvates and hydrates of the multi-kinase inhibitor drug pazopanib with hydroxybenzoic acids CrystEngComm, 2021, 23, 5994-6011
7243663	CIF	C29 H35 N7 O8 S	P 1 21/c 1	16.4349; 8.4148; 22.4426 90; 103.464; 90	3018.4	Rai, Sunil K.; Baidya, Debjani; Nangia, Ashwini K. Salts, solvates and hydrates of the multi-kinase inhibitor drug pazopanib with hydroxybenzoic acids CrystEngComm, 2021, 23, 5994-6011
7243664	CIF	C32 H34 N8 O6 S	P 1 21/c 1	16.0673; 8.5659; 23.125 90; 106.194; 90	3056.4	Rai, Sunil K.; Baidya, Debjani; Nangia, Ashwini K. Salts, solvates and hydrates of the multi-kinase inhibitor drug pazopanib with hydroxybenzoic acids CrystEngComm, 2021, 23, 5994-6011
7243665	CIF	C28 H29 N7 O6 S	P -1	8.687; 10.446; 16.411 77.708; 77.031; 74.897	1382.1	Rai, Sunil K.; Baidya, Debjani; Nangia, Ashwini K. Salts, solvates and hydrates of the multi-kinase inhibitor drug pazopanib with hydroxybenzoic acids CrystEngComm, 2021, 23, 5994-6011
7243666	CIF	C28 H37 N7 O10 S	P -1	7.499; 14.142; 15.071 77.4; 77.647; 86.005	1523.2	Rai, Sunil K.; Baidya, Debjani; Nangia, Ashwini K. Salts, solvates and hydrates of the multi-kinase inhibitor drug pazopanib with hydroxybenzoic acids CrystEngComm, 2021, 23, 5994-6011
7243667	CIF	C28 H29 N7 O6 S	P 1 21/c 1	8.5756; 22.7659; 14.185 90; 90.794; 90	2769.09	Rai, Sunil K.; Baidya, Debjani; Nangia, Ashwini K. Salts, solvates and hydrates of the multi-kinase inhibitor drug pazopanib with hydroxybenzoic acids CrystEngComm, 2021, 23, 5994-6011
7243668	CIF	C25 H31 N7 O3 S	P -1	11.358; 14.023; 16.34 105.473; 91.683; 97.049	2484	Rai, Sunil K.; Baidya, Debjani; Nangia, Ashwini K. Salts, solvates and hydrates of the multi-kinase inhibitor drug pazopanib with hydroxybenzoic acids CrystEngComm, 2021, 23, 5994-6011
7243669	CIF	C22 H28 Cd N2 O5	P n m a	14.727; 23.437; 5.987 90; 90; 90	2066.5	Soltani, Sajjad; Akhbari, Kamran; White, Jonathan Effect of structural features on the stability and bactericidal potential of two cadmium coordination polymers CrystEngComm, 2021, 23, 7450-7461
7243670	CIF	C20 H18 Cd N2 O4	P -1	9.306; 10.76; 10.904 114.49; 104.24; 103.92	887.5	Soltani, Sajjad; Akhbari, Kamran; White, Jonathan Effect of structural features on the stability and bactericidal potential of two cadmium coordination polymers CrystEngComm, 2021, 23, 7450-7461
7243671	CIF	C30 H31 Cl N6 O5 S	P 1 21 1	13.247; 7.6192; 15.469 90; 92.42; 90	1559.9	Gundlapalli, Suman; Devarapalli, Ramesh; Mudda, Ramesh Reddy; Chennuru, Ramanaiah; Rupakula, Ravichandrababu Novel solid forms of insomnia drug suvorexant with improved solubility and dissolution: accessing salts from a salt solvate route CrystEngComm, 2021, 23, 7739-7749
7243672	CIF	C22 H28 Cd N2 O5	P n m a	14.727; 23.437; 5.987 90; 90; 90	2066.5	Gundlapalli, Suman; Devarapalli, Ramesh; Mudda, Ramesh Reddy; Chennuru, Ramanaiah; Rupakula, Ravichandrababu Novel solid forms of insomnia drug suvorexant with improved solubility and dissolution: accessing salts from a salt solvate route CrystEngComm, 2021, 23, 7739-7749
7243673	CIF	C20 H18 Cd N2 O4	P -1	9.306; 10.76; 10.904 114.49; 104.24; 103.92	887.5	Gundlapalli, Suman; Devarapalli, Ramesh; Mudda, Ramesh Reddy; Chennuru, Ramanaiah; Rupakula, Ravichandrababu Novel solid forms of insomnia drug suvorexant with improved solubility and dissolution: accessing salts from a salt solvate route CrystEngComm, 2021, 23, 7739-7749
7243674	CIF	C29 H29 Cl N6 O5 S	P 1 c 1	15.4711; 7.0655; 13.0349 90; 104.993; 90	1376.4	Gundlapalli, Suman; Devarapalli, Ramesh; Mudda, Ramesh Reddy; Chennuru, Ramanaiah; Rupakula, Ravichandrababu Novel solid forms of insomnia drug suvorexant with improved solubility and dissolution: accessing salts from a salt solvate route CrystEngComm, 2021, 23, 7739-7749
7243675	CIF	C31 H35 Cl N6 O6 S	P 1 21 1	14.5891; 7.5159; 15.6522 90; 113.725; 90	1571.22	Gundlapalli, Suman; Devarapalli, Ramesh; Mudda, Ramesh Reddy; Chennuru, Ramanaiah; Rupakula, Ravichandrababu Novel solid forms of insomnia drug suvorexant with improved solubility and dissolution: accessing salts from a salt solvate route CrystEngComm, 2021, 23, 7739-7749
7243676	CIF	C17 H13 N3 O10 U2	P -1	8.175; 11.225; 12.1741 76.648; 86.085; 70.908	1027.13	Thuéry, Pierre; Harrowfield, Jack Uranyl ion complexes with 2,2′:6′,2′′-terpyridine-4′-carboxylate. Interpenetration of networks involving “expanded ligands” CrystEngComm, 2021, 23, 7305-7313
7243677	CIF	C18 H17 N3 O11 Pb U	P -1	10.4295; 10.5028; 11.5621 63.375; 74.261; 80.69	1088.56	Thuéry, Pierre; Harrowfield, Jack Uranyl ion complexes with 2,2′:6′,2′′-terpyridine-4′-carboxylate. Interpenetration of networks involving “expanded ligands” CrystEngComm, 2021, 23, 7305-7313
7243678	CIF	C32 H26 N7 Ni O12.5 U	P 1 21/n 1	8.7682; 16.9333; 28.1757 90; 98.6612; 90	4135.67	Thuéry, Pierre; Harrowfield, Jack Uranyl ion complexes with 2,2′:6′,2′′-terpyridine-4′-carboxylate. Interpenetration of networks involving “expanded ligands” CrystEngComm, 2021, 23, 7305-7313
7243679	CIF	C64 H60 N14 Ni2 O29 U2	P 41	18.5799; 18.5799; 42.3462 90; 90; 90	14618.4	Thuéry, Pierre; Harrowfield, Jack Uranyl ion complexes with 2,2′:6′,2′′-terpyridine-4′-carboxylate. Interpenetration of networks involving “expanded ligands” CrystEngComm, 2021, 23, 7305-7313
7243680	CIF	C160 H176 Ag8 O12 Pt4 S16	C 1 2/c 1	12.125; 26.995; 21.902 90; 90.493; 90	7169	Cheng, Xinglian; Sui, Xin; Xu, Jiayu; Liu, Xu; Chen, Mingyang; Zhu, Yan On the photocatalysis evolution of heteroatom-doped Ag4M2 nanoclusters RSC Advances, 2021, 11, 32526-32532
7243681	CIF	C21 H25 N5 O2 S	P 1 21/n 1	9.2609; 24.972; 9.6398 90; 109.03; 90	2107.5	Zhao, Chenyang; Li, Wanya; Li, Zhonghua; Hu, Weiguo; Zhang, Suoqing; Wu, Songgu Preparation and solid-state characterization of dapsone pharmaceutical cocrystals through the supramolecular synthon strategy CrystEngComm, 2021, 23, 6690-6702
7243682	CIF	C33 H37 N7 O4 S2	P 1 21/n 1	5.7687; 7.8235; 35.517 90; 91.67; 90	1602.3	Zhao, Chenyang; Li, Wanya; Li, Zhonghua; Hu, Weiguo; Zhang, Suoqing; Wu, Songgu Preparation and solid-state characterization of dapsone pharmaceutical cocrystals through the supramolecular synthon strategy CrystEngComm, 2021, 23, 6690-6702
7243683	CIF	C10 H20 Br3 Na O5 Pb	P n m a	7.8228; 13.8222; 16.4334 90; 90; 90	1776.92	Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793
7243684	CIF	C10 H20 Br3 Na O5 Pb	P n m a	7.8558; 13.8616; 16.5205 90; 90; 90	1798.98	Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793
7243685	CIF	C10 H20 Br3 Na O5 Pb	P n m a	7.9139; 13.9195; 16.6734 90; 90; 90	1836.7	Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793
7243686	CIF	C10 H20 Br3 Na O5 Pb	P n m a	7.9357; 13.9514; 16.7733 90; 90; 90	1857.04	Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793
7243687	CIF	C10 H20 Br3 Na O5 Pb	P n m a	7.9192; 13.9256; 16.7036 90; 90; 90	1842.07	Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793
7243688	CIF	C10 H20 Br3 Na O5 Pb	P n m a	7.9171; 13.9272; 16.6694 90; 90; 90	1838.02	Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793
7243689	CIF	C10 H20 Br3 Na O5 Pb	P n m a	7.8962; 13.9023; 16.6281 90; 90; 90	1825.36	Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793
7243690	CIF	C10 H20 Br3 Na O5 Pb	P n m a	7.8377; 13.8396; 16.4718 90; 90; 90	1786.71	Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793
7243691	CIF	C10 H20 Br3 Na O5 Pb	P n m a	7.8755; 13.8822; 16.5729 90; 90; 90	1811.9	Yuan, Guo-Jun; Zhou, Hong; Li, Li; Chen, Hong; Ren, Xiao-Ming Supramolecular [Na(15-crown-5)]+ cations anchored to face-sharing octahedral lead bromide chains featuring a rotor-like one-dimensional perovskite with a reversible isostructural phase transition near room temperature CrystEngComm, 2021, 23, 7787-7793
7243692	CIF	C19 H19 N2 O8 Pb2	P 1 2/c 1	13.6568; 4.4427; 18.6786 90; 101.195; 90	1111.72	Peedikakkal, Abdul Malik P.; Jalilov, Almaz S.; Shaikh, Abdul Rajjak; Kalanthoden, Abdul Nasar; Al-Saadi, Abdulaziz A. Blue- and white-light-emitting 2D-coordination polymers and their solid-state photodimerization reaction CrystEngComm, 2021, 23, 7663-7670
7243693	CIF	C28 H24 N4 O8 Pb2	P 1 2/c 1	18.508; 4.0982; 18.984 90; 96.68; 90	1430.2	Peedikakkal, Abdul Malik P.; Jalilov, Almaz S.; Shaikh, Abdul Rajjak; Kalanthoden, Abdul Nasar; Al-Saadi, Abdulaziz A. Blue- and white-light-emitting 2D-coordination polymers and their solid-state photodimerization reaction CrystEngComm, 2021, 23, 7663-7670
7243694	CIF	C57 H67 Cu2 N11 O21	P 1 21/c 1	21.4117; 11.5851; 25.3771 90; 103.588; 90	6118.8	Malaza, Siphelele S. P.; Mehlana, Gift; Cheung, Ocean; Hunter, Roger; Makhubela, Banothile C. E. Crystalline Cu(ii) metal–organic frameworks based on a carboxamide pincer ligand and an NCONCON–Pd(ii) pincer complex CrystEngComm, 2021, 23, 7418-7424
7243695	CIF	C50 H40 Cu2 N8 O16 Pd2	C 1 c 1	19.6662; 20.9151; 18.3648 90; 117.44; 90	6703.97	Malaza, Siphelele S. P.; Mehlana, Gift; Cheung, Ocean; Hunter, Roger; Makhubela, Banothile C. E. Crystalline Cu(ii) metal–organic frameworks based on a carboxamide pincer ligand and an NCONCON–Pd(ii) pincer complex CrystEngComm, 2021, 23, 7418-7424
7243696	CIF	C8 H8 O2 Te0.5	I 41/a :2	15.9927; 15.9927; 12.1188 90; 90; 90	3099.58	Shibuya, Yuga; Toyoda, Anna; Ohmura, Shiori; Higashikawa, Go; Koguchi, Shinichi One-pot synthesis, structural analysis, and oxidation applications of a series of diaryltellurium dicarboxylates RSC Advances, 2021, 11, 32837-32840
7243697	CIF	C8 H7 F O2 Te0.5	I 41	16.7448; 16.7448; 11.7851 90; 90; 90	3304.4	Shibuya, Yuga; Toyoda, Anna; Ohmura, Shiori; Higashikawa, Go; Koguchi, Shinichi One-pot synthesis, structural analysis, and oxidation applications of a series of diaryltellurium dicarboxylates RSC Advances, 2021, 11, 32837-32840
7243698	CIF	C22 H28 O4 Te	P -1	9.5423; 11.037; 11.4973 115.288; 104.367; 91.682	1047.86	Shibuya, Yuga; Toyoda, Anna; Ohmura, Shiori; Higashikawa, Go; Koguchi, Shinichi One-pot synthesis, structural analysis, and oxidation applications of a series of diaryltellurium dicarboxylates RSC Advances, 2021, 11, 32837-32840
7243699	CIF	C22 H22 F6 O4 Te	P -1	9.6945; 11.7224; 11.8645 116.648; 106.361; 90.992	1139.96	Shibuya, Yuga; Toyoda, Anna; Ohmura, Shiori; Higashikawa, Go; Koguchi, Shinichi One-pot synthesis, structural analysis, and oxidation applications of a series of diaryltellurium dicarboxylates RSC Advances, 2021, 11, 32837-32840
7243700	CIF	C64 H40 F24 O16 Te4	P 1 c 1	19.5971; 10.3078; 19.7804 90; 117.086; 90	3557.5	Shibuya, Yuga; Toyoda, Anna; Ohmura, Shiori; Higashikawa, Go; Koguchi, Shinichi One-pot synthesis, structural analysis, and oxidation applications of a series of diaryltellurium dicarboxylates RSC Advances, 2021, 11, 32837-32840
7243701	CIF	C18 H20 O6 Te	P 1 21/c 1	9.4353; 11.8064; 16.9075 90; 101.416; 90	1846.18	Shibuya, Yuga; Toyoda, Anna; Ohmura, Shiori; Higashikawa, Go; Koguchi, Shinichi One-pot synthesis, structural analysis, and oxidation applications of a series of diaryltellurium dicarboxylates RSC Advances, 2021, 11, 32837-32840
7243702	CIF	C40 H32 O4 Te	C 1 2 1	28.4494; 11.2159; 20.254 90; 103.136; 90	6293.65	Shibuya, Yuga; Toyoda, Anna; Ohmura, Shiori; Higashikawa, Go; Koguchi, Shinichi One-pot synthesis, structural analysis, and oxidation applications of a series of diaryltellurium dicarboxylates RSC Advances, 2021, 11, 32837-32840
7243703	CIF	C23 H16 N3 O8 S4 Zn2	C 1 2/c 1	14.3455; 27.8054; 27.708 90; 90.205; 90	11052.2	Liang, Yu-Jie; Yao, Jun; Deng, Min; Liu, Yan-E.; Xu, Quan-Qing; Li, Qiu-Xia; Jing, Bi; Zhu, Ai-Xin; Huang, Bo A porous anionic zinc(ii) metal–organic framework for gas adsorption, selective uptake of dyes and sensing of Fe3+ by Tb3+ ion encapsulation CrystEngComm, 2021, 23, 7348-7357
7243704	CIF	C21 H19 N3 O S	P 21 21 21	7.2246; 11.8631; 20.815 90; 90; 90	1784	Duan, Xiu; Sun, Qi; Yuan, Xin; Qin, Long-Zhou; Zhang, Xin-Peng; Liu, Jie; Wu, Meng-Yu; Zhu, Shan-Shan; Ma, Can-Liang; Qiu, Jiang-Kai; Guo, Kai Photoinduced remote heteroaryl migration accompanied by cyanoalkylacylation in continuous flow Green Chemistry, 2021, 23, 8916-8921
7243705	CIF	C50 H108 Ce N9 O12 S2	C 1 c 1	16.1541; 18.0486; 23.7037 90; 91.155; 90	6909.62	Ying, Tingting; Tan, Yuhui; Tang, Yunzhi; Long, Xiao; Song, Ning; Li, Yukong; Sun, Zhen Multifunctional rare earth molecular ferroelectrics with a piezoelectric response: ((nBu)4N)3[Ce(NO3)4(SCN)2]((CH3CH2CH2CH2)4N = tetrabutylammonium) CrystEngComm, 2021, 23, 8104-8109
7243706	CIF	C116 H96 Cd5 N6 O30	P -1	8.9895; 11.5404; 33.0283 95.255; 96.857; 102.441	3297.64	Qiao, Yang; Li, Zeqi; Yu, Mei-Hui; Chang, Ze; Bu, Xian-He A metal–organic framework featuring highly sensitive fluorescence sensing for Al3+ ions CrystEngComm, 2021, 23, 8087-8092
7243707	CIF	C51 H51 Cl2 Ga P2 Ru	P -1	12.004; 13.159; 14.922 86.296; 87.495; 71.75	2233.2	García Ponce, Jorge; Díaz-Ramírez, Mariana L.; Gorla, Saidulu; Navarathna, Chanaka; Sanchez-Lecuona, Gabriela; Donnadieu, Bruno; Ibarra, Ilich A.; Montiel-Palma, Virginia SO2 capture enhancement in NU-1000 by the incorporation of a ruthenium gallate organometallic complex CrystEngComm, 2021, 23, 7479-7484
7243708	CIF	C39 H33 N3 O7	P -1	11.035; 11.907; 13.273 81.38; 70.064; 71.719	1554.9	Lombard, Jean; Laker, Heinrich; Prins, Francis; Wahl, Helene; le Roex, Tanya; Haynes, Delia A. Selectivity of hosts for guests by liquid-assisted grinding: differences between solution and mechanochemistry CrystEngComm, 2021, 23, 7380-7384
7243709	CIF	C39 H32 N2 O7	P -1	10.653; 11.153; 13.566 85.062; 74.512; 72.396	1480.5	Lombard, Jean; Laker, Heinrich; Prins, Francis; Wahl, Helene; le Roex, Tanya; Haynes, Delia A. Selectivity of hosts for guests by liquid-assisted grinding: differences between solution and mechanochemistry CrystEngComm, 2021, 23, 7380-7384
7243710	CIF	C38 H31 N3 O7	P -1	10.6989; 11.63; 13.421 82.162; 72.106; 72.058	1510.3	Lombard, Jean; Laker, Heinrich; Prins, Francis; Wahl, Helene; le Roex, Tanya; Haynes, Delia A. Selectivity of hosts for guests by liquid-assisted grinding: differences between solution and mechanochemistry CrystEngComm, 2021, 23, 7380-7384
7243711	CIF	C37 H30 N2 O7 S	P -1	10.554; 11.3682; 13.7388 84.165; 74.55; 72.852	1517.71	Lombard, Jean; Laker, Heinrich; Prins, Francis; Wahl, Helene; le Roex, Tanya; Haynes, Delia A. Selectivity of hosts for guests by liquid-assisted grinding: differences between solution and mechanochemistry CrystEngComm, 2021, 23, 7380-7384
7243712	CIF	C14 H20 Cl N3 O3 S	P 1 21/n 1	18.7914; 9.2921; 19.0621 90; 99.32; 90	3284.52	Gál, G. Tamás; May, Nóra V.; Trif, László; Mihály, Judith; Bombicz, Petra Solvatomorph and polymorph screening of clopamide drug and its copper(ii) complex crystals CrystEngComm, 2021, 23, 7425-7441
7243713	CIF	C28 H38 Cl2 Cu N6 O6 S2	P -1	7.8247; 13.829; 15.156 78.981; 81.309; 85.041	1588.5	Gál, G. Tamás; May, Nóra V.; Trif, László; Mihály, Judith; Bombicz, Petra Solvatomorph and polymorph screening of clopamide drug and its copper(ii) complex crystals CrystEngComm, 2021, 23, 7425-7441
7243714	CIF	C28 H38 Cl2 Cu N6 O6 S2	P -1	13.46; 15.2424; 18.1855 114.627; 93.362; 90.021	3384.5	Gál, G. Tamás; May, Nóra V.; Trif, László; Mihály, Judith; Bombicz, Petra Solvatomorph and polymorph screening of clopamide drug and its copper(ii) complex crystals CrystEngComm, 2021, 23, 7425-7441
7243715	CIF	C28 H38 Cl2 Cu N6 O6 S2	R -3 :H	23.078; 23.078; 18.3291 90; 90; 120	8454.1	Gál, G. Tamás; May, Nóra V.; Trif, László; Mihály, Judith; Bombicz, Petra Solvatomorph and polymorph screening of clopamide drug and its copper(ii) complex crystals CrystEngComm, 2021, 23, 7425-7441
7243716	CIF	C30 H42 Cl6 Cu N6 O6 S2	C 1 2/c 1	26.699; 9.8941; 15.6876 90; 104.75; 90	4007.5	Gál, G. Tamás; May, Nóra V.; Trif, László; Mihály, Judith; Bombicz, Petra Solvatomorph and polymorph screening of clopamide drug and its copper(ii) complex crystals CrystEngComm, 2021, 23, 7425-7441
7243717	CIF	C34 H58 Cl2 Cu N6 O10 S2	P -1	8.497; 8.404; 16.31 83.113; 79.445; 67.366	1055.2	Gál, G. Tamás; May, Nóra V.; Trif, László; Mihály, Judith; Bombicz, Petra Solvatomorph and polymorph screening of clopamide drug and its copper(ii) complex crystals CrystEngComm, 2021, 23, 7425-7441
7243718	CIF	C34 H58 Cl2 Cu N6 O10 S2	P -1	8.3107; 8.7469; 16.387 79.713; 87.099; 65.629	1067.3	Gál, G. Tamás; May, Nóra V.; Trif, László; Mihály, Judith; Bombicz, Petra Solvatomorph and polymorph screening of clopamide drug and its copper(ii) complex crystals CrystEngComm, 2021, 23, 7425-7441
7243719	CIF	C30 H50 Cl2 Cu N6 O10 S2	P -1	7.7518; 8.0901; 16.3683 83.113; 78.821; 71.659	953.96	Gál, G. Tamás; May, Nóra V.; Trif, László; Mihály, Judith; Bombicz, Petra Solvatomorph and polymorph screening of clopamide drug and its copper(ii) complex crystals CrystEngComm, 2021, 23, 7425-7441
7243720	CIF	C32 H54 Cl2 Cu N6 O10 S2	P -1	8.2195; 8.2439; 16.4822 85.598; 78.212; 68.273	1015.62	Gál, G. Tamás; May, Nóra V.; Trif, László; Mihály, Judith; Bombicz, Petra Solvatomorph and polymorph screening of clopamide drug and its copper(ii) complex crystals CrystEngComm, 2021, 23, 7425-7441
7243721	CIF	C28 H40 Cl2 N6 O7 S2	C 1 2/c 1	14.5166; 9.3747; 24.7064 90; 100.965; 90	3300.9	Gál, G. Tamás; May, Nóra V.; Trif, László; Mihály, Judith; Bombicz, Petra Solvatomorph and polymorph screening of clopamide drug and its copper(ii) complex crystals CrystEngComm, 2021, 23, 7425-7441
7243722	CIF	C152 H162 Ag36 F44 O30 Te	P -1	17.5326; 18.5686; 19.6507 65.24; 66.895; 69.537	5210.2	Hou, Lin-Lin; Li, Hong-Jing; Yu, Dong-Nan; Cheng, Xun; Yao, Zi-Xuan; Liu, Kuan-Guan; Yan, Xiao-Wei Mass spectrometry guided surface modification of a tellurate ion templated 36-nucleus silver alkynyl nanocluster CrystEngComm, 2021, 23, 7202-7205
7243723	CIF	C24 H8 Cl4 O2	P -1	3.8349; 8.8365; 13.2606 88.717; 89.773; 78.865	440.79	Liu, Ying-Hsuan; Dadvand, Afshin; Titi, Hatem M.; Hamzehpoor, Ehsan; Perepichka, Dmitrii F. Halogen bonding vs. π-stacking interactions in new bis(acenaphthylene)dione semiconductors CrystEngComm, 2021, 23, 8255-8259
7243724	CIF	C24 H12 O2	P 1 21/c 1	3.8029; 13.8237; 14.1694 90; 94.395; 90	742.7	Liu, Ying-Hsuan; Dadvand, Afshin; Titi, Hatem M.; Hamzehpoor, Ehsan; Perepichka, Dmitrii F. Halogen bonding vs. π-stacking interactions in new bis(acenaphthylene)dione semiconductors CrystEngComm, 2021, 23, 8255-8259
7243725	CIF	C24 H8 Br4 O2	P n a 21	31.7745; 3.8742; 15.4074 90; 90; 90	1896.66	Liu, Ying-Hsuan; Dadvand, Afshin; Titi, Hatem M.; Hamzehpoor, Ehsan; Perepichka, Dmitrii F. Halogen bonding vs. π-stacking interactions in new bis(acenaphthylene)dione semiconductors CrystEngComm, 2021, 23, 8255-8259
7243726	CIF	C45 H38 Br2 N7 O2 S0.5	P 1 21/c 1	15.8195; 4.6302; 26.812 90; 100.182; 90	1933	Islam, Md Faizul; Sindt, Ammon J.; Hossain, Muhammad Saddam; Ayare, Pooja J.; Smith, Mark D.; Vannucci, Aaron K.; Garashchuk, Sophya; Shimizu, Linda S. Assembled triphenylamine bis-urea macrocycles: Exploring photodriven electron transfer from host to guests. Physical Chemistry Chemical Physics, 2021
7243727	CIF	C43.88 H36.62 Br2 Cl0.62 N6 O2.62	P 1 21/c 1	15.782; 4.6143; 26.78 90; 100.354; 90	1918.4	Islam, Md Faizul; Sindt, Ammon J.; Hossain, Muhammad Saddam; Ayare, Pooja J.; Smith, Mark D.; Vannucci, Aaron K.; Garashchuk, Sophya; Shimizu, Linda S. Assembled triphenylamine bis-urea macrocycles: Exploring photodriven electron transfer from host to guests. Physical Chemistry Chemical Physics, 2021
7243728	CIF	C42 H36 Br2 I0.69 N6 O2	P 1 21/c 1	15.871; 4.6048; 26.839 90; 100.177; 90	1930.6	Islam, Md Faizul; Sindt, Ammon J.; Hossain, Muhammad Saddam; Ayare, Pooja J.; Smith, Mark D.; Vannucci, Aaron K.; Garashchuk, Sophya; Shimizu, Linda S. Assembled triphenylamine bis-urea macrocycles: Exploring photodriven electron transfer from host to guests. Physical Chemistry Chemical Physics, 2021
7243729	CIF	C23 H14 Cu2 O12	I 41/a m d :2	28.727; 28.727; 14.5895 90; 90; 90	12040	Yan, Yang-Tian; Wang, Chen-Yang; Zheng, Li-Na; Wu, Yun-long; Liu, Jiao; Wu, Wei-Ping; Zhang, Wen-Yan; Wang, Yao-Yu A new multi-functional Cu(ii)-organic framework as a platform for selective carbon dioxide chemical fixation and separation of organic dyes CrystEngComm, 2021, 23, 8315-8322
7243730	CIF	C50 H46 Cd3 N8 O17	P -1	9.965; 10.598; 12.54 94.375; 108.088; 94.539	1247.8	Zhou, Shanhe; Lu, Lu; Liu, Dong; Wang, Jun; Sakiyama, Hiroshi; Muddassir, Mohd.; Nezamzadeh-Ejhieh, Alireza; Liu, Jianqiang Series of highly stable Cd(ii)-based MOFs as sensitive and selective sensors for detection of nitrofuran antibiotic CrystEngComm, 2021, 23, 8043-8052
7243731	CIF	C33 H23 Cd N5 O8	P -1	10.256; 12.989; 14.013 63.783; 81.4; 82.923	1652.4	Zhou, Shanhe; Lu, Lu; Liu, Dong; Wang, Jun; Sakiyama, Hiroshi; Muddassir, Mohd.; Nezamzadeh-Ejhieh, Alireza; Liu, Jianqiang Series of highly stable Cd(ii)-based MOFs as sensitive and selective sensors for detection of nitrofuran antibiotic CrystEngComm, 2021, 23, 8043-8052
7243732	CIF	C62 H42 Cd3 N12 O14	P -1	10.0981; 11.7986; 12.4956 86.098; 76.446; 72.064	1376.95	Zhou, Shanhe; Lu, Lu; Liu, Dong; Wang, Jun; Sakiyama, Hiroshi; Muddassir, Mohd.; Nezamzadeh-Ejhieh, Alireza; Liu, Jianqiang Series of highly stable Cd(ii)-based MOFs as sensitive and selective sensors for detection of nitrofuran antibiotic CrystEngComm, 2021, 23, 8043-8052
7243733	CIF	C54 H38 Cd3 N8 O16	P -1	10.081; 10.549; 12.362 91.1; 107.393; 99.635	1233.5	Zhou, Shanhe; Lu, Lu; Liu, Dong; Wang, Jun; Sakiyama, Hiroshi; Muddassir, Mohd.; Nezamzadeh-Ejhieh, Alireza; Liu, Jianqiang Series of highly stable Cd(ii)-based MOFs as sensitive and selective sensors for detection of nitrofuran antibiotic CrystEngComm, 2021, 23, 8043-8052
7243738	CIF	C15 H13 F N2 O3	P 1 21/c 1	12.35; 13.16; 8.567 90; 93; 90	1390	Luo, Mu-Jia; Ouyang, Xuan-Hui; Zhu, Yan-Ping; Li, Yang; Li, Jin-Heng Metal-free electrochemical [3 + 2] heteroannulation of anilines with pyridines enabled by dual C–H radical aminations Green Chemistry, 2021, 23, 9024-9029
7243739	CIF	C18 H48 B Cu3 K3 N24 O66 W12	R -3 :H	35.1668; 35.1668; 20.227 90; 90; 120	21663.5	Chang, Shenzhen; Chen, Yanhong; An, Haiyan; Zhu, Qingshan; Luo, Huiyun; Huang, Yaohui Polyoxometalate-based supramolecular porous frameworks with dual-active centers towards highly efficient synthesis of functionalized p-benzoquinones Green Chemistry, 2021, 23, 8591-8603
7243740	CIF	C18 H67 Cu3 K3 N24 O76 Si W12	P -3	15.57; 15.57; 10.337 90; 90; 120	2170.2	Chang, Shenzhen; Chen, Yanhong; An, Haiyan; Zhu, Qingshan; Luo, Huiyun; Huang, Yaohui Polyoxometalate-based supramolecular porous frameworks with dual-active centers towards highly efficient synthesis of functionalized p-benzoquinones Green Chemistry, 2021, 23, 8591-8603
7243741	CIF	C42 H43 Ag3 N6 O8	P 1	9.702; 10.763; 11.435 75.894; 84.943; 69.928	1087.7	Liu, Bo; Lv, Mengying; Jiang, Wei; Gao, Baihui; Li, Yuxin; Zhou, Shi; Wang, Dandan; Liu, Chunbo; Che, Guangbo Self-photoreduced Ag0-doped Ag(i)–organic frameworks with efficient visible-light-driven photocatalytic performance CrystEngComm, 2021, 23, 7496-7501
7243742	CIF	C54 H62 Cl6 F6 Ir N6 O4 P	C 1 2/c 1	19.554; 22.055; 15.394 90; 117.07; 90	5912	Martínez-Vollbert, Emiliano; Philouze, Christian; Gautier-Luneau, Isabelle; Moreau, Yohann; Lanoë, Pierre-Henri; Loiseau, Frederique Study of a phosphorescent cationic iridium(III) complex displaying blue shift in crystals Physical Chemistry Chemical Physics, 2021
7243743	CIF	C15 H14 Fe O7	P 1 21 1	7.1067; 12.2043; 9.3734 90; 104.11; 90	788.45	Krause, Bernhard Markus; Bauer, Britta; Neudoerfl, Joerg; Wieder, Thomas; Schmalz, Hans Günther ItaCORMs: Conjugation with a CO-releasing Unit greatly Enhances the Anti-inflammatory Activity of Itaconates RSC Medicinal Chemistry, 2021
7243744	CIF	C15 H14 Fe O7	P b c n	11.3484; 7.4781; 36.737 90; 90; 90	3117.67	Krause, Bernhard Markus; Bauer, Britta; Neudoerfl, Joerg; Wieder, Thomas; Schmalz, Hans Günther ItaCORMs: Conjugation with a CO-releasing Unit greatly Enhances the Anti-inflammatory Activity of Itaconates RSC Medicinal Chemistry, 2021
7243745	CIF	C26 H28 Co2 Mo8 N8 O35	P -1	9.5767; 11.1881; 12.2524 83.416; 68.138; 73.915	1170.6	Ying, Jun; Jin, Liang; Yu, Hai-Yan; Tian, Ai-Xiang; Wang, Xiu-Li A series of polyoxometalate-based hybrid complexes constructed by a tripodal ligand containing mixed N/O donors CrystEngComm, 2021, 23, 7846-7854
7243746	CIF	C13 H13 Fe Mo4 N4 O17	P -1	9.589; 11.22; 12.27 83.409; 68.107; 73.943	1177	Ying, Jun; Jin, Liang; Yu, Hai-Yan; Tian, Ai-Xiang; Wang, Xiu-Li A series of polyoxometalate-based hybrid complexes constructed by a tripodal ligand containing mixed N/O donors CrystEngComm, 2021, 23, 7846-7854
7243747	CIF	C26 H30 Cu2 Mo8 N8 O35	P -1	9.593; 11.205; 12.283 83.427; 68.122; 73.812	1176.5	Ying, Jun; Jin, Liang; Yu, Hai-Yan; Tian, Ai-Xiang; Wang, Xiu-Li A series of polyoxometalate-based hybrid complexes constructed by a tripodal ligand containing mixed N/O donors CrystEngComm, 2021, 23, 7846-7854
7243748	CIF	C13 H12 Mo4 N4 O17 Zn	P -1	9.6183; 11.1742; 12.2597 83.415; 68.179; 73.86	1174.92	Ying, Jun; Jin, Liang; Yu, Hai-Yan; Tian, Ai-Xiang; Wang, Xiu-Li A series of polyoxometalate-based hybrid complexes constructed by a tripodal ligand containing mixed N/O donors CrystEngComm, 2021, 23, 7846-7854
7243749	CIF	C13 H13 Mo4 N4 Ni O17	P -1	9.5458; 11.1569; 12.2071 83.619; 68.162; 74.084	1160.46	Ying, Jun; Jin, Liang; Yu, Hai-Yan; Tian, Ai-Xiang; Wang, Xiu-Li A series of polyoxometalate-based hybrid complexes constructed by a tripodal ligand containing mixed N/O donors CrystEngComm, 2021, 23, 7846-7854
7243750	CIF	C26 H24 Cd Mo12 N8 O46 P	P -1	13.2622; 13.533; 16.2984 87.28; 74.467; 88.037	2814.5	Ying, Jun; Jin, Liang; Yu, Hai-Yan; Tian, Ai-Xiang; Wang, Xiu-Li A series of polyoxometalate-based hybrid complexes constructed by a tripodal ligand containing mixed N/O donors CrystEngComm, 2021, 23, 7846-7854
7243751	CIF	C26 H14 La N2.3 O10.9	P -1	9.3815; 12.1909; 14.0591 92.007; 101.5; 101.086	1541.7	Liu, Jian-Jun; Fu, Jia-Jia; Li, Gui-Jun; Liu, Teng; Xia, Shu-Biao; Cheng, Fei-Xiang A water-stable photochromic MOF with controllable iodine sorption and efficient removal of dichromate CrystEngComm, 2021, 23, 7628-7634
7243752	CIF	C40 H48 Cu N6 O8	P 1 21/c 1	5.7835; 16.051; 21.5072 90; 94.365; 90	1990.7	Dezotti, Yuri; Barrionuevo, Manoel Victor Frutuoso; Silva, Ingrid Fernandes; Ribeiro, Marcos Antônio; Añez, Rafael; Stumpf, Humberto Osório; San-Miguel, Miguel Angel; Barros, Wdeson Pereira Experimental and theoretical studies of a pyridylvinyl(benzoate) based coordination polymer structure CrystEngComm, 2021, 23, 8139-8149
7243753	CIF	C56 H44 Cu F3 N4 O3 P2 S	P 1 21/n 1	15.728; 13.5055; 24.0316 90; 108.218; 90	4848.8	Li, Zi-Xi; Kuang, Xiao-Nan; Wang, Guo; Zhu, Ning; Sun, Zhen-Zhou; Han, Hong-Liang; Yang, Yu-Ping; Li, Zhong-Feng; Xin, Xiu-Lan; Jin, Qiong-Hua; Ren, Zhi-Gang A series of luminescent Cu(i) complexes based on the diphosphine ligand and diimine ligand: weak intermolecular interactions, terahertz spectroscopy and photoproperties CrystEngComm, 2021, 23, 8323-8333
7243754	CIF	C55.27 H45.07 B Cu F4 N4 O0.27 P2	P 1 21/n 1	14.5279; 19.7802; 16.4881 90; 93.0114; 90	4731.56	Li, Zi-Xi; Kuang, Xiao-Nan; Wang, Guo; Zhu, Ning; Sun, Zhen-Zhou; Han, Hong-Liang; Yang, Yu-Ping; Li, Zhong-Feng; Xin, Xiu-Lan; Jin, Qiong-Hua; Ren, Zhi-Gang A series of luminescent Cu(i) complexes based on the diphosphine ligand and diimine ligand: weak intermolecular interactions, terahertz spectroscopy and photoproperties CrystEngComm, 2021, 23, 8323-8333
7243755	CIF	C55 H44 Cl Cu N4 O4 P2	P 1 21/c 1	16.0954; 13.4388; 23.1216 90; 107.221; 90	4777.1	Li, Zi-Xi; Kuang, Xiao-Nan; Wang, Guo; Zhu, Ning; Sun, Zhen-Zhou; Han, Hong-Liang; Yang, Yu-Ping; Li, Zhong-Feng; Xin, Xiu-Lan; Jin, Qiong-Hua; Ren, Zhi-Gang A series of luminescent Cu(i) complexes based on the diphosphine ligand and diimine ligand: weak intermolecular interactions, terahertz spectroscopy and photoproperties CrystEngComm, 2021, 23, 8323-8333
7243756	CIF	C57 H52 Br Cu N4 O2 P2	P 1 21/n 1	11.9044; 19.1935; 21.5471 90; 105.907; 90	4734.71	Li, Zi-Xi; Kuang, Xiao-Nan; Wang, Guo; Zhu, Ning; Sun, Zhen-Zhou; Han, Hong-Liang; Yang, Yu-Ping; Li, Zhong-Feng; Xin, Xiu-Lan; Jin, Qiong-Hua; Ren, Zhi-Gang A series of luminescent Cu(i) complexes based on the diphosphine ligand and diimine ligand: weak intermolecular interactions, terahertz spectroscopy and photoproperties CrystEngComm, 2021, 23, 8323-8333
7243757	CIF	C56 H48 Cu I N4 O P2	P 1 21/n 1	14.3536; 20.0276; 16.8454 90; 94.109; 90	4830.07	Li, Zi-Xi; Kuang, Xiao-Nan; Wang, Guo; Zhu, Ning; Sun, Zhen-Zhou; Han, Hong-Liang; Yang, Yu-Ping; Li, Zhong-Feng; Xin, Xiu-Lan; Jin, Qiong-Hua; Ren, Zhi-Gang A series of luminescent Cu(i) complexes based on the diphosphine ligand and diimine ligand: weak intermolecular interactions, terahertz spectroscopy and photoproperties CrystEngComm, 2021, 23, 8323-8333
7243758	CIF	C8 H12 N14 O16	P 1 21/c 1	8.9053; 12.585; 17.847 90; 90.73; 90	2000	Zhang, Wenjin; Bao, Lingxiang; Fei, Teng; Lv, Penghao; Sun, Chenghui; Pang, Siping Taming CL-20 through hydrogen bond interaction with nitromethane CrystEngComm, 2021, 23, 8099-8103
7243759	CIF	C18 H15 N O3 S	P 21 21 21	8.79899; 12.17385; 15.22942 90; 90; 90	1631.34	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243760	CIF	C56 H46 N6 O6 S2	P 1 21/n 1	14.8313; 16.0368; 20.2334 90; 91.974; 90	4809.6	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243761	CIF	C14 H14 Cl N O4 S	P 1 21/n 1	8.4505; 13.524; 13.0184 90; 100.599; 90	1462.42	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243762	CIF	C17 H13 Br Cl N2 O2 S	P -1	8.4205; 9.8122; 11.2928 93.998; 101.829; 108.5	856.87	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243763	CIF	C24 H23 N3 O3 S	C 1 2/c 1	31.8179; 8.1924; 17.861 90; 103.002; 90	4536.4	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243764	CIF	C23 H20 F N3 O2 S	P 1 21/c 1	10.2247; 13.3486; 15.0139 90; 98.168; 90	2028.4	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243765	CIF	C15 H17 N O2 S	P -1	9.0097; 12.3524; 12.9152 82.341; 84.612; 84.72	1413.62	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243766	CIF	C25 H24 N3 O2 S	P 1 21/c 1	12.6908; 11.0757; 15.7411 90; 91.683; 90	2211.61	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243767	CIF	C26 H27 N3 O4 S	P -1	8.3499; 11.4704; 13.571 101.723; 95.458; 110.537	1172	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243768	CIF	C13 H12 F N O2 S	P 1 21/n 1	9.175; 5.9502; 22.5 90; 95.764; 90	1222.13	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243769	CIF	C16 H12 F N O2 S	P b c a	11.5492; 7.5883; 31.0045 90; 90; 90	2717.2	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243770	CIF	C54 H42 Br4 N8 O4 S2	P -1	11.7276; 14.3853; 16.9385 99.089; 98.944; 110.799	2567.63	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243771	CIF	C12 H9 Br2 N O2 S	P n a 21	9.958; 21.7896; 6.0999 90; 90; 90	1323.56	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243772	CIF	C13 H10 F3 N O2 S	P 1 21/n 1	5.0813; 20.4639; 12.2504 90; 90.757; 90	1273.72	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243773	CIF	C24 H22 F N3 O2 S	P -1	10.0096; 12.4631; 17.7972 80.489; 73.938; 87.66	2104.19	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243774	CIF	C20 H19 Cl4 N2 O4 S	P -1	8.56656; 11.3193; 12.12655 85.376; 87.7729; 80.6487	1156.08	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243775	CIF	C23 H18 F3 N3 O2 S	P -1	8.24874; 9.01497; 29.484 82.9508; 83.6918; 76.4332	2107.72	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243776	CIF	C88 H68 F3 N11 O6 S3	P 1 21/c 1	15.703; 30.2596; 17.0294 90; 111.871; 90	7509.4	Okayasu, Misaki; Kikkawa, Shoko; Hikawa, Hidemasa; Azumaya, Isao Relationship between crystal shape and unit cell shape: crystal shape modification via co-crystallization toward SXRD-suitable crystals CrystEngComm, 2021, 23, 7760-7770
7243777	CIF	C52 H94 Cl2 N8 O6	P 1 21/c 1	8.123; 20.61; 18.053 90; 99.8; 90	2978	Basak, Megha; Das, Asesh; Das, Gopal Exploring cyclohexane/piperazine-urea motifs for spherical halide (X = Cl−/Br−) recognition: effects on anion coordination, photoluminescence, and morphological tunability CrystEngComm, 2021, 23, 7771-7780
7243778	CIF	C60 H102 Cl2 F12 N8 O2	P 1 21/c 1	21.998; 8.4985; 19.2091 90; 99.496; 90	3541.9	Basak, Megha; Das, Asesh; Das, Gopal Exploring cyclohexane/piperazine-urea motifs for spherical halide (X = Cl−/Br−) recognition: effects on anion coordination, photoluminescence, and morphological tunability CrystEngComm, 2021, 23, 7771-7780
7243779	CIF	C28 H30 F12 N6 O2	P 1 21/c 1	12.8556; 13.8433; 8.8264 90; 99.395; 90	1549.7	Basak, Megha; Das, Asesh; Das, Gopal Exploring cyclohexane/piperazine-urea motifs for spherical halide (X = Cl−/Br−) recognition: effects on anion coordination, photoluminescence, and morphological tunability CrystEngComm, 2021, 23, 7771-7780
7243780	CIF	C60 H102 Br2 F12 N8 O2	P 1 21/c 1	21.98; 8.6346; 19.393 90; 99.074; 90	3634.5	Basak, Megha; Das, Asesh; Das, Gopal Exploring cyclohexane/piperazine-urea motifs for spherical halide (X = Cl−/Br−) recognition: effects on anion coordination, photoluminescence, and morphological tunability CrystEngComm, 2021, 23, 7771-7780
7243781	CIF	C52 H94 Br2 N8 O6	P 1 21/c 1	8.2545; 20.43; 18.277 90; 100.194; 90	3033.6	Basak, Megha; Das, Asesh; Das, Gopal Exploring cyclohexane/piperazine-urea motifs for spherical halide (X = Cl−/Br−) recognition: effects on anion coordination, photoluminescence, and morphological tunability CrystEngComm, 2021, 23, 7771-7780
7243782	CIF	C21 H18 N O3 P	P 1 21/n 1	9.52643; 14.88162; 12.71774 90; 90.7242; 90	1802.83	Zhu, Yuan-Yuan; Zhang, Tao; Zhou, Linlin; Yang, Shang-Dong Concise synthesis of N-phosphorylated amides through three-component reactions Green Chemistry, 2021, 23, 9417-9421
7243783	CIF	C26 H22 N O2 P	P 1 21/c 1	15.6285; 9.3057; 14.6152 90; 95.164; 90	2116.92	Zhu, Yuan-Yuan; Zhang, Tao; Zhou, Linlin; Yang, Shang-Dong Concise synthesis of N-phosphorylated amides through three-component reactions Green Chemistry, 2021, 23, 9417-9421
7243784	CIF	C22 H18 N2	P 1 21/c 1	9.87; 20.34; 8.95 90; 108.57; 90	1703	Chen, Wei-Li; Li, Kun; Liao, Wei-Cong; Liang, Wang-Fu; Qiu, Pei-Wen; Liang, Cui; Su, Gui-Fa; Mo, Dong-Liang An iron(iii)-catalyzed dehydrogenative cross-coupling reaction of indoles with benzylamines to prepare 3-aminoindole derivatives Green Chemistry, 2021, 23, 9610-9616
7243785	CIF	C20 H14 N2	P 1 21/n 1	7.9106; 10.4113; 18.0346 90; 98.689; 90	1468.28	Chen, Wei-Li; Li, Kun; Liao, Wei-Cong; Liang, Wang-Fu; Qiu, Pei-Wen; Liang, Cui; Su, Gui-Fa; Mo, Dong-Liang An iron(iii)-catalyzed dehydrogenative cross-coupling reaction of indoles with benzylamines to prepare 3-aminoindole derivatives Green Chemistry, 2021, 23, 9610-9616
7243786	CIF	C26 H24 O S2	P 21 21 21	5.6526; 10.0371; 36.8324 90; 90; 90	2089.71	Zhou, Lu; Chen, Zhaopeng; Li, Jiahui; Li, Baolin Synthesis of dithienofurans via cascade copper catalysed dual C–S coupling and ring closure reactions under mild conditions RSC Advances, 2021, 11, 34071-34078
7243787	CIF	C20 H12 O S2	P 1 21/c 1	16.763; 5.691; 7.7824 90; 97.279; 90	736.44	Zhou, Lu; Chen, Zhaopeng; Li, Jiahui; Li, Baolin Synthesis of dithienofurans via cascade copper catalysed dual C–S coupling and ring closure reactions under mild conditions RSC Advances, 2021, 11, 34071-34078
7243788	CIF	C47 H60 Au2 B F7 N8 O5 S	P 1	9.2214; 11.7385; 13.033 72.325; 75.768; 86.988	1302.54	Kariuki, Benson M.; Platts, James A.; Newman, Paul D. A hybrid bipy–NHC ligand for the construction of group 11 mixed-metal bimetallic complexes RSC Advances, 2021, 11, 34170-34173
7243789	CIF	C40 H48 Ag Au B2 F8 N8	P 1 21 1	12.5502; 26.5936; 13.7021 90; 114.813; 90	4151	Kariuki, Benson M.; Platts, James A.; Newman, Paul D. A hybrid bipy–NHC ligand for the construction of group 11 mixed-metal bimetallic complexes RSC Advances, 2021, 11, 34170-34173
7243790	CIF	C38 H20 Au F3 N4 O	C 1 2/c 1	20.9037; 19.7169; 15.8376 90; 91.467; 90	6525.4	Einrem, Rune F.; Jonsson, Einar Torfi; Teat, Simon J.; Settineri, Nicholas S.; Alemayehu, Abraham B.; Ghosh, Abhik Regioselective formylation of rhenium-oxo and gold corroles: substituent effects on optical spectra and redox potentials RSC Advances, 2021, 11, 34086-34094
7243791	CIF	C45 H36 N4 O3 Re	P -1	9.5807; 12.6649; 29.1467 95.279; 91.627; 90.341	3520.1	Einrem, Rune F.; Jonsson, Einar Torfi; Teat, Simon J.; Settineri, Nicholas S.; Alemayehu, Abraham B.; Ghosh, Abhik Regioselective formylation of rhenium-oxo and gold corroles: substituent effects on optical spectra and redox potentials RSC Advances, 2021, 11, 34086-34094
7243792	CIF	C70 H105 Eu N5 O37 Si8 Tb3	P -1	13.9398; 14.0767; 14.8978 92.2809; 116.681; 113.637	2305.01	Nigoghossian, Karina; Kulakova, Alena N.; Félix, Gautier; Khrustalev, Victor N.; Shubina, Elena S.; Long, Jérôme; Guari, Yannick; Sene, Saad; Carlos, Luís D.; Bilyachenko, Alexey N.; Larionova, Joulia Temperature sensing in Tb3+/Eu3±based tetranuclear silsesquioxane cages with tunable emission RSC Advances, 2021, 11, 34735-34741
7243793	CIF	C80 H110 Eu2 N14 O36 Si8 Tb2	P -1	13.2636; 13.3247; 16.0584 67.984; 85.33; 80.109	2591.5	Nigoghossian, Karina; Kulakova, Alena N.; Félix, Gautier; Khrustalev, Victor N.; Shubina, Elena S.; Long, Jérôme; Guari, Yannick; Sene, Saad; Carlos, Luís D.; Bilyachenko, Alexey N.; Larionova, Joulia Temperature sensing in Tb3+/Eu3±based tetranuclear silsesquioxane cages with tunable emission RSC Advances, 2021, 11, 34735-34741
7243794	CIF	C42 H24 N0 O21 S3 Tb2	P -1	13.9073; 14.243; 14.994 118.151; 99.052; 103.126	2426.3	Liu, Yuqian; Zhao, Peiran; Duan, Chunying; He, Cheng A novel 3D terbium metal–organic framework as a heterogeneous Lewis acid catalyst for the cyanosilylation of aldehyde RSC Advances, 2021, 11, 34779-34787
7243795	CIF	C12 H18 N2 O5	P -1	7.5493; 9.2659; 9.8603 91.084; 104.586; 109.587	624.83	Hussain, Anwar; Mariappan, Kadarkaraisamy; Cork, Dawson C.; Lewandowski, Luke D.; Shrestha, Prem K.; Giri, Samiksha; Wang, Xuejun; Sykes, Andrew G. A highly selective pyridoxal-based chemosensor for the detection of Zn(ii) and application in live-cell imaging; X-ray crystallography of pyridoxal-TRIS Schiff-base Zn(ii) and Cu(ii) complexes RSC Advances, 2021, 11, 34181-34192
7243796	CIF	C24 H44 N4 O15 Zn	P n a 21	20.3659; 8.7855; 16.9217 90; 90; 90	3027.7	Hussain, Anwar; Mariappan, Kadarkaraisamy; Cork, Dawson C.; Lewandowski, Luke D.; Shrestha, Prem K.; Giri, Samiksha; Wang, Xuejun; Sykes, Andrew G. A highly selective pyridoxal-based chemosensor for the detection of Zn(ii) and application in live-cell imaging; X-ray crystallography of pyridoxal-TRIS Schiff-base Zn(ii) and Cu(ii) complexes RSC Advances, 2021, 11, 34181-34192
7243797	CIF	C12 H18 Cl2 Cu N2 O13	P -1	5.877; 9.125; 18.214 86.63; 80.725; 74.305	927.9	Hussain, Anwar; Mariappan, Kadarkaraisamy; Cork, Dawson C.; Lewandowski, Luke D.; Shrestha, Prem K.; Giri, Samiksha; Wang, Xuejun; Sykes, Andrew G. A highly selective pyridoxal-based chemosensor for the detection of Zn(ii) and application in live-cell imaging; X-ray crystallography of pyridoxal-TRIS Schiff-base Zn(ii) and Cu(ii) complexes RSC Advances, 2021, 11, 34181-34192
7243798	CIF	C38 H42 Cl2 Co N10 O16	P 1 21/n 1	12.8107; 14.1995; 25.5626 90; 96.566; 90	4619.5	Oulmidi, Afaf; Radi, Smaail; Idir, Abderrazak; Zyad, Abdelmajid; Kabach, Imad; Nhiri, Mohamed; Robeyns, Koen; Rotaru, Aurelian; Garcia, Yann Synthesis and cytotoxicity against tumor cells of pincer N-heterocyclic ligands and their transition metal complexes RSC Advances, 2021, 11, 34742-34753
7243799	CIF	C38 H42 Cl2 Fe N10 O16.79	P 1 21/c 1	14.3475; 25.751; 13.6655 90; 114.2; 90	4605.2	Oulmidi, Afaf; Radi, Smaail; Idir, Abderrazak; Zyad, Abdelmajid; Kabach, Imad; Nhiri, Mohamed; Robeyns, Koen; Rotaru, Aurelian; Garcia, Yann Synthesis and cytotoxicity against tumor cells of pincer N-heterocyclic ligands and their transition metal complexes RSC Advances, 2021, 11, 34742-34753
7243800	CIF	C19 H21 Cl2 Mn N5 O4	R -3 c :H	30.3293; 30.3293; 13.6082 90; 90; 120	10840.7	Oulmidi, Afaf; Radi, Smaail; Idir, Abderrazak; Zyad, Abdelmajid; Kabach, Imad; Nhiri, Mohamed; Robeyns, Koen; Rotaru, Aurelian; Garcia, Yann Synthesis and cytotoxicity against tumor cells of pincer N-heterocyclic ligands and their transition metal complexes RSC Advances, 2021, 11, 34742-34753
7243801	CIF	C38 H42 Cl2 N10 Ni O16	C 1 2/c 1	29.5243; 13.8841; 22.5685 90; 105.786; 90	8902.3	Oulmidi, Afaf; Radi, Smaail; Idir, Abderrazak; Zyad, Abdelmajid; Kabach, Imad; Nhiri, Mohamed; Robeyns, Koen; Rotaru, Aurelian; Garcia, Yann Synthesis and cytotoxicity against tumor cells of pincer N-heterocyclic ligands and their transition metal complexes RSC Advances, 2021, 11, 34742-34753
7243802	CIF	C45 H32 N4	P -1	9.945; 18.098; 18.778 91.599; 94.106; 104.334	3262	Kim, Min-Ji; Ahn, Mina; Chae, Minjung; Kim, Sanghyun; Kim, Daehoon; Wee, Kyung-Ryang meta-Terphenyl linked donor–π–acceptor dyads: intramolecular charge transfer controlled by electron acceptor group tuning RSC Advances, 2021, 11, 34945-34954
7243803	CIF	C32 H28 Bi2 N10 O14	P 1 21/n 1	11.0626; 13.5522; 11.9227 90; 94.194; 90	1782.7	Adcock, Alyssa K.; Marwitz, Alexander C.; Sanz, Lulio A.; Lee Ayscue, R.; Bertke, Jeffery A.; Knope, Karah E. Synthesis, structural characterization, and luminescence properties of heteroleptic bismuth-organic compounds CrystEngComm, 2021, 23, 8183-8197
7243804	CIF	C31 H19 Bi F6 N4 O7 S2	C 1 2/c 1	36.9899; 9.7296; 18.0256 90; 90.543; 90	6487.1	Adcock, Alyssa K.; Marwitz, Alexander C.; Sanz, Lulio A.; Lee Ayscue, R.; Bertke, Jeffery A.; Knope, Karah E. Synthesis, structural characterization, and luminescence properties of heteroleptic bismuth-organic compounds CrystEngComm, 2021, 23, 8183-8197
7243805	CIF	C31 H19 Bi Br F6 N3 O4 S2	P -1	10.2659; 10.8192; 14.9442 91.545; 92.281; 109.003	1566.73	Adcock, Alyssa K.; Marwitz, Alexander C.; Sanz, Lulio A.; Lee Ayscue, R.; Bertke, Jeffery A.; Knope, Karah E. Synthesis, structural characterization, and luminescence properties of heteroleptic bismuth-organic compounds CrystEngComm, 2021, 23, 8183-8197
7243806	CIF	C31 H19 Eu F6 N4 O7 S2	C 1 2/c 1	37.6364; 9.6744; 18.2345 90; 95.909; 90	6604.1	Adcock, Alyssa K.; Marwitz, Alexander C.; Sanz, Lulio A.; Lee Ayscue, R.; Bertke, Jeffery A.; Knope, Karah E. Synthesis, structural characterization, and luminescence properties of heteroleptic bismuth-organic compounds CrystEngComm, 2021, 23, 8183-8197
7243807	CIF	C31 H19 Bi Cl F6 N3 O4 S2	P -1	10.3216; 10.7535; 14.8647 91.665; 91.689; 109.018	1557.84	Adcock, Alyssa K.; Marwitz, Alexander C.; Sanz, Lulio A.; Lee Ayscue, R.; Bertke, Jeffery A.; Knope, Karah E. Synthesis, structural characterization, and luminescence properties of heteroleptic bismuth-organic compounds CrystEngComm, 2021, 23, 8183-8197
7243808	CIF	C23 H15 Bi Br2 F3 N3 O2 S	C 1 2/c 1	30.2542; 8.7876; 18.6371 90; 96.051; 90	4927.3	Adcock, Alyssa K.; Marwitz, Alexander C.; Sanz, Lulio A.; Lee Ayscue, R.; Bertke, Jeffery A.; Knope, Karah E. Synthesis, structural characterization, and luminescence properties of heteroleptic bismuth-organic compounds CrystEngComm, 2021, 23, 8183-8197
7243809	CIF	C24 H18 Eu2 N6 O10	P 1 21/n 1	7.422; 25.734; 13.2847 90; 100.008; 90	2498.7	Hassan, Sadaf ul; Farid, Muhammad Asim; Wang, Yingxia A series of lanthanide–quinoxaline-2,3(1H,4H)-dione complexes containing 1D chiral Ln2O3 (Ln = Eu, Tb, Sm, Dy) chains: luminescent properties and response to small molecules RSC Advances, 2021, 11, 33309-33318
7243810	CIF	C18 H12 F6 N2 O	P -1	8.6416; 11.0188; 18.0722 93.734; 90.935; 95.221	1709.6	Shchegolkov, Evgeny V.; Burgart, Yanina V.; Matsneva, Daria A.; Borisevich, Sophia S.; Kadyrova, Renata A.; Orshanskaya, Iana R.; Zarubaev, Vladimir V.; Saloutin, Victor I. Polyfluoroalkylated antipyrines in Pd-catalyzed transformations RSC Advances, 2021, 11, 35174-35181
7243818	CIF	C3 H12 O12 Sc	P -1	7.8876; 8.3604; 9.668 65.082; 76.419; 73.429	549.34	Liu, Rui; Jiang, Yansong; Gong, Yiran; Fu, Yu; Shen, Jieyu; Wang, Li; Fan, Yong; Guo, Yupeng; Xu, Jianing Two scandium-based coordination polymers: rapid ultrasound-assisted synthesis, crystal transformation, and catalytic properties CrystEngComm, 2021, 23, 7813-7821
7243819	CIF	C52 H102 K4 Mo12 N2 O64 Si	P 1 21/n 1	13.9162; 25.5541; 14.1871 90; 106.461; 90	4838.4	Shi, Jianhang; Zhang, Hongxu; Wang, Peisen; Wang, Pai; Zha, Junjie; Liu, Yi; Gautam, Jagadis; Zhang, Lu-Nan; Wang, Yue; Xie, Ju; Ni, Lubin; Diao, Guowang; Wei, Yongge Inorganic–organic hybrid supramolecular architectures based on Keggin polyoxometalates and crown ether: synthesis, crystal structure and electrochemical properties CrystEngComm, 2021, 23, 8482-8489
7243820	CIF	C52 H102 K4 N2 O64 Si W12	P 1 21/n 1	13.9948; 25.5334; 14.1995 90; 106.73; 90	4859.2	Shi, Jianhang; Zhang, Hongxu; Wang, Peisen; Wang, Pai; Zha, Junjie; Liu, Yi; Gautam, Jagadis; Zhang, Lu-Nan; Wang, Yue; Xie, Ju; Ni, Lubin; Diao, Guowang; Wei, Yongge Inorganic–organic hybrid supramolecular architectures based on Keggin polyoxometalates and crown ether: synthesis, crystal structure and electrochemical properties CrystEngComm, 2021, 23, 8482-8489
7243821	CIF	C18 H18 Br4 I2 N4 O2	P -1	7.057; 12.6851; 14.8883 80.126; 77.986; 76.607	1257.45	Milašinović, Valentina; Molčanov, Krešimir Novel co-crystals with π-hole interactions between iodide anions and quinoid rings involving charge transfer CrystEngComm, 2021, 23, 8209-8214
7243822	CIF	C18 H16 Br4 Cl0 I2 N2 O2	P 1 21/c 1	15.4807; 9.1376; 17.3524 90; 91.217; 90	2454.06	Milašinović, Valentina; Molčanov, Krešimir Novel co-crystals with π-hole interactions between iodide anions and quinoid rings involving charge transfer CrystEngComm, 2021, 23, 8209-8214
7243823	CIF	C15 H14 Br2 Cl2 I2 N2 O	P 1 21/a 1	10.9816; 15.6952; 13.8514 90; 110.729; 90	2232.86	Milašinović, Valentina; Molčanov, Krešimir Novel co-crystals with π-hole interactions between iodide anions and quinoid rings involving charge transfer CrystEngComm, 2021, 23, 8209-8214
7243824	CIF	C20 H18 Br4 Cl2 I2 N2 O2	P -1	8.5741; 9.1611; 9.2506 105.323; 94.024; 95.605	693.94	Milašinović, Valentina; Molčanov, Krešimir Novel co-crystals with π-hole interactions between iodide anions and quinoid rings involving charge transfer CrystEngComm, 2021, 23, 8209-8214
7243825	CIF	C20 H30 Br4 I2 N4 O2	P b a m	13.9401; 13.8771; 7.6055 90; 90; 90	1471.27	Milašinović, Valentina; Molčanov, Krešimir Novel co-crystals with π-hole interactions between iodide anions and quinoid rings involving charge transfer CrystEngComm, 2021, 23, 8209-8214
7243826	CIF	C9 H8 Br2 I N O	P 1 21/c 1	7.773; 9.519; 17.246 90; 91.254; 90	1275.7	Milašinović, Valentina; Molčanov, Krešimir Novel co-crystals with π-hole interactions between iodide anions and quinoid rings involving charge transfer CrystEngComm, 2021, 23, 8209-8214
7243827	CIF	C29 H15 N5	P -1	6.95; 7.941; 21.253 96.36; 93.79; 101.98	1135.5	Khan, Arshad; Usman, Rabia; Li, Rongrong; Hajji, Melek; Tang, Haiming; Ma, Di Polycyclic motif engineering in cyanostilbene-based donors towards highly efficient modulable emission properties in two-component systems CrystEngComm, 2021, 23, 8462-8470
7243828	CIF	C2.82 H1.64 N0.27	P -1	9.951; 11.055; 11.472 61.503; 81.14; 82.377	1093.3	Khan, Arshad; Usman, Rabia; Li, Rongrong; Hajji, Melek; Tang, Haiming; Ma, Di Polycyclic motif engineering in cyanostilbene-based donors towards highly efficient modulable emission properties in two-component systems CrystEngComm, 2021, 23, 8462-8470
7243829	CIF	C29 H18 N3	P 1 21/n 1	14.271; 10.228; 14.842 90; 98.44; 90	2142.9	Khan, Arshad; Usman, Rabia; Li, Rongrong; Hajji, Melek; Tang, Haiming; Ma, Di Polycyclic motif engineering in cyanostilbene-based donors towards highly efficient modulable emission properties in two-component systems CrystEngComm, 2021, 23, 8462-8470
7243830	CIF	C43 H34 N2 O9.56	P 1 21/c 1	11.6758; 9.9495; 31.6357 90; 94.133; 90	3665.5	Xiao, Cheng-Quan; Yi, Wen-Hai; Hu, Jun-Jie; Liu, Sui-Jun; Wen, He-Rui Stable hydrogen-bonded organic frameworks for selective fluorescence detection of Al3+ and Fe3+ ions CrystEngComm, 2021, 23, 8334-8342
7243831	CIF	C43 H35 N2 O9	P 1 21/n 1	11.5248; 9.7579; 33.3652 90; 95.796; 90	3733	Xiao, Cheng-Quan; Yi, Wen-Hai; Hu, Jun-Jie; Liu, Sui-Jun; Wen, He-Rui Stable hydrogen-bonded organic frameworks for selective fluorescence detection of Al3+ and Fe3+ ions CrystEngComm, 2021, 23, 8334-8342
7243832	CIF	C43.59 H33.41 N2.59 O8.41	P 1 21/n 1	11.1855; 9.8257; 33.0145 90; 92.215; 90	3625.76	Xiao, Cheng-Quan; Yi, Wen-Hai; Hu, Jun-Jie; Liu, Sui-Jun; Wen, He-Rui Stable hydrogen-bonded organic frameworks for selective fluorescence detection of Al3+ and Fe3+ ions CrystEngComm, 2021, 23, 8334-8342
7243833	CIF	C86 H74 N4 O19	P 1 21/c 1	11.8376; 9.829; 31.8542 90; 95.889; 90	3686.7	Xiao, Cheng-Quan; Yi, Wen-Hai; Hu, Jun-Jie; Liu, Sui-Jun; Wen, He-Rui Stable hydrogen-bonded organic frameworks for selective fluorescence detection of Al3+ and Fe3+ ions CrystEngComm, 2021, 23, 8334-8342
7243834	CIF	C30 H49 N5 O4	P 1	7.1986; 7.591; 28.718 84.702; 89.324; 80.32	1540.3	Polacchi, Luca; Brosseau, Arnaud; Guillot, Régis; Métivier, Rémi; Allain, Clémence Enhanced mechano-responsive fluorescence in polydiacetylene thin films through functionalization with tetrazine dyes: photopolymerization, energy transfer and AFM coupled to fluorescence microscopy studies Physical Chemistry Chemical Physics, 2021
7243835	CIF	C44 H89 O8 P2	P 1 21/n 1	21.43; 13.5076; 9.2943 90; 113.17; 90	2473.4	Haneda, Tsuyoshi; Matsuno, Shinya; Yamamoto, Hisanao; Ohtsu, Hiroyoshi; Kawano, Masaki Latency control of chemical reactions in polymerization of epoxy resins using a hydrogen bonding network CrystEngComm, 2021, 23, 7717-7719
7243836	CIF	C48 H81 O8 P2	P -1	13.8216; 10.531; 9.538 83.576; 93.435; 109.149	1302.86	Haneda, Tsuyoshi; Matsuno, Shinya; Yamamoto, Hisanao; Ohtsu, Hiroyoshi; Kawano, Masaki Latency control of chemical reactions in polymerization of epoxy resins using a hydrogen bonding network CrystEngComm, 2021, 23, 7717-7719
7243837	CIF	C21 O4 P	C c c a :2	19.5817; 19.58544; 12.02036 90; 90; 90	4610	Haneda, Tsuyoshi; Matsuno, Shinya; Yamamoto, Hisanao; Ohtsu, Hiroyoshi; Kawano, Masaki Latency control of chemical reactions in polymerization of epoxy resins using a hydrogen bonding network CrystEngComm, 2021, 23, 7717-7719
7243838	CIF	C22 H45 O4 P	C 1 2/c 1	9.3115; 13.0344; 19.6397 90; 91.56; 90	2382.78	Haneda, Tsuyoshi; Matsuno, Shinya; Yamamoto, Hisanao; Ohtsu, Hiroyoshi; Kawano, Masaki Latency control of chemical reactions in polymerization of epoxy resins using a hydrogen bonding network CrystEngComm, 2021, 23, 7717-7719
7243839	CIF	C42 H76 O8 P2	C c c a :2	19.1921; 20.0035; 11.7616 90; 90; 90	4515.4	Haneda, Tsuyoshi; Matsuno, Shinya; Yamamoto, Hisanao; Ohtsu, Hiroyoshi; Kawano, Masaki Latency control of chemical reactions in polymerization of epoxy resins using a hydrogen bonding network CrystEngComm, 2021, 23, 7717-7719
7243840	CIF	C24 H41 O4 P	P -1	9.5325; 10.0097; 13.4783 74.634; 87.007; 81.876	1227.5	Haneda, Tsuyoshi; Matsuno, Shinya; Yamamoto, Hisanao; Ohtsu, Hiroyoshi; Kawano, Masaki Latency control of chemical reactions in polymerization of epoxy resins using a hydrogen bonding network CrystEngComm, 2021, 23, 7717-7719
7243841	CIF	C16 H25 O4 P	C 1 2/c 1	15.9106; 14.2542; 15.9668 90; 95.032; 90	3607.2	Haneda, Tsuyoshi; Matsuno, Shinya; Yamamoto, Hisanao; Ohtsu, Hiroyoshi; Kawano, Masaki Latency control of chemical reactions in polymerization of epoxy resins using a hydrogen bonding network CrystEngComm, 2021, 23, 7717-7719
7243842	CIF	C23 H22 I N O4	P 1 21/c 1	15.4121; 8.5604; 15.8404 90; 98.365; 90	2067.65	Wei, Xiaohui; Liang, Xuewu; Li, Yazhou; Liu, Qi; Liu, Xuyi; Zhou, Yu; Liu, Hong I2-induced cascade cyclization and dearomatization of indoles for the highly efficient synthesis of iodinated and vinylic spiroindolenines Green Chemistry, 2021, 23, 9165-9171
7243843	CIF	C25 H25 N O4	P 1 21/n 1	9.216; 21.035; 10.878 90; 98.207; 90	2087.2	Wei, Xiaohui; Liang, Xuewu; Li, Yazhou; Liu, Qi; Liu, Xuyi; Zhou, Yu; Liu, Hong I2-induced cascade cyclization and dearomatization of indoles for the highly efficient synthesis of iodinated and vinylic spiroindolenines Green Chemistry, 2021, 23, 9165-9171
7243844	CIF	C23 H22 I N O4	P 1 21/c 1	8.0055; 15.3728; 17.6184 90; 101.571; 90	2124.18	Wei, Xiaohui; Liang, Xuewu; Li, Yazhou; Liu, Qi; Liu, Xuyi; Zhou, Yu; Liu, Hong I2-induced cascade cyclization and dearomatization of indoles for the highly efficient synthesis of iodinated and vinylic spiroindolenines Green Chemistry, 2021, 23, 9165-9171
7243845	CIF	C32 H63 N O3	P c a 21	8.7755; 4.8774; 72.679 90; 90; 90	3110.8	Reddy, Soudherpally Thirupathi; Sivaramakrishna, Dokku; Mamatha, Keerthi; Sharma, Manju; Swamy, Musti J. Packing polymorphism, odd–even alternation and thermotropic phase transitions in N-,O-diacylethanolamines with varying N-acyl chains. A combined experimental and computational study Physical Chemistry Chemical Physics, 2021
7243846	CIF	C29 H55 N O3	C 1 2/c 1	135.24; 4.8798; 8.7392 90; 91.27; 90	5766	Reddy, Soudherpally Thirupathi; Sivaramakrishna, Dokku; Mamatha, Keerthi; Sharma, Manju; Swamy, Musti J. Packing polymorphism, odd–even alternation and thermotropic phase transitions in N-,O-diacylethanolamines with varying N-acyl chains. A combined experimental and computational study Physical Chemistry Chemical Physics, 2021
7243847	CIF	C31 H61 N O3	C 1 2/c 1	144.31; 4.888; 8.748 90; 91.444; 90	6169	Reddy, Soudherpally Thirupathi; Sivaramakrishna, Dokku; Mamatha, Keerthi; Sharma, Manju; Swamy, Musti J. Packing polymorphism, odd–even alternation and thermotropic phase transitions in N-,O-diacylethanolamines with varying N-acyl chains. A combined experimental and computational study Physical Chemistry Chemical Physics, 2021
7243848	CIF	C2 H3.93 N0.07 O0.2	P 1 21/c 1	68.97; 4.852; 8.906 90; 92.787; 90	2977	Reddy, Soudherpally Thirupathi; Sivaramakrishna, Dokku; Mamatha, Keerthi; Sharma, Manju; Swamy, Musti J. Packing polymorphism, odd–even alternation and thermotropic phase transitions in N-,O-diacylethanolamines with varying N-acyl chains. A combined experimental and computational study Physical Chemistry Chemical Physics, 2021
7243849	CIF	C31 H60 N O3	C 1 2/c 1	143.4; 4.8764; 8.7342 90; 91.137; 90	6106.4	Reddy, Soudherpally Thirupathi; Sivaramakrishna, Dokku; Mamatha, Keerthi; Sharma, Manju; Swamy, Musti J. Packing polymorphism, odd–even alternation and thermotropic phase transitions in N-,O-diacylethanolamines with varying N-acyl chains. A combined experimental and computational study Physical Chemistry Chemical Physics, 2021
7243850	CIF	C15 H18 N2 O3 S	C 1 2/c 1	18.2332; 7.3341; 25.197 90; 101.888; 90	3297.2	Dowarah, Jayanta; Patel, Devanshi; Marak, Brilliant N.; Yadav, Umesh Chand Singh; Shah, Pramod Kumar; Shukla, Pradeep Kumar; Singh, Ved Prakash Green synthesis, structural analysis and anticancer activity of dihydropyrimidinone derivatives RSC Advances, 2021, 11, 35737-35753
7243851	CIF	C14 H15 Cl N2 O2 S	P -1	7.3066; 10.4657; 10.6788 107.568; 90.583; 107.829	736.37	Dowarah, Jayanta; Patel, Devanshi; Marak, Brilliant N.; Yadav, Umesh Chand Singh; Shah, Pramod Kumar; Shukla, Pradeep Kumar; Singh, Ved Prakash Green synthesis, structural analysis and anticancer activity of dihydropyrimidinone derivatives RSC Advances, 2021, 11, 35737-35753
7243852	CIF	C15 H18 N2 O2 S	P -1	7.3603; 9.4648; 12.2076 74.216; 88.729; 69.819	765.7	Dowarah, Jayanta; Patel, Devanshi; Marak, Brilliant N.; Yadav, Umesh Chand Singh; Shah, Pramod Kumar; Shukla, Pradeep Kumar; Singh, Ved Prakash Green synthesis, structural analysis and anticancer activity of dihydropyrimidinone derivatives RSC Advances, 2021, 11, 35737-35753
7243853	CIF	C16 H10 F N O2	P 1 21/n 1	5.77617; 28.7775; 7.41435 90; 95.123; 90	1227.52	Aksenov, Alexander V.; Aksenov, Nicolai A.; Kirilov, Nikita K.; Skomorokhov, Anton A.; Aksenov, Dmitrii A.; Kurenkov, Igor A.; Sorokina, Elena A.; Nobi, Mezvah A.; Rubin, Michael Does electrophilic activation of nitroalkanes in polyphosphoric acid involve formation of nitrile oxides? RSC Advances, 2021, 11, 35937-35945
7243854	CIF	C34 H55 N5 O8	P 21 21 21	9.5985; 23.0985; 16.6315 90; 90; 90	3687.4	Nandi, Sujay Kumar; Mondal, Saikat; Mondal, Sahabaj; Gumtya, Milan; Haldar, Debasish Structure–mechanical property relationship of a pentapeptide crystal CrystEngComm, 2021, 23, 8093-8098
7243855	CIF	C22 H19 N O3 S Se	P 1 21/n 1	9.4942; 18.7603; 11.8071 90; 112.137; 90	1948	Liu, Gong-Qing; Zhou, Chen-Fan; Zhang, Yun-Qian; Yi, Wei; Wang, Peng-Fei; Liu, Ji; Ling, Yong Visible-light-induced intermolecular aminoselenation of alkenes Green Chemistry, 2021, 23, 9968-9973
7243856	CIF	C24 H21 N O3 S Se	P 1 21/c 1	14.6984; 11.124; 14.3493 90; 117.396; 90	2083.1	Liu, Gong-Qing; Zhou, Chen-Fan; Zhang, Yun-Qian; Yi, Wei; Wang, Peng-Fei; Liu, Ji; Ling, Yong Visible-light-induced intermolecular aminoselenation of alkenes Green Chemistry, 2021, 23, 9968-9973
7243857	CIF	C24 H29 N O2 S Se	P 1 21 1	9.8465; 23.1935; 10.1145 90; 108.968; 90	2184.5	Liu, Gong-Qing; Zhou, Chen-Fan; Zhang, Yun-Qian; Yi, Wei; Wang, Peng-Fei; Liu, Ji; Ling, Yong Visible-light-induced intermolecular aminoselenation of alkenes Green Chemistry, 2021, 23, 9968-9973
7243858	CIF	C97 H86 N10 Nd2 O32 Zn6	P 1 21/n 1	20.327; 23.139; 25.376 90; 94.941; 90	11891	Niu, Mengyu; Yang, Xiaoping; Ma, Yanan; Wang, Chengri; Schipper, Desmond NIR luminescent detection of quercetin based on an octanuclear Zn(ii)–Nd(iii) salen nanocluster RSC Advances, 2021, 11, 35893-35897
7243861	CIF	C38 H26 Cd N6 O10	P 1 21/n 1	13.0139; 8.364; 15.6352 90; 105.259; 90	1641.87	Chen, Yaxuan; Liu, Guocheng; Wang, Xiuli; Lu, Xue; Xu, Na; Chang, Zhihan; Zhang, Zhong; Li, Xiaohui Various carboxylates induced eight Zn(ii)/Cd(ii) coordination polymers with fluorescence sensing activities for Fe(iii), Cr(vi) and oxytetracycline CrystEngComm, 2021, 23, 8077-8086
7243862	CIF	C32 H25 Cd N5 O9	P -1	7.4456; 10.0938; 20.1002 80.984; 81.683; 87.5	1475.9	Chen, Yaxuan; Liu, Guocheng; Wang, Xiuli; Lu, Xue; Xu, Na; Chang, Zhihan; Zhang, Zhong; Li, Xiaohui Various carboxylates induced eight Zn(ii)/Cd(ii) coordination polymers with fluorescence sensing activities for Fe(iii), Cr(vi) and oxytetracycline CrystEngComm, 2021, 23, 8077-8086
7243863	CIF	C21 H18 Cd N2 O6	P -1	8.604; 10.136; 11.831 90.865; 101.993; 101.402	987.6	Chen, Yaxuan; Liu, Guocheng; Wang, Xiuli; Lu, Xue; Xu, Na; Chang, Zhihan; Zhang, Zhong; Li, Xiaohui Various carboxylates induced eight Zn(ii)/Cd(ii) coordination polymers with fluorescence sensing activities for Fe(iii), Cr(vi) and oxytetracycline CrystEngComm, 2021, 23, 8077-8086
7243864	CIF	C44 H42 Cd3 N4 O16	P 1 21/c 1	6.8068; 22.8205; 14.2425 90; 92.986; 90	2209.35	Chen, Yaxuan; Liu, Guocheng; Wang, Xiuli; Lu, Xue; Xu, Na; Chang, Zhihan; Zhang, Zhong; Li, Xiaohui Various carboxylates induced eight Zn(ii)/Cd(ii) coordination polymers with fluorescence sensing activities for Fe(iii), Cr(vi) and oxytetracycline CrystEngComm, 2021, 23, 8077-8086
7243865	CIF	C33 H26 N4 O6 Zn	P -1	9.033; 9.906; 19.233 98.94; 96.928; 115.762	1496.5	Chen, Yaxuan; Liu, Guocheng; Wang, Xiuli; Lu, Xue; Xu, Na; Chang, Zhihan; Zhang, Zhong; Li, Xiaohui Various carboxylates induced eight Zn(ii)/Cd(ii) coordination polymers with fluorescence sensing activities for Fe(iii), Cr(vi) and oxytetracycline CrystEngComm, 2021, 23, 8077-8086
7243866	CIF	C40 H20 Cd2 Cl8 N4 O10	P -1	4.8119; 12.3498; 34.966 90.387; 93.527; 93.29	2070.4	Chen, Yaxuan; Liu, Guocheng; Wang, Xiuli; Lu, Xue; Xu, Na; Chang, Zhihan; Zhang, Zhong; Li, Xiaohui Various carboxylates induced eight Zn(ii)/Cd(ii) coordination polymers with fluorescence sensing activities for Fe(iii), Cr(vi) and oxytetracycline CrystEngComm, 2021, 23, 8077-8086
7243867	CIF	C32 H26 Cd N4 O8	C 1 2/c 1	21.4405; 10.1496; 27.784 90; 108.755; 90	5725.1	Chen, Yaxuan; Liu, Guocheng; Wang, Xiuli; Lu, Xue; Xu, Na; Chang, Zhihan; Zhang, Zhong; Li, Xiaohui Various carboxylates induced eight Zn(ii)/Cd(ii) coordination polymers with fluorescence sensing activities for Fe(iii), Cr(vi) and oxytetracycline CrystEngComm, 2021, 23, 8077-8086
7243868	CIF	C3.62 H3.12 N0.5 O Zn0.12	P -1	8.609; 9.6249; 17.9177 97.561; 94.156; 116.185	1306.43	Chen, Yaxuan; Liu, Guocheng; Wang, Xiuli; Lu, Xue; Xu, Na; Chang, Zhihan; Zhang, Zhong; Li, Xiaohui Various carboxylates induced eight Zn(ii)/Cd(ii) coordination polymers with fluorescence sensing activities for Fe(iii), Cr(vi) and oxytetracycline CrystEngComm, 2021, 23, 8077-8086
7243869	CIF	C72 H76 Cl4 Mn N8 O22 Zr6	P -1	11.1927; 12.9714; 21.8377 80.98; 77.033; 76.035	2980.6	Wang, Ying; Fu, Yaomei; You, Siqi; Li, Xuexin; Zhao, Liang; Qin, Chao; Wang, Xinlong Two Zr-based heterometal–organic frameworks for efficient CO2 reduction under visible light CrystEngComm, 2021, 23, 8115-8120
7243870	CIF	C36 H52 Cl3 N4 Ni O19 Zr3	P 21 21 21	10.51; 16.988; 29.61 90; 90; 90	5287	Wang, Ying; Fu, Yaomei; You, Siqi; Li, Xuexin; Zhao, Liang; Qin, Chao; Wang, Xinlong Two Zr-based heterometal–organic frameworks for efficient CO2 reduction under visible light CrystEngComm, 2021, 23, 8115-8120
7243871	CIF	C70 H81 Mn6 N12 Na3 O47	R -3 :H	16.9618; 16.9618; 28.201 90; 90; 120	7026.5	Wu, Yan-Fang; Hu, Zhao-Bo; Quan, Lixia; Jing, Leina; Zhang, Jinlei; Chen, Zilu Single-molecule magnet achieved through topological tuning with sodium ions CrystEngComm, 2021, 23, 8490-8497
7243872	CIF	C38 H39 Mn3 N8 O24	P -1	11.6155; 13.4396; 16.6802 86.026; 75.057; 85.102	2503.64	Wu, Yan-Fang; Hu, Zhao-Bo; Quan, Lixia; Jing, Leina; Zhang, Jinlei; Chen, Zilu Single-molecule magnet achieved through topological tuning with sodium ions CrystEngComm, 2021, 23, 8490-8497
7243873	CIF	C45 H51 Mn3 N6 Na2 O21	P -1	13.502; 14.1079; 15.3728 84.81; 68.896; 77.273	2664.6	Wu, Yan-Fang; Hu, Zhao-Bo; Quan, Lixia; Jing, Leina; Zhang, Jinlei; Chen, Zilu Single-molecule magnet achieved through topological tuning with sodium ions CrystEngComm, 2021, 23, 8490-8497
7243874	CIF	C10 H13 N O4 S3	P n a 21	12.8766; 6.3085; 16.9497 90; 90; 90	1376.86	Gong, Kai; Zhou, Yilin; Jiang, Xuefeng From symmetrical tetrasulfides to trisulfide dioxides via photocatalysis Green Chemistry, 2021, 23, 9865-9869
7243875	CIF	C16 H12 O5	P 1 21/n 1	7.0308; 14.1809; 24.9877 90; 92.536; 90	2488.91	Goel, Narender; Gajbhiye, Rahul L.; Saha, Moumita; Nagendra, Chennuru; Reddy, Araveeti Madhusudhana; Ravichandiran, V.; Das Saha, Krishna; Jaisankar, Parasuraman A comparative assessment of in vitro cytotoxic activity and phytochemical profiling of Andrographis nallamalayana J.L.Ellis and Andrographis paniculata (Burm. f.) Nees using UPLC-QTOF-MS/MS approach RSC Advances, 2021, 11, 35918-35936
7243876	CIF	C23 H26 O12	P 1 21 1	11.5283; 8.0352; 24.3766 90; 103.495; 90	2195.7	Goel, Narender; Gajbhiye, Rahul L.; Saha, Moumita; Nagendra, Chennuru; Reddy, Araveeti Madhusudhana; Ravichandiran, V.; Das Saha, Krishna; Jaisankar, Parasuraman A comparative assessment of in vitro cytotoxic activity and phytochemical profiling of Andrographis nallamalayana J.L.Ellis and Andrographis paniculata (Burm. f.) Nees using UPLC-QTOF-MS/MS approach RSC Advances, 2021, 11, 35918-35936
7243877	CIF	C17 H14 O6	P 1 21/c 1	4.921; 21.735; 13.1847 90; 96.263; 90	1401.8	Goel, Narender; Gajbhiye, Rahul L.; Saha, Moumita; Nagendra, Chennuru; Reddy, Araveeti Madhusudhana; Ravichandiran, V.; Das Saha, Krishna; Jaisankar, Parasuraman A comparative assessment of in vitro cytotoxic activity and phytochemical profiling of Andrographis nallamalayana J.L.Ellis and Andrographis paniculata (Burm. f.) Nees using UPLC-QTOF-MS/MS approach RSC Advances, 2021, 11, 35918-35936
7243878	CIF	C39 H48 Cl2 Dy N9 O4	P -1	12.765; 12.8233; 14.6204 76.975; 64.278; 68.218	1996.2	Chen, Bo-Yi; Tsai, Min-Yem; Su, Yu-Chia; Lin, Po-Heng; Long, Jérôme Synthesis, structures and magnetic properties of dysprosium(iii) complexes based on amino-bis(benzotriazole phenolate) and nitrophenolates: influence over the slow relaxation of the magnetization CrystEngComm, 2021, 23, 8343-8350
7243879	CIF	C41 H43 Dy N10 O10	P -1	9.1671; 11.9694; 19.5627 84.62; 84.325; 88.419	2126.2	Chen, Bo-Yi; Tsai, Min-Yem; Su, Yu-Chia; Lin, Po-Heng; Long, Jérôme Synthesis, structures and magnetic properties of dysprosium(iii) complexes based on amino-bis(benzotriazole phenolate) and nitrophenolates: influence over the slow relaxation of the magnetization CrystEngComm, 2021, 23, 8343-8350
7243880	CIF	C40 H42 Dy N11 O11	P -1	9.2418; 11.8854; 19.2808 81.334; 82.417; 88.254	2075.24	Chen, Bo-Yi; Tsai, Min-Yem; Su, Yu-Chia; Lin, Po-Heng; Long, Jérôme Synthesis, structures and magnetic properties of dysprosium(iii) complexes based on amino-bis(benzotriazole phenolate) and nitrophenolates: influence over the slow relaxation of the magnetization CrystEngComm, 2021, 23, 8343-8350
7243881	CIF	C40 H43 Dy N10 O9	P 1 21/c 1	11.8504; 9.1104; 37.8203 90; 97.811; 90	4045.3	Chen, Bo-Yi; Tsai, Min-Yem; Su, Yu-Chia; Lin, Po-Heng; Long, Jérôme Synthesis, structures and magnetic properties of dysprosium(iii) complexes based on amino-bis(benzotriazole phenolate) and nitrophenolates: influence over the slow relaxation of the magnetization CrystEngComm, 2021, 23, 8343-8350
7243882	CIF	C163 H183 B2 Dy2 O14 Si4	C 1 2/c 1	46.8542; 18.1479; 18.2239 90; 112.584; 90	14307.6	Long, Jérôme; Tolpygin, Aleksei O.; Cherkasov, Anton V.; Nelyubina, Yulia V.; Guari, Yannick; Larionova, Joulia; Trifonov, Alexander A. Tuning the coordination sphere of octahedral Dy(iii) complexes with silanolate/stannanolate ligands: synthesis, structures and slow relaxation of the magnetization CrystEngComm, 2021, 23, 8351-8359
7243883	CIF	C70 H77 Dy O7 Si3	P 1 21 1	14.334; 16.468; 14.54 90; 113.635; 90	3144.3	Long, Jérôme; Tolpygin, Aleksei O.; Cherkasov, Anton V.; Nelyubina, Yulia V.; Guari, Yannick; Larionova, Joulia; Trifonov, Alexander A. Tuning the coordination sphere of octahedral Dy(iii) complexes with silanolate/stannanolate ligands: synthesis, structures and slow relaxation of the magnetization CrystEngComm, 2021, 23, 8351-8359
7243884	CIF	C72 H69 Dy N2 O5 Si3	P 1 21 1	14.2745; 16.2901; 15.0762 90; 115.806; 90	3156.1	Long, Jérôme; Tolpygin, Aleksei O.; Cherkasov, Anton V.; Nelyubina, Yulia V.; Guari, Yannick; Larionova, Joulia; Trifonov, Alexander A. Tuning the coordination sphere of octahedral Dy(iii) complexes with silanolate/stannanolate ligands: synthesis, structures and slow relaxation of the magnetization CrystEngComm, 2021, 23, 8351-8359
7243885	CIF	C82 H96 B Dy O6 Sn2	P -1	14.2076; 14.4956; 20.1298 75.221; 83.003; 64.803	3626.7	Long, Jérôme; Tolpygin, Aleksei O.; Cherkasov, Anton V.; Nelyubina, Yulia V.; Guari, Yannick; Larionova, Joulia; Trifonov, Alexander A. Tuning the coordination sphere of octahedral Dy(iii) complexes with silanolate/stannanolate ligands: synthesis, structures and slow relaxation of the magnetization CrystEngComm, 2021, 23, 8351-8359
7243886	CIF	C45 H93 Ag2 Mo8 N9 O27	P -1	16.5639; 17.9149; 25.3059 104.626; 106.317; 91.236	6938.6	Abramov, Pavel A.; Komarov, Vladislav Yu.; Pischur, Denis A.; Sulyaeva, Veronica S.; Benassi, Enrico; Sokolov, Maxim N. Solvatomorphs of (Bu4N)2[{Ag(N2-py)}2Mo8O26]: structure, colouration and phase transition CrystEngComm, 2021, 23, 8527-8537
7243887	CIF	C42 H86 Ag2 Mo8 N8 O26	P b c a	17.5214; 16.1843; 23.4644 90; 90; 90	6653.8	Abramov, Pavel A.; Komarov, Vladislav Yu.; Pischur, Denis A.; Sulyaeva, Veronica S.; Benassi, Enrico; Sokolov, Maxim N. Solvatomorphs of (Bu4N)2[{Ag(N2-py)}2Mo8O26]: structure, colouration and phase transition CrystEngComm, 2021, 23, 8527-8537
7243888	CIF	C45 H93 Ag2 Mo8 N9 O27	P -1	12.9493; 16.7502; 18.016 88.198; 74.295; 68.962	3501.7	Abramov, Pavel A.; Komarov, Vladislav Yu.; Pischur, Denis A.; Sulyaeva, Veronica S.; Benassi, Enrico; Sokolov, Maxim N. Solvatomorphs of (Bu4N)2[{Ag(N2-py)}2Mo8O26]: structure, colouration and phase transition CrystEngComm, 2021, 23, 8527-8537
7243893	CIF	C22 H19 Cl F N4 O2 S	P 1 21/n 1	7.17026; 21.7971; 13.6848 90; 98.637; 90	2114.55	Guo, Sheng-Qiang; Yang, Hui-Qing; Wang, Ai-Lian; Jiang, Yu-Zhen; Xu, Guo-Qiang; Luo, Yong-Chun; Chen, Zhao-Xu; Xu, Peng-Fei Divergent Ritter-type amination via photoredox catalytic four-component radical-polar crossover reactions Green Chemistry, 2021, 23, 9571-9576
7243894	CIF	C23 H20 Cl N O4 S	P 1 21/c 1	12.7213; 10.0584; 17.2909 90; 106.273; 90	2123.84	Guo, Sheng-Qiang; Yang, Hui-Qing; Wang, Ai-Lian; Jiang, Yu-Zhen; Xu, Guo-Qiang; Luo, Yong-Chun; Chen, Zhao-Xu; Xu, Peng-Fei Divergent Ritter-type amination via photoredox catalytic four-component radical-polar crossover reactions Green Chemistry, 2021, 23, 9571-9576
7243895	CIF	C25 H25 N O4 S	I 1 2/a 1	19.8661; 9.09317; 25.7813 90; 109.671; 90	4385.48	Guo, Sheng-Qiang; Yang, Hui-Qing; Wang, Ai-Lian; Jiang, Yu-Zhen; Xu, Guo-Qiang; Luo, Yong-Chun; Chen, Zhao-Xu; Xu, Peng-Fei Divergent Ritter-type amination via photoredox catalytic four-component radical-polar crossover reactions Green Chemistry, 2021, 23, 9571-9576
7243896	CIF	C23 H22 N4 O2 S	P b c a	8.65981; 17.7339; 27.7046 90; 90; 90	4254.66	Guo, Sheng-Qiang; Yang, Hui-Qing; Wang, Ai-Lian; Jiang, Yu-Zhen; Xu, Guo-Qiang; Luo, Yong-Chun; Chen, Zhao-Xu; Xu, Peng-Fei Divergent Ritter-type amination via photoredox catalytic four-component radical-polar crossover reactions Green Chemistry, 2021, 23, 9571-9576
7243897	CIF	C36 H29 Eu N2 O6 S3	P -1	9.1817; 13.0615; 15.0182 96.107; 92.85; 104.079	1731.72	Varaksina, Evgeniya A.; Kiskin, Mikhail A.; Lyssenko, Konstantin A.; Puntus, Lada N.; Korshunov, Vladislav M.; Silva, Gustavo S.; Freire, Ricardo O.; Taydakov, Ilya V. Tuning the luminescence efficiency by perfluorination of side chains in Eu3+ complexes with β-diketones of the thiophene series Physical Chemistry Chemical Physics, 2021
7243898	CIF	C36 H23 Eu F6 N2 O6 S3	P -1	9.4489; 13.2007; 14.8576 90.152; 94.059; 102.044	1807.6	Varaksina, Evgeniya A.; Kiskin, Mikhail A.; Lyssenko, Konstantin A.; Puntus, Lada N.; Korshunov, Vladislav M.; Silva, Gustavo S.; Freire, Ricardo O.; Taydakov, Ilya V. Tuning the luminescence efficiency by perfluorination of side chains in Eu3+ complexes with β-diketones of the thiophene series Physical Chemistry Chemical Physics, 2021
7243899	CIF	C42 H20 Eu F21 N2 O6 S3	P b c a	20.6112; 17.9832; 25.1758 90; 90; 90	9331.5	Varaksina, Evgeniya A.; Kiskin, Mikhail A.; Lyssenko, Konstantin A.; Puntus, Lada N.; Korshunov, Vladislav M.; Silva, Gustavo S.; Freire, Ricardo O.; Taydakov, Ilya V. Tuning the luminescence efficiency by perfluorination of side chains in Eu3+ complexes with β-diketones of the thiophene series Physical Chemistry Chemical Physics, 2021
7243900	CIF	C39 H26 Eu F9 N2 O7 S3	P 1 21 1	9.8914; 10.6986; 38.1886 90; 89.992; 90	4041.3	Varaksina, Evgeniya A.; Kiskin, Mikhail A.; Lyssenko, Konstantin A.; Puntus, Lada N.; Korshunov, Vladislav M.; Silva, Gustavo S.; Freire, Ricardo O.; Taydakov, Ilya V. Tuning the luminescence efficiency by perfluorination of side chains in Eu3+ complexes with β-diketones of the thiophene series Physical Chemistry Chemical Physics, 2021
7243901	CIF	C45 H20 Eu F27 N2 O6 S3	P -1	15.2499; 15.6839; 22.6048 78.939; 89.664; 79.532	5215.5	Varaksina, Evgeniya A.; Kiskin, Mikhail A.; Lyssenko, Konstantin A.; Puntus, Lada N.; Korshunov, Vladislav M.; Silva, Gustavo S.; Freire, Ricardo O.; Taydakov, Ilya V. Tuning the luminescence efficiency by perfluorination of side chains in Eu3+ complexes with β-diketones of the thiophene series Physical Chemistry Chemical Physics, 2021
7243902	CIF	C25 H23 Fe2 N O3	P -1	5.8955; 12.6957; 15.6399 66.206; 86.515; 80.988	1057.88	Stevanović, Dragana; Bugarinović, Jovana; Pešić, Marko; Todosijević, Anka; Bogdanović, Goran A.; Damljanović, Ivan Chemoselective synthesis of multifunctional ferrocene-containing derivatives by the cross Rauhut–Currier reaction RSC Advances, 2021, 11, 36208-36214
7243903	CIF	C54 H42 N14 Ni	R -3 :H	16.0135; 16.0135; 26.0061 90; 90; 120	5775.4	Li, Bei; Lei, Qingjuan; Qin, Tong; Zhang, Xiaoxian; Zhao, Dongsheng; Wang, Feng; Li, Wenqian; Zhang, Zhengguo; Fan, Liming Anion exchange strategy to improve electrocatalytic hydrogen evolution performances in cationic metal–organic frameworks CrystEngComm, 2021, 23, 8260-8264
7243905	CIF	C108 H84 N18 O36 Zn3	P 65	15.4575; 15.4575; 88.791 90; 90; 120	18373	Park, Junmyeong; Kim, Dongwon; Kim, Dongwook; Jung, Ok-Sang Pair of chiral molecular ladders and successive hydration in single-crystal-to-single-crystal mode CrystEngComm, 2021, 23, 8546-8552
7243906	CIF	C108 H84 N18 O36 Zn3	P 61	15.531; 15.531; 89.937 90; 90; 120	18787	Park, Junmyeong; Kim, Dongwon; Kim, Dongwook; Jung, Ok-Sang Pair of chiral molecular ladders and successive hydration in single-crystal-to-single-crystal mode CrystEngComm, 2021, 23, 8546-8552
7243907	CIF	C108 H88 N18 O38 Zn3	P 65	15.3498; 15.3498; 84.37 90; 90; 120	17215.7	Park, Junmyeong; Kim, Dongwon; Kim, Dongwook; Jung, Ok-Sang Pair of chiral molecular ladders and successive hydration in single-crystal-to-single-crystal mode CrystEngComm, 2021, 23, 8546-8552
7243908	CIF	C108 H84 N18 O38 Zn3	P 61	15.1763; 15.1763; 84.264 90; 90; 120	16807.6	Park, Junmyeong; Kim, Dongwon; Kim, Dongwook; Jung, Ok-Sang Pair of chiral molecular ladders and successive hydration in single-crystal-to-single-crystal mode CrystEngComm, 2021, 23, 8546-8552
7243921	CIF	C15 H5 Cd2 N7 O8	P -1	8.3887; 10.3405; 11.1345 80.652; 89.883; 80.627	940	Li, Jing; Zhao, Yun-Xiu; Wu, Qian; Yang, Hua; Lu, Jing; Ma, Hui-Yan; Wang, Su-Na; Li, Yun-Wu A Cd-MOF fluorescence sensor with dual functional sites for efficient detection of metal ions in multifarious water environments CrystEngComm, 2021, 23, 8392-8403
7243922	CIF	C32 H26 F12 N6 P2 Ru	P 1 21/c 1	13.3118; 18.7973; 13.9779 90; 97.417; 90	3468.37	Tomioka, Nozomi; Nanbu, Shinkoh; Misawa-Suzuki, Tomoyo; Nagao, Hirotaka N–C bond formation between two anilines coordinated to a ruthenium center in cis-form affording a 3,5-cyclohexadiene-1,2-diimine moiety RSC Advances, 2021, 11, 36644-36650
7243923	CIF	C34 H30 F6 N6 O6 Ru S2	P 1 21/n 1	11.2579; 17.1076; 19.0176 90; 95.982; 90	3642.76	Tomioka, Nozomi; Nanbu, Shinkoh; Misawa-Suzuki, Tomoyo; Nagao, Hirotaka N–C bond formation between two anilines coordinated to a ruthenium center in cis-form affording a 3,5-cyclohexadiene-1,2-diimine moiety RSC Advances, 2021, 11, 36644-36650
7243924	CIF	C34 H26 F10 N6 O6 Ru S2	P -1	10.0063; 10.2443; 10.4305 114.725; 93.032; 100.152	946.35	Tomioka, Nozomi; Nanbu, Shinkoh; Misawa-Suzuki, Tomoyo; Nagao, Hirotaka N–C bond formation between two anilines coordinated to a ruthenium center in cis-form affording a 3,5-cyclohexadiene-1,2-diimine moiety RSC Advances, 2021, 11, 36644-36650
7243925	CIF	C34 H30 F12 N6 P2 Ru	P -1	13.2725; 13.5131; 13.7967 104.582; 103.059; 116.309	1977.56	Tomioka, Nozomi; Nanbu, Shinkoh; Misawa-Suzuki, Tomoyo; Nagao, Hirotaka N–C bond formation between two anilines coordinated to a ruthenium center in cis-form affording a 3,5-cyclohexadiene-1,2-diimine moiety RSC Advances, 2021, 11, 36644-36650
7243926	CIF	C36 H34 F6 N6 O6 Ru S2	P 1 21/n 1	11.2388; 22.2125; 15.9788 90; 91.188; 90	3988.12	Tomioka, Nozomi; Nanbu, Shinkoh; Misawa-Suzuki, Tomoyo; Nagao, Hirotaka N–C bond formation between two anilines coordinated to a ruthenium center in cis-form affording a 3,5-cyclohexadiene-1,2-diimine moiety RSC Advances, 2021, 11, 36644-36650
7243927	CIF	C22 H15 N O5	P -1	8.2293; 10.0168; 21.787 79.927; 88.945; 89.73	1767.94	Mousavi, Seyedeh Hekmat; Mohammadizadeh, Mohammad Reza; Poorsadeghi, Samira; Arimitsu, Satoru; Mohammadsaleh, Fatemeh; Kojya, Genta; Gima, Shinichi One-pot synthesis of new alkyl 1-naphthoates bearing quinoline, pyranone and cyclohexenone moieties via metal-free sequential addition/oxidation reactions RSC Advances, 2021, 11, 36748-36752
7243928	CIF	C29 H22 Co N3 O5	C 1 2/c 1	14.1916; 14.043; 26.3455 90; 92.889; 90	5243.8	Wen, Ming-Yue; Ren, Li; Cui, Guang-Hua Two Co(ii) complexes containing pyridylbenzimidazole ligands as chemosensors for the sensing of levofloxacin, acetylacetone, and Ni2+ with high selectivity and sensitivity CrystEngComm, 2021, 23, 8563-8571
7243929	CIF	C76 H66 Co2 N14 O14	P 1 21/n 1	12.622; 11.7644; 23.5657 90; 95.079; 90	3485.5	Wen, Ming-Yue; Ren, Li; Cui, Guang-Hua Two Co(ii) complexes containing pyridylbenzimidazole ligands as chemosensors for the sensing of levofloxacin, acetylacetone, and Ni2+ with high selectivity and sensitivity CrystEngComm, 2021, 23, 8563-8571
7243932	CIF	C131 H106 Cd9 N6 O54	P b c m	13.985; 25.773; 25.773 90; 90; 90	9289.5	Wang, Xiao-Qing; Ma, Xuehui; Feng, Doudou; Wu, Dan; Yang, Jie A stable Ln(iii)-functionalized Cd(ii)-based metal–organic framework: tunable white-light emission and fluorescent probe for monitoring bilirubin RSC Advances, 2021, 11, 36913-36919
7243933	CIF	C66 H88 O8 S6	P -1	11.1603; 11.9646; 13.1785 81.0129; 70.9839; 80.0849	1629.33	Kaiser, Lukáš; Landovský, Tomáš; Salvadori, Karolína; Eigner, Václav; Dvořáková, Hana; Lhoták, Pavel Breaking thiacalix[4]arene into pieces – a novel synthetic approach to higher calixarenes bearing mixed (–S–, –CH2–) bridges RSC Advances, 2021, 11, 36934-36941
7243934	CIF	C54 H72 O7 S3	P -1	13.233; 14.4941; 14.675 71.9424; 82.1907; 89.1864	2650.05	Kaiser, Lukáš; Landovský, Tomáš; Salvadori, Karolína; Eigner, Václav; Dvořáková, Hana; Lhoták, Pavel Breaking thiacalix[4]arene into pieces – a novel synthetic approach to higher calixarenes bearing mixed (–S–, –CH2–) bridges RSC Advances, 2021, 11, 36934-36941
7243935	CIF	C29.42 H25.64 F2 N5.21 O4 S2	C 1 2 1	29.078; 8.723; 12.0174 90; 93.915; 90	3041.1	Voronin, Alexander P.; Vasilev, Nikita A.; Surov, Artem O.; Churakov, Andrei V.; Perlovich, German L. Exploring the solid form landscape of the antifungal drug isavuconazole: crystal structure analysis, phase transformation behavior and dissolution performance CrystEngComm, 2021, 23, 8513-8526
7243936	CIF	C22 H19 F2 N5 O2 S	P 21 21 21	7.892; 11.2256; 24.2967 90; 90; 90	2152.5	Voronin, Alexander P.; Vasilev, Nikita A.; Surov, Artem O.; Churakov, Andrei V.; Perlovich, German L. Exploring the solid form landscape of the antifungal drug isavuconazole: crystal structure analysis, phase transformation behavior and dissolution performance CrystEngComm, 2021, 23, 8513-8526
7243937	CIF	C22 H17 F2 N5 O S	P 1 21 1	5.825; 17.3293; 9.7547 90; 97.072; 90	977.18	Voronin, Alexander P.; Vasilev, Nikita A.; Surov, Artem O.; Churakov, Andrei V.; Perlovich, German L. Exploring the solid form landscape of the antifungal drug isavuconazole: crystal structure analysis, phase transformation behavior and dissolution performance CrystEngComm, 2021, 23, 8513-8526
7243938	CIF	C22 H20 F2 N5 O5 P S	P 21 21 21	6.1215; 11.1722; 34.3989 90; 90; 90	2352.56	Voronin, Alexander P.; Vasilev, Nikita A.; Surov, Artem O.; Churakov, Andrei V.; Perlovich, German L. Exploring the solid form landscape of the antifungal drug isavuconazole: crystal structure analysis, phase transformation behavior and dissolution performance CrystEngComm, 2021, 23, 8513-8526
7243939	CIF	C8 H10 N4 Zn	I -4 3 m	17.497; 17.497; 17.497 90; 90; 90	5357	Ito, Sho; White, Fraser J.; Okunishi, Eiji; Aoyama, Yoshitaka; Yamano, Akihito; Sato, Hiroyasu; Ferrara, Joseph D.; Jasnowski, Michał; Meyer, Mathias Structure determination of small molecule compounds by an electron diffractometer for 3D ED/MicroED CrystEngComm, 2021, 23, 8622-8630
7243940	CIF	Cl4 K2 Pt	P 4/m m m	7.0688; 7.0688; 4.157 90; 90; 90	207.72	Ito, Sho; White, Fraser J.; Okunishi, Eiji; Aoyama, Yoshitaka; Yamano, Akihito; Sato, Hiroyasu; Ferrara, Joseph D.; Jasnowski, Michał; Meyer, Mathias Structure determination of small molecule compounds by an electron diffractometer for 3D ED/MicroED CrystEngComm, 2021, 23, 8622-8630
7243941	CIF	C18 H12 N6	C 1 2/c 1	13.507; 11.432; 11.114 90; 109.81; 90	1615	Ito, Sho; White, Fraser J.; Okunishi, Eiji; Aoyama, Yoshitaka; Yamano, Akihito; Sato, Hiroyasu; Ferrara, Joseph D.; Jasnowski, Michał; Meyer, Mathias Structure determination of small molecule compounds by an electron diffractometer for 3D ED/MicroED CrystEngComm, 2021, 23, 8622-8630
7243942	CIF	C9 H12 N3 O5	P 21 21 21	5.1022; 13.858; 14.596 90; 90; 90	1032	Ito, Sho; White, Fraser J.; Okunishi, Eiji; Aoyama, Yoshitaka; Yamano, Akihito; Sato, Hiroyasu; Ferrara, Joseph D.; Jasnowski, Michał; Meyer, Mathias Structure determination of small molecule compounds by an electron diffractometer for 3D ED/MicroED CrystEngComm, 2021, 23, 8622-8630
7243943	CIF	C24 H18	P n a 21	7.8; 20.2; 11.5 90; 90; 90	1812	Ito, Sho; White, Fraser J.; Okunishi, Eiji; Aoyama, Yoshitaka; Yamano, Akihito; Sato, Hiroyasu; Ferrara, Joseph D.; Jasnowski, Michał; Meyer, Mathias Structure determination of small molecule compounds by an electron diffractometer for 3D ED/MicroED CrystEngComm, 2021, 23, 8622-8630
7243944	CIF	C23 H36 N2 O2	P 21 21 21	6.66; 13.2; 26.77 90; 90; 90	2353	Ito, Sho; White, Fraser J.; Okunishi, Eiji; Aoyama, Yoshitaka; Yamano, Akihito; Sato, Hiroyasu; Ferrara, Joseph D.; Jasnowski, Michał; Meyer, Mathias Structure determination of small molecule compounds by an electron diffractometer for 3D ED/MicroED CrystEngComm, 2021, 23, 8622-8630
7243945	CIF	C22 H24 Cl F N4 O3	P -1	9.146; 9.99; 13.028 93.78; 97; 101.72	1151.8	Ito, Sho; White, Fraser J.; Okunishi, Eiji; Aoyama, Yoshitaka; Yamano, Akihito; Sato, Hiroyasu; Ferrara, Joseph D.; Jasnowski, Michał; Meyer, Mathias Structure determination of small molecule compounds by an electron diffractometer for 3D ED/MicroED CrystEngComm, 2021, 23, 8622-8630
7243946	CIF	C12 H8 F3 N5 O3 S	P -1	8.302; 10.025; 10.638 115.25; 91.67; 95.51	794.7	Ito, Sho; White, Fraser J.; Okunishi, Eiji; Aoyama, Yoshitaka; Yamano, Akihito; Sato, Hiroyasu; Ferrara, Joseph D.; Jasnowski, Michał; Meyer, Mathias Structure determination of small molecule compounds by an electron diffractometer for 3D ED/MicroED CrystEngComm, 2021, 23, 8622-8630
7243947	CIF	C9 H11 N O3	P 21 21 21	5.96; 7.09; 21.59 90; 90; 90	912	Ito, Sho; White, Fraser J.; Okunishi, Eiji; Aoyama, Yoshitaka; Yamano, Akihito; Sato, Hiroyasu; Ferrara, Joseph D.; Jasnowski, Michał; Meyer, Mathias Structure determination of small molecule compounds by an electron diffractometer for 3D ED/MicroED CrystEngComm, 2021, 23, 8622-8630
7243948	CIF	C6 H12 O6	P 21 21 21	5.177; 10.691; 15.272 90; 90; 90	845.3	Ito, Sho; White, Fraser J.; Okunishi, Eiji; Aoyama, Yoshitaka; Yamano, Akihito; Sato, Hiroyasu; Ferrara, Joseph D.; Jasnowski, Michał; Meyer, Mathias Structure determination of small molecule compounds by an electron diffractometer for 3D ED/MicroED CrystEngComm, 2021, 23, 8622-8630
7243949	CIF	C8 H9 N O2	P 1 21/n 1	7.344; 9.645; 12.087 90; 97.37; 90	849.1	Ito, Sho; White, Fraser J.; Okunishi, Eiji; Aoyama, Yoshitaka; Yamano, Akihito; Sato, Hiroyasu; Ferrara, Joseph D.; Jasnowski, Michał; Meyer, Mathias Structure determination of small molecule compounds by an electron diffractometer for 3D ED/MicroED CrystEngComm, 2021, 23, 8622-8630
7243950	CIF	C42 H28	C m c e	26.34; 7.03; 14.16 90; 90; 90	2622	Ito, Sho; White, Fraser J.; Okunishi, Eiji; Aoyama, Yoshitaka; Yamano, Akihito; Sato, Hiroyasu; Ferrara, Joseph D.; Jasnowski, Michał; Meyer, Mathias Structure determination of small molecule compounds by an electron diffractometer for 3D ED/MicroED CrystEngComm, 2021, 23, 8622-8630
7243951	CIF	C42 H28 Fe N10	P 1 21/c 1	9.25; 19.99; 9.66 90; 111.6; 90	1661	Ito, Sho; White, Fraser J.; Okunishi, Eiji; Aoyama, Yoshitaka; Yamano, Akihito; Sato, Hiroyasu; Ferrara, Joseph D.; Jasnowski, Michał; Meyer, Mathias Structure determination of small molecule compounds by an electron diffractometer for 3D ED/MicroED CrystEngComm, 2021, 23, 8622-8630
7243952	CIF	C6 Cl5 I	P 1 21/n 1	8.1229; 3.9138; 15.0718 90; 92.013; 90	478.86	Shapiro, Nicole M.; Bosch, Eric; Unruh, Daniel K.; Krueger, Herman R.; Groeneman, Ryan H. Iodoperchlorobenzene acts as a dual halogen-bond donor to template a [2 + 2] cycloaddition reaction within an organic co-crystal CrystEngComm, 2021, 23, 8265-8268
7243953	CIF	C18 H8 Cl5 I N2	P -1	3.9516; 11.1045; 12.2703 112.085; 91.11; 96.392	494.72	Shapiro, Nicole M.; Bosch, Eric; Unruh, Daniel K.; Krueger, Herman R.; Groeneman, Ryan H. Iodoperchlorobenzene acts as a dual halogen-bond donor to template a [2 + 2] cycloaddition reaction within an organic co-crystal CrystEngComm, 2021, 23, 8265-8268
7243954	CIF	C16 H8 Cl5 I N4	P -1	3.9144; 10.6909; 12.4925 111.51; 93.205; 91.807	484.858	Shapiro, Nicole M.; Bosch, Eric; Unruh, Daniel K.; Krueger, Herman R.; Groeneman, Ryan H. Iodoperchlorobenzene acts as a dual halogen-bond donor to template a [2 + 2] cycloaddition reaction within an organic co-crystal CrystEngComm, 2021, 23, 8265-8268
7243955	CIF	C18 H10 Cl5 I N2	P -1	3.9746; 10.7984; 12.4426 111.056; 93.327; 93.491	495.61	Shapiro, Nicole M.; Bosch, Eric; Unruh, Daniel K.; Krueger, Herman R.; Groeneman, Ryan H. Iodoperchlorobenzene acts as a dual halogen-bond donor to template a [2 + 2] cycloaddition reaction within an organic co-crystal CrystEngComm, 2021, 23, 8265-8268
7243958	CIF	C34 H30 Mn2 N6 O14	P -1	7.143; 9.3717; 13.017 85.852; 75.893; 89.95	842.8	Alizadeh, Hanie; Mirzaei, Masoud; Saljooghi, Amir Sh.; Jodaian, Vida; Bazargan, Maryam; Mague, Joel T.; Gomila, Rosa M.; Frontera, Antonio Coordination complexes of zinc and manganese based on pyridine-2,5-dicarboxylic acid N-oxide: DFT studies and antiproliferative activities consideration RSC Advances, 2021, 11, 37403-37412
7243959	CIF	C24 H16 N4 O10 Zn	P 1 21/c 1	13.7121; 17.737; 9.5694 90; 93.303; 90	2323.5	Alizadeh, Hanie; Mirzaei, Masoud; Saljooghi, Amir Sh.; Jodaian, Vida; Bazargan, Maryam; Mague, Joel T.; Gomila, Rosa M.; Frontera, Antonio Coordination complexes of zinc and manganese based on pyridine-2,5-dicarboxylic acid N-oxide: DFT studies and antiproliferative activities consideration RSC Advances, 2021, 11, 37403-37412
7243960	CIF	C17 H16 Cl N3 O7 Zn	P -1	8.5124; 9.503; 12.0869 75.923; 84.467; 80.995	934.96	Alizadeh, Hanie; Mirzaei, Masoud; Saljooghi, Amir Sh.; Jodaian, Vida; Bazargan, Maryam; Mague, Joel T.; Gomila, Rosa M.; Frontera, Antonio Coordination complexes of zinc and manganese based on pyridine-2,5-dicarboxylic acid N-oxide: DFT studies and antiproliferative activities consideration RSC Advances, 2021, 11, 37403-37412
7243961	CIF	C6 H3 Br N2 S	P -1	7.1075; 7.197; 7.635 68.754; 76.414; 69.876	339.06	Anderson, Trent E.; Culver, Evan W.; Badía-Domínguez, Irene; Wilcox, Wyatt D.; Buysse, Claire E.; Ruiz Delgado, M. Carmen; Rasmussen, Seth C. Probing the nature of donor-acceptor effects in conjugated materials: a joint experimental and computational study of model conjugated oligomers. Physical chemistry chemical physics : PCCP, 2021
7243962	CIF	C12 H8 N2 O2 S2	P 1 21/c 1	3.8786; 21.357; 13.401 90; 96.283; 90	1103.4	Anderson, Trent E.; Culver, Evan W.; Badía-Domínguez, Irene; Wilcox, Wyatt D.; Buysse, Claire E.; Ruiz Delgado, M. Carmen; Rasmussen, Seth C. Probing the nature of donor-acceptor effects in conjugated materials: a joint experimental and computational study of model conjugated oligomers. Physical chemistry chemical physics : PCCP, 2021
7243963	CIF	C24 H19 Br2 N5 Pd	C 1 2/c 1	18.6682; 15.9603; 8.1346 90; 94.651; 90	2415.7	Çakır, Sinem; Kavukcu, Serdar Batıkan; Karabıyık, Hande; Rethinam, Senthil; Türkmen, Hayati C(acyl)–C(sp2) and C(sp2)–C(sp2) Suzuki–Miyaura cross-coupling reactions using nitrile-functionalized NHC palladium complexes RSC Advances, 2021, 11, 37684-37699
7243964	CIF	C17 H16 Br2 N4 Pd	P -1	7.4786; 11.0996; 11.7959 90.731; 100.478; 106.482	921.1	Çakır, Sinem; Kavukcu, Serdar Batıkan; Karabıyık, Hande; Rethinam, Senthil; Türkmen, Hayati C(acyl)–C(sp2) and C(sp2)–C(sp2) Suzuki–Miyaura cross-coupling reactions using nitrile-functionalized NHC palladium complexes RSC Advances, 2021, 11, 37684-37699
7243965	CIF	C16 H17 Br2 N3 Pd	P -1	10.0563; 14.191; 14.2442 72.709; 72.523; 72.84	1803.4	Çakır, Sinem; Kavukcu, Serdar Batıkan; Karabıyık, Hande; Rethinam, Senthil; Türkmen, Hayati C(acyl)–C(sp2) and C(sp2)–C(sp2) Suzuki–Miyaura cross-coupling reactions using nitrile-functionalized NHC palladium complexes RSC Advances, 2021, 11, 37684-37699
7243967	CIF	C38 H43 Cl2 N3 O3 Ru	P -1	8.8611; 10.6837; 19.3949 74.511; 87.898; 89.558	1768.22	Al-Enezi, Mariam Y.; John, Elizabeth; Ibrahim, Yehia A.; Al-Awadi, Nouria A. Highly efficient Ru(ii)–alkylidene based Hoveyda–Grubbs catalysts for ring-closing metathesis reactions RSC Advances, 2021, 11, 37866-37876
7243968	CIF	C37 H43 Cl2 N3 O3 Ru S	R -3 :H	28.642; 28.642; 24.4463 90; 90; 120	17368	Al-Enezi, Mariam Y.; John, Elizabeth; Ibrahim, Yehia A.; Al-Awadi, Nouria A. Highly efficient Ru(ii)–alkylidene based Hoveyda–Grubbs catalysts for ring-closing metathesis reactions RSC Advances, 2021, 11, 37866-37876
7243969	CIF	C44 H49 Cl4 N3 O4 Ru S	P 1 21/c 1	12.038; 14.886; 24.18 90; 91.36; 90	4332	Al-Enezi, Mariam Y.; John, Elizabeth; Ibrahim, Yehia A.; Al-Awadi, Nouria A. Highly efficient Ru(ii)–alkylidene based Hoveyda–Grubbs catalysts for ring-closing metathesis reactions RSC Advances, 2021, 11, 37866-37876
7243979	CIF	C16 H19 Cl N2 O	P 21 21 21	7.78804; 10.18953; 19.93923 90; 90; 90	1582.31	Fauziev, Ruslan V.; Ivanov, Roman E.; Kuchurov, Ilya V.; Zlotin, Sergei G. A carbon dioxide-promoted three-component Strecker reaction Green Chemistry, 2021, 23, 10137-10144
7243982	CIF	C19 H15 F3 N2 O	P 1 21/n 1	12.2095; 12.2629; 12.3037 90; 118.746; 90	1615.14	Li, Hong; Peng, Xiangjun; Nie, Liang; Zhou, Lin; Yang, Ming; Li, Fan; Hu, Jian; Yao, Zhiyang; Liu, Liangxian Graphene oxide-catalyzed trifluoromethylation of alkynes with quinoxalinones and Langlois' reagent RSC Advances, 2021, 11, 38667-38673
7243983	CIF	C5 H4 F N3 O2	P n a 21	9.144; 14.87; 4.5573 90; 90; 90	619.7	Tiyasakulchai, Thanat; Charoensetakul, Netnapa; Khamkhenshorngphanuch, Thitiphong; Thongpanchang, Chawanee; Srikun, Onsiri; Yuthavong, Yongyuth; Srimongkolpithak, Nitipol Scalable synthesis of favipiravir via conventional and continuous flow chemistry RSC Advances, 2021, 11, 38691-38693
7243984	CIF	C22 H17 F O4	P 1 21/n 1	18.116; 5.561; 18.91 90; 112.394; 90	1761.4	Anwar, Shaik; Lin, Li-Tzu; Srinivasadesikan, V.; Gudise, Veera Babu; Chen, Kwunmin [3+2] regioselective annulation reaction of 2-arylidene-1,3-indandiones towards synthesis of spirocyclopentenes: understanding the mechanism of γ-attack vs. α-attack using DFT studies RSC Advances, 2021, 11, 38648-38653
7243985	CIF	C22 H17 Cl O4	P 1 21/n 1	18.038; 5.5757; 19.59 90; 111.044; 90	1838.8	Anwar, Shaik; Lin, Li-Tzu; Srinivasadesikan, V.; Gudise, Veera Babu; Chen, Kwunmin [3+2] regioselective annulation reaction of 2-arylidene-1,3-indandiones towards synthesis of spirocyclopentenes: understanding the mechanism of γ-attack vs. α-attack using DFT studies RSC Advances, 2021, 11, 38648-38653
7243986	CIF	C22 H17 Br O4	P 1 21/n 1	18.073; 5.5804; 19.888 90; 109.898; 90	1886	Anwar, Shaik; Lin, Li-Tzu; Srinivasadesikan, V.; Gudise, Veera Babu; Chen, Kwunmin [3+2] regioselective annulation reaction of 2-arylidene-1,3-indandiones towards synthesis of spirocyclopentenes: understanding the mechanism of γ-attack vs. α-attack using DFT studies RSC Advances, 2021, 11, 38648-38653
7243987	CIF	C23 H17 N O4	C 1 2/c 1	31.098; 8.4741; 14.651 90; 97.962; 90	3823.7	Anwar, Shaik; Lin, Li-Tzu; Srinivasadesikan, V.; Gudise, Veera Babu; Chen, Kwunmin [3+2] regioselective annulation reaction of 2-arylidene-1,3-indandiones towards synthesis of spirocyclopentenes: understanding the mechanism of γ-attack vs. α-attack using DFT studies RSC Advances, 2021, 11, 38648-38653
7243988	CIF	C20 H16 O4 S	P 1 21 1	8.833; 6.042; 16.23 90; 103.32; 90	843	Anwar, Shaik; Lin, Li-Tzu; Srinivasadesikan, V.; Gudise, Veera Babu; Chen, Kwunmin [3+2] regioselective annulation reaction of 2-arylidene-1,3-indandiones towards synthesis of spirocyclopentenes: understanding the mechanism of γ-attack vs. α-attack using DFT studies RSC Advances, 2021, 11, 38648-38653
7243989	CIF	C23 H17 N O4	P 1 21 1	11.4044; 5.5305; 15.6417 90; 95.178; 90	982.5	Anwar, Shaik; Lin, Li-Tzu; Srinivasadesikan, V.; Gudise, Veera Babu; Chen, Kwunmin [3+2] regioselective annulation reaction of 2-arylidene-1,3-indandiones towards synthesis of spirocyclopentenes: understanding the mechanism of γ-attack vs. α-attack using DFT studies RSC Advances, 2021, 11, 38648-38653
7244000	CIF	C19 H15 Fe N S	P b c a	10.7762; 7.7571; 35.821 90; 90; 90	2994.4	Kulhánek, Jiří; Klikar, Milan; Pytela, Oldřich; R°užičková, Zdenka; Bureš, Filip Ferrocene donor linked to pyridine/pyridinium acceptor via a systematically enlarged π-linker RSC Advances, 2021, 11, 38804-38813
7244001	CIF	C23 H17 Fe N	P 1 21 1	10.696; 7.473; 21.224 90; 94.182; 90	1691.9	Kulhánek, Jiří; Klikar, Milan; Pytela, Oldřich; R°užičková, Zdenka; Bureš, Filip Ferrocene donor linked to pyridine/pyridinium acceptor via a systematically enlarged π-linker RSC Advances, 2021, 11, 38804-38813
7244002	CIF	C24 H22 Cu Fe N2 O5	P 1 21/c 1	5.8675; 20.1101; 18.3448 90; 98.579; 90	2140.4	Ospina-Castro, María L.; Ávila, Edward E.; Briceño, Alexander; Reiber, Andreas; Pacheco-Londoño, Leonardo C.; Galan-Freyle, Nataly J. Self-assembly and supramolecular isomerism in 1D metal–organometallic networks based on transition-metal assemblies from 1,1′-ferrocene-dicarboxylic acid and ancillary nitrogen heterocycle ligands CrystEngComm, 2021, 23, 8198-8208
7244003	CIF	C24 H20 Co Fe N2 O4.48	P 1 21/c 1	6.34; 15.31; 23.14 90; 84.1; 90	2234	Ospina-Castro, María L.; Ávila, Edward E.; Briceño, Alexander; Reiber, Andreas; Pacheco-Londoño, Leonardo C.; Galan-Freyle, Nataly J. Self-assembly and supramolecular isomerism in 1D metal–organometallic networks based on transition-metal assemblies from 1,1′-ferrocene-dicarboxylic acid and ancillary nitrogen heterocycle ligands CrystEngComm, 2021, 23, 8198-8208
7244004	CIF	C24 H18 Cu Fe N2 O5	P 1 21/c 1	5.707; 25.67; 14.37 90; 97.07; 90	2089	Ospina-Castro, María L.; Ávila, Edward E.; Briceño, Alexander; Reiber, Andreas; Pacheco-Londoño, Leonardo C.; Galan-Freyle, Nataly J. Self-assembly and supramolecular isomerism in 1D metal–organometallic networks based on transition-metal assemblies from 1,1′-ferrocene-dicarboxylic acid and ancillary nitrogen heterocycle ligands CrystEngComm, 2021, 23, 8198-8208
7244005	CIF	C24 H21 Cd Fe N2 O4.5	P 1 21/c 1	5.9086; 16.8542; 21.1889 90; 92.684; 90	2107.78	Ospina-Castro, María L.; Ávila, Edward E.; Briceño, Alexander; Reiber, Andreas; Pacheco-Londoño, Leonardo C.; Galan-Freyle, Nataly J. Self-assembly and supramolecular isomerism in 1D metal–organometallic networks based on transition-metal assemblies from 1,1′-ferrocene-dicarboxylic acid and ancillary nitrogen heterocycle ligands CrystEngComm, 2021, 23, 8198-8208
7244006	CIF	C38 H32 Fe N2 O5 Zn	P -1	10.2015; 12.2977; 13.0982 105.694; 92.706; 93.349	1575.88	Ospina-Castro, María L.; Ávila, Edward E.; Briceño, Alexander; Reiber, Andreas; Pacheco-Londoño, Leonardo C.; Galan-Freyle, Nataly J. Self-assembly and supramolecular isomerism in 1D metal–organometallic networks based on transition-metal assemblies from 1,1′-ferrocene-dicarboxylic acid and ancillary nitrogen heterocycle ligands CrystEngComm, 2021, 23, 8198-8208
7244007	CIF	C24 H24 Co Fe N2 O6	P n n a	23.977; 12.069; 8.344 90; 90; 90	2414.6	Ospina-Castro, María L.; Ávila, Edward E.; Briceño, Alexander; Reiber, Andreas; Pacheco-Londoño, Leonardo C.; Galan-Freyle, Nataly J. Self-assembly and supramolecular isomerism in 1D metal–organometallic networks based on transition-metal assemblies from 1,1′-ferrocene-dicarboxylic acid and ancillary nitrogen heterocycle ligands CrystEngComm, 2021, 23, 8198-8208
7244008	CIF	C38 H32 Co Fe N2 O5	P -1	10.241; 12.46; 13.234 106.27; 91.968; 93.26	1616.2	Ospina-Castro, María L.; Ávila, Edward E.; Briceño, Alexander; Reiber, Andreas; Pacheco-Londoño, Leonardo C.; Galan-Freyle, Nataly J. Self-assembly and supramolecular isomerism in 1D metal–organometallic networks based on transition-metal assemblies from 1,1′-ferrocene-dicarboxylic acid and ancillary nitrogen heterocycle ligands CrystEngComm, 2021, 23, 8198-8208
7244009	CIF	C38 H30 Cu Fe N2 O4	P -1	10.7394; 12.0118; 12.6687 77.694; 78.073; 79.98	1547.74	Ospina-Castro, María L.; Ávila, Edward E.; Briceño, Alexander; Reiber, Andreas; Pacheco-Londoño, Leonardo C.; Galan-Freyle, Nataly J. Self-assembly and supramolecular isomerism in 1D metal–organometallic networks based on transition-metal assemblies from 1,1′-ferrocene-dicarboxylic acid and ancillary nitrogen heterocycle ligands CrystEngComm, 2021, 23, 8198-8208
7244010	CIF	C4 H12 B N	P 1 21/c 1	10.6; 6.32; 9.48 90; 96.06; 90	632	Giustra, Zachary X.; Chen, Gang; Vasiliu, Monica; Karkamkar, Abhijeet; Autrey, Tom; Dixon, David A.; Liu, Shih-Yuan A comparison of hydrogen release kinetics from 5- and 6-membered 1,2-BN-cycloalkanes RSC Advances, 2021, 11, 34132-34136
7244011	CIF	C4 H12 B N	P b c a	7.078; 9.187; 18.233 90; 90; 90	1186	Giustra, Zachary X.; Chen, Gang; Vasiliu, Monica; Karkamkar, Abhijeet; Autrey, Tom; Dixon, David A.; Liu, Shih-Yuan A comparison of hydrogen release kinetics from 5- and 6-membered 1,2-BN-cycloalkanes RSC Advances, 2021, 11, 34132-34136
7244012	CIF	C6 H16 B N	P n a 21	9.5116; 12.6484; 6.5253 90; 90; 90	785.04	Giustra, Zachary X.; Chen, Gang; Vasiliu, Monica; Karkamkar, Abhijeet; Autrey, Tom; Dixon, David A.; Liu, Shih-Yuan A comparison of hydrogen release kinetics from 5- and 6-membered 1,2-BN-cycloalkanes RSC Advances, 2021, 11, 34132-34136
7244013	CIF	C3 H10 B N	P c a 21	8.519; 6.85; 8.309 90; 90; 90	484.9	Giustra, Zachary X.; Chen, Gang; Vasiliu, Monica; Karkamkar, Abhijeet; Autrey, Tom; Dixon, David A.; Liu, Shih-Yuan A comparison of hydrogen release kinetics from 5- and 6-membered 1,2-BN-cycloalkanes RSC Advances, 2021, 11, 34132-34136
7244032	CIF	C41 H35 Cl2 N5 O2 P Rh	P 1 21/c 1	10.9618; 28.137; 12.411 90; 107.366; 90	3653.5	Yatabe, Takeshi; Futakuchi, Sayaka; Miyazawa, Keishi; Shimauchi, Daiki; Takahashi, Yukina; Yoon, Ki-Seok; Nakai, Hidetaka; Ogo, Seiji Reductive C(sp3)–C(sp3) homo-coupling of benzyl or allyl halides with H2 using a water-soluble electron storage catalyst RSC Advances, 2021, 11, 39450-39454
7244033	CIF	C24 H19 Cl N5 O2 Rh	P -1	8.823; 11.1353; 12.6467 64.079; 77.813; 71.596	1056.45	Yatabe, Takeshi; Futakuchi, Sayaka; Miyazawa, Keishi; Shimauchi, Daiki; Takahashi, Yukina; Yoon, Ki-Seok; Nakai, Hidetaka; Ogo, Seiji Reductive C(sp3)–C(sp3) homo-coupling of benzyl or allyl halides with H2 using a water-soluble electron storage catalyst RSC Advances, 2021, 11, 39450-39454
7244037	CIF	C19 H15 N O3	P n a 21	21.52; 5.086; 13.68 90; 90; 90	1497	Malik, Manzoor Ahmad; Raza, Md Kausar; Mohammed, Arif; Wani, Mohmmad Younus; Al-Bogami, Abdullah Saad; Hashmi, Athar Adil Unravelling the anticancer potential of a square planar copper complex: toward non-platinum chemotherapy RSC Advances, 2021, 11, 39349-39361
7244049	CIF	C48 H37 F6 Ir N11 O P	P 1 21/n 1	15.6191; 17.9773; 15.7336 90; 97.817; 90	4376.77	Otaif, Haleema Y.; Adams, Samuel J.; Horton, Peter N.; Coles, Simon J.; Beames, Joseph M.; Pope, Simon J. A. Bis-cyclometalated iridium(iii) complexes with terpyridine analogues: syntheses, structures, spectroscopy and computational studies RSC Advances, 2021, 11, 39718-39727
7244050	CIF	C50.5 H41 Cl F6 Ir N10 P	I 1 2/a 1	20.0555; 17.4269; 29.5696 90; 108.009; 90	9828.4	Otaif, Haleema Y.; Adams, Samuel J.; Horton, Peter N.; Coles, Simon J.; Beames, Joseph M.; Pope, Simon J. A. Bis-cyclometalated iridium(iii) complexes with terpyridine analogues: syntheses, structures, spectroscopy and computational studies RSC Advances, 2021, 11, 39718-39727
7244054	CIF	C30 H40 N3 O4 P	P 21 21 21	5.46724; 21.5006; 23.19943 90; 90; 90	2727.07	Rouh, Hossein; Tang, Yao; Zhang, Sai; Ali, Ahmed I. M.; Surowiec, Kazimierz; Unruh, Daniel; Li, Guigen Asymmetric [4 + 2] cycloaddition synthesis of 4H-chromene derivatives facilitated by group-assisted-purification (GAP) chemistry RSC Advances, 2021, 11, 39790-39796
7244079	CIF	C28 H30	P -1	9.427; 11.348; 11.761 112.635; 97.722; 106.198	1072.9	Han, Bo; Zhang, Miaomiao; Jiao, Hongmei; Ma, Haojie; Wang, Jijiang; Zhang, Yuqi Ligand-enabled and magnesium-activated hydrogenation with earth-abundant cobalt catalysts RSC Advances, 2021, 11, 39934-39939
7244080	CIF	C16 H11 Cl2 N O5	P n a 21	22.9722; 13.0888; 5.093 90; 90; 90	1531.36	Manojkumar, Palnati; Harilal,; Mahipal, Varukolu; Suresh, Gangadhari; Venkatesh, Nampally; Ramesh, Macha; Parthasarathy, Tigulla Exploring the charge transfer dynamics of hydrogen bonded crystals of 2-methyl-8-quinolinol and chloranilic acid: synthesis, spectrophotometric, single-crystal, DFT/PCM analysis, antimicrobial, and DNA binding studies RSC Advances, 2021, 11, 39994-40010
7244081	CIF	C50 H42 Cl4 Cu2 N10 O20 S2	P -1	10.7361; 12.0568; 12.4567 66.295; 81.685; 82.104	1455.27	Zeng, Zhenfang; Cai, Jiehui; Li, Fuyan; Weng, Yanying; Huang, Qiuping; Yang, Honglan; Huang, Qiuchan; Wei, Youhuan Synthesis, crystal structures, DNA interactions, and antitumor activity of two new dinuclear copper(ii) complexes with thiazole ligand RSC Advances, 2021, 11, 40040-40050
7244082	CIF	C50 H46 Cu2 N10 O20 S2	C 1 2/c 1	18.402; 16.2054; 18.6394 90; 97.992; 90	5504.5	Zeng, Zhenfang; Cai, Jiehui; Li, Fuyan; Weng, Yanying; Huang, Qiuping; Yang, Honglan; Huang, Qiuchan; Wei, Youhuan Synthesis, crystal structures, DNA interactions, and antitumor activity of two new dinuclear copper(ii) complexes with thiazole ligand RSC Advances, 2021, 11, 40040-40050
7244083	CIF	Ba4 Mn2.9 O12 Sn1.1	R -3 m :H	5.72904; 5.72904; 28.1637 90; 90; 120	800.542	Wu, Junkun; Yan, Xiaohui; Guo, Wenbin; Wang, Xiaoming; Yin, Congling; Kuang, Xiaojun Molecule-like cluster magnetism and cationic order in the new hexagonal perovskite Ba4Sn1.1Mn2.9O12 RSC Advances, 2021, 11, 40235-40242
7244084	CIF	C66 H56 N4 O8 S2	P 1 21 1	9.7583; 21.2841; 13.5807 90; 92.287; 90	2818.42	Gao, Zhenzhen; Xie, Lei; Ji, Lusha; Ma, Xin; Li, Xiaojing; Liu, Honglei; Guo, Hongchao Phosphine-catalyzed [3 + 2] annulation of β-sulfonamido-substituted enones with trans-α-cyano-α,β-unsaturated ketones for the synthesis of highly substituted pyrrolidines RSC Advances, 2021, 11, 40136-40139
7244092	CIF	C14 H11 N O3	P 21 21 21	8.9979; 9.4469; 14.0932 90; 90; 90	1198	Wang, Kai-Kai; Li, Yan-Li; Zhao, Ying-Chao; Zhang, Shan-Shan; Chen, Rongxiang; Sun, Aili Facile synthesis of O-acylhydroxamates via reaction of oxime chlorides with carboxylic acids RSC Advances, 2021, 11, 40193-40196
7244093	CIF	C20 H18 N2 O5	P 1 21/n 1	20.945; 8.7506; 21.976 90; 116.49; 90	3604.9	Cossío, Fernando P; de Cózar, Abel; Sierra, Miguel A.; Casarrubios, Luis; Muntaner, Jaime G.; Banik, Bimal K.; Bandyopadhyay, Debasish Role of imine isomerization in the stereocontrol of the Staudinger reaction between ketenes and imines. RSC advances, 2021, 12, 104-117
7244094	CIF	C20 H18 N2 O5	P 1 21/c 1	10.9199; 20.1342; 8.5465 90; 107.303; 90	1794	Cossío, Fernando P; de Cózar, Abel; Sierra, Miguel A.; Casarrubios, Luis; Muntaner, Jaime G.; Banik, Bimal K.; Bandyopadhyay, Debasish Role of imine isomerization in the stereocontrol of the Staudinger reaction between ketenes and imines. RSC advances, 2021, 12, 104-117
7244106	CIF	C20 H21 B Cl N3 O2	C 1 c 1	13.0381; 20.5925; 7.15692 90; 91.598; 90	1920.79	Zheng, Huitao; Xiong, Honggang; Su, Chaobo; Cao, Hua; Yao, Huagang; Liu, Xiang Photoinduced successive oxidative ring-opening and borylation of indolizines with NHC-boranes. RSC advances, 2021, 12, 470-474
7244108	CIF	C27 H22 N2 O6	P -1	9.838; 10.401; 12.2553 102.291; 100.426; 103.17	1157.8	Galeev, Andrew R.; Moroz, Anna A.; Dmitriev, Maksim V.; Maslivets, Andrey N. Cycloaddition of Huisgen 1,4-dipoles: synthesis and rapid epimerization of functionalized spiropyrido[2,1-<i>b</i>][1,3]oxazine-pyrroles and related products. RSC advances, 2021, 12, 578-587
7244109	CIF	C30 H21 N3 O5	P -1	11.4672; 14.0604; 15.6426 99.666; 96.992; 94.581	2454.8	Galeev, Andrew R.; Moroz, Anna A.; Dmitriev, Maksim V.; Maslivets, Andrey N. Cycloaddition of Huisgen 1,4-dipoles: synthesis and rapid epimerization of functionalized spiropyrido[2,1-<i>b</i>][1,3]oxazine-pyrroles and related products. RSC advances, 2021, 12, 578-587
7244110	CIF	C31 H28 N2 O8	P -1	11.1868; 11.4255; 12.2739 95.263; 107.966; 103.507	1428.1	Galeev, Andrew R.; Moroz, Anna A.; Dmitriev, Maksim V.; Maslivets, Andrey N. Cycloaddition of Huisgen 1,4-dipoles: synthesis and rapid epimerization of functionalized spiropyrido[2,1-<i>b</i>][1,3]oxazine-pyrroles and related products. RSC advances, 2021, 12, 578-587
7244111	CIF	C30 H21 N3 O5	P 1 21/n 1	8.7697; 19.206; 14.48 90; 94.7; 90	2430.7	Galeev, Andrew R.; Moroz, Anna A.; Dmitriev, Maksim V.; Maslivets, Andrey N. Cycloaddition of Huisgen 1,4-dipoles: synthesis and rapid epimerization of functionalized spiropyrido[2,1-<i>b</i>][1,3]oxazine-pyrroles and related products. RSC advances, 2021, 12, 578-587
7244115	CIF	C22 H21 N3 O5	P -1	8.6661; 11.0426; 12.2572 108.672; 102.099; 108.033	992.66	Kausar, Naghmana; Murtaza, Shahzad; Arshad, Muhammad Nadeem; Zaib Saleem, Rahman Shah; Asiri, Abdullah M.; Kausar, Samia; Altaf, Ataf Ali; Tatheer, Adina; Elnaggar, Ashraf Y.; El-Bahy, Salah M Design, synthesis, crystal structure, <i>in vitro</i> cytotoxicity evaluation, density functional theory calculations and docking studies of 2-(benzamido) benzohydrazide derivatives as potent AChE and BChE inhibitors. RSC advances, 2021, 12, 154-167
7244116	CIF	C18 H17 N O3 S	P 1 21/n 1	8.8132; 18.052; 10.3523 90; 102.448; 90	1608.3	Choi, Seoung-Mi; Kim, Kyeong Do; Park, Jong-Un; Xuan, Zi; Kim, Ju Hyun Pd-catalyzed [3 + 2] cycloaddition of cyclic ketimines and trimethylenemethanes toward <i>N</i>-fused pyrrolidines bearing a quaternary carbon. RSC advances, 2021, 12, 785-789
7244136	CIF	C17 H16 Cd Cl2 N4 O4	P 1 21/c 1	10.8022; 14.266; 14.671 90; 101.96; 90	2211.8	Nguyen, Anh Van; Vu, Anh Thi Ngoc; Bazan, Liya V.; Galeev, Ravil T.; Utenyshev, Andrey N.; Markova, Ekaterina B.; Le, Van Thuan; Kovalchukova, Olga V. Synthesis, characterization, and sorption activity of novel azo-colorants derived from phloroglucinol and antipyrine and their metal complexes. RSC advances, 2021, 12, 888-898
7245739	CIF	C3 H6 O	P 1 21/a 1	8.9833; 4.2238; 9.4734 90; 97.508; 90	356.37	Maynard-Casely, Helen E; Yevstigneyev, Nikita S.; Duyker, Samuel G.; Ennis, Courtney The crystal structure, thermal expansion and far-IR spectrum of propanal (CH<sub>3</sub>CH<sub>2</sub>CHO) determined using powder X-ray diffraction, neutron scattering, periodic DFT and synchrotron techniques. Physical chemistry chemical physics : PCCP, 2021, 24, 122-128
7246217	CIF	Cu2 S3 Sn	C 1 c 1	6.6561; 11.5249; 6.6579 90; 109.515; 90	481.39	Pavan Kumar, V.; Lemoine, P.; Carnevali, V.; Guelou, G.; Lebedev, O.I.; Boullay, P.; Raveau, B.; Al Rahal Al Orabi, R.; Fornari, M.; Prestipino, C.; Menut, D.; Candolfi, C.; Malaman, B.; Juraszek, J.; Guilmeau, E. 'Ordered sphalerite derivative Cu5Sn2S7: a degenerate semiconductor with high carrier mobility in the Cu-Sn-S diagram' Journal of Materials Chemistry A, 2021, 9, 10812-10826
7246218	CIF	Cu5 S7 Sn2	C 1 2 1	12.058; 5.40629; 8.5026 90; 98.163; 90	548.66	Pavan Kumar, V.; Lemoine, P.; Carnevali, V.; Guelou, G.; Lebedev, O.I.; Boullay, P.; Raveau, B.; Al Rahal Al Orabi, R.; Fornari, M.; Prestipino, C.; Menut, D.; Candolfi, C.; Malaman, B.; Juraszek, J.; Guilmeau, E. 'Ordered sphalerite derivative Cu5Sn2S7: a degenerate semiconductor with high carrier mobility in the Cu-Sn-S diagram' Journal of Materials Chemistry A, 2021, 9, 10812-10826
7705747	CIF	C90 H83 F12 N4 O4.5 P6 Ru2	P -1	11.7551; 17.493; 22.9633 110.196; 97.478; 99.273	4284.88	Graminha, Angelica E.; Honorato, João; Correa, Rodrigo S.; Cominetti, Marcia R.; Menezes, Antônio C S; Batista, Alzir A. A novel ruthenium(ii) gallic acid complex disrupts the actin cytoskeleton and inhibits migration, invasion and adhesion of triple negative breast tumor cells. Dalton transactions (Cambridge, England : 2003), 2021, 50, 323-335
7705748	CIF	C51 H47.5 F6 N2 O8.25 P3 Ru	P 1 21/a 1	18.644; 31.025; 19.489 90; 110.134; 90	10584.1	Graminha, Angelica E.; Honorato, João; Correa, Rodrigo S.; Cominetti, Marcia R.; Menezes, Antônio C S; Batista, Alzir A. A novel ruthenium(ii) gallic acid complex disrupts the actin cytoskeleton and inhibits migration, invasion and adhesion of triple negative breast tumor cells. Dalton transactions (Cambridge, England : 2003), 2021, 50, 323-335
7705752	CIF	C30 H37 Cl Cu N2 O3	C 1 c 1	32.453; 10.493; 20.097 90; 113.66; 90	6268	Ribeiro, Nádia; Bulut, Ipek; Cevatemre, Buse; Teixeira, Carlos; Yildizhan, Yasemin; André, Vânia; Adão, Pedro; Pessoa, João Costa; Acilan, Ceyda; Correia, Isabel Cu(ii) and V(iv)O complexes with tri- or tetradentate ligands based on (2-hydroxybenzyl)-l-alanines reveal promising anticancer therapeutic potential. Dalton transactions (Cambridge, England : 2003), 2021, 50, 157-169
7705753	CIF	C24 H33 B F3 N2 O Rh	P -1	7.6521; 12.0807; 14.3701 65.159; 82.202; 83.726	1192.33	Srivastava, Ravi; Jakoobi, Martin; Thieuleux, Chloé; Quadrelli, Elsje Alessandra; Camp, Clément A family of rhodium(i) NHC chelates featuring O-containing tethers for catalytic tandem alkene isomerization-hydrosilylation. Dalton transactions (Cambridge, England : 2003), 2021, 50, 869-879
7705754	CIF	C24 H33 N2 O Rh	R -3 :H	32.883; 32.883; 10.4799 90; 90; 120	9813.7	Srivastava, Ravi; Jakoobi, Martin; Thieuleux, Chloé; Quadrelli, Elsje Alessandra; Camp, Clément A family of rhodium(i) NHC chelates featuring O-containing tethers for catalytic tandem alkene isomerization-hydrosilylation. Dalton transactions (Cambridge, England : 2003), 2021, 50, 869-879
7705755	CIF	C24 H34 B F4 N2 O Rh	C 1 2/c 1	41.765; 7.8159; 24.836 90; 134.45; 90	5787	Srivastava, Ravi; Jakoobi, Martin; Thieuleux, Chloé; Quadrelli, Elsje Alessandra; Camp, Clément A family of rhodium(i) NHC chelates featuring O-containing tethers for catalytic tandem alkene isomerization-hydrosilylation. Dalton transactions (Cambridge, England : 2003), 2021, 50, 869-879
7705770	CIF	C20 H21 As Cu F6 N4 O P	C 1 2/m 1	17.9397; 14.5346; 8.819 90; 91.8006; 90	2298.39	Plajer, Alex J.; Crusius, Daniel; Jethwa, Rajesh B.; García-Romero, Álvaro; Bond, Andrew D.; García-Rodríguez, Raúl; Wright, Dominic S. Coordination chemistry of the bench-stable tris-2-pyridyl pnictogen ligands [E(6-Me-2-py)<sub>3</sub>] (E = As, As[double bond, length as m-dash]O, Sb). Dalton transactions (Cambridge, England : 2003), 2021, 50, 2393-2402
7705771	CIF	C36 H36 As2 Cl2 N6 Pt	P 1 21/c 1	11.1512; 17.0883; 18.9656 90; 100.393; 90	3554.7	Plajer, Alex J.; Crusius, Daniel; Jethwa, Rajesh B.; García-Romero, Álvaro; Bond, Andrew D.; García-Rodríguez, Raúl; Wright, Dominic S. Coordination chemistry of the bench-stable tris-2-pyridyl pnictogen ligands [E(6-Me-2-py)<sub>3</sub>] (E = As, As[double bond, length as m-dash]O, Sb). Dalton transactions (Cambridge, England : 2003), 2021, 50, 2393-2402
7705772	CIF	C29 H34 As Cl4 N3 Ru	P -1	11.6321; 11.8492; 12.1214 88.9504; 74.5037; 85.8931	1605.84	Plajer, Alex J.; Crusius, Daniel; Jethwa, Rajesh B.; García-Romero, Álvaro; Bond, Andrew D.; García-Rodríguez, Raúl; Wright, Dominic S. Coordination chemistry of the bench-stable tris-2-pyridyl pnictogen ligands [E(6-Me-2-py)<sub>3</sub>] (E = As, As[double bond, length as m-dash]O, Sb). Dalton transactions (Cambridge, England : 2003), 2021, 50, 2393-2402
7705773	CIF	C20 H22 As Br2 Cl4 N3 Ni O	P 1 21/c 1	12.5295; 14.4095; 15.1592 90; 96.375; 90	2719.98	Plajer, Alex J.; Crusius, Daniel; Jethwa, Rajesh B.; García-Romero, Álvaro; Bond, Andrew D.; García-Rodríguez, Raúl; Wright, Dominic S. Coordination chemistry of the bench-stable tris-2-pyridyl pnictogen ligands [E(6-Me-2-py)<sub>3</sub>] (E = As, As[double bond, length as m-dash]O, Sb). Dalton transactions (Cambridge, England : 2003), 2021, 50, 2393-2402
7705774	CIF	C37 H38 Cl4 N6 Pt Sb2	P 1 21/c 1	21.5597; 9.4131; 21.624 90; 111.956; 90	4070.16	Plajer, Alex J.; Crusius, Daniel; Jethwa, Rajesh B.; García-Romero, Álvaro; Bond, Andrew D.; García-Rodríguez, Raúl; Wright, Dominic S. Coordination chemistry of the bench-stable tris-2-pyridyl pnictogen ligands [E(6-Me-2-py)<sub>3</sub>] (E = As, As[double bond, length as m-dash]O, Sb). Dalton transactions (Cambridge, England : 2003), 2021, 50, 2393-2402
7705775	CIF	C18 H18 As Br2 Co N3	P -1	8.2686; 8.6144; 15.8017 101.168; 93.4356; 115.304	985.27	Plajer, Alex J.; Crusius, Daniel; Jethwa, Rajesh B.; García-Romero, Álvaro; Bond, Andrew D.; García-Rodríguez, Raúl; Wright, Dominic S. Coordination chemistry of the bench-stable tris-2-pyridyl pnictogen ligands [E(6-Me-2-py)<sub>3</sub>] (E = As, As[double bond, length as m-dash]O, Sb). Dalton transactions (Cambridge, England : 2003), 2021, 50, 2393-2402
7705776	CIF	C88 H84 Ag4 As4 F12 N16 O8	P 1 21/n 1	23.6574; 16.1326; 23.9153 90; 94.593; 90	9098.1	Plajer, Alex J.; Crusius, Daniel; Jethwa, Rajesh B.; García-Romero, Álvaro; Bond, Andrew D.; García-Rodríguez, Raúl; Wright, Dominic S. Coordination chemistry of the bench-stable tris-2-pyridyl pnictogen ligands [E(6-Me-2-py)<sub>3</sub>] (E = As, As[double bond, length as m-dash]O, Sb). Dalton transactions (Cambridge, England : 2003), 2021, 50, 2393-2402
7705777	CIF	C18 H18 As Br2 N3 Ni	P -1	8.2096; 8.5804; 15.8305 100.351; 93.784; 114.969	981.79	Plajer, Alex J.; Crusius, Daniel; Jethwa, Rajesh B.; García-Romero, Álvaro; Bond, Andrew D.; García-Rodríguez, Raúl; Wright, Dominic S. Coordination chemistry of the bench-stable tris-2-pyridyl pnictogen ligands [E(6-Me-2-py)<sub>3</sub>] (E = As, As[double bond, length as m-dash]O, Sb). Dalton transactions (Cambridge, England : 2003), 2021, 50, 2393-2402
7705778	CIF	C18 H18 As N3 O	P 1 21/n 1	13.4062; 8.7464; 14.48 90; 94.315; 90	1693.05	Plajer, Alex J.; Crusius, Daniel; Jethwa, Rajesh B.; García-Romero, Álvaro; Bond, Andrew D.; García-Rodríguez, Raúl; Wright, Dominic S. Coordination chemistry of the bench-stable tris-2-pyridyl pnictogen ligands [E(6-Me-2-py)<sub>3</sub>] (E = As, As[double bond, length as m-dash]O, Sb). Dalton transactions (Cambridge, England : 2003), 2021, 50, 2393-2402
7705779	CIF	C28 H32 Cl2 N3 Ru Sb	P -1	10.0959; 11.3011; 13.3583 80.513; 80.3017; 74.413	1435.56	Plajer, Alex J.; Crusius, Daniel; Jethwa, Rajesh B.; García-Romero, Álvaro; Bond, Andrew D.; García-Rodríguez, Raúl; Wright, Dominic S. Coordination chemistry of the bench-stable tris-2-pyridyl pnictogen ligands [E(6-Me-2-py)<sub>3</sub>] (E = As, As[double bond, length as m-dash]O, Sb). Dalton transactions (Cambridge, England : 2003), 2021, 50, 2393-2402
7705780	CIF	C12 H14 Br2 Co N2	P -1	7.8472; 8.7748; 11.4684 85.187; 78.798; 68.072	718.54	Plajer, Alex J.; Crusius, Daniel; Jethwa, Rajesh B.; García-Romero, Álvaro; Bond, Andrew D.; García-Rodríguez, Raúl; Wright, Dominic S. Coordination chemistry of the bench-stable tris-2-pyridyl pnictogen ligands [E(6-Me-2-py)<sub>3</sub>] (E = As, As[double bond, length as m-dash]O, Sb). Dalton transactions (Cambridge, England : 2003), 2021, 50, 2393-2402
7705781	CIF	C40 H42 As2 Br4 Co2 N8 O2	P -1	11.5249; 11.8024; 19.742 100.624; 99.526; 112.501	2354.55	Plajer, Alex J.; Crusius, Daniel; Jethwa, Rajesh B.; García-Romero, Álvaro; Bond, Andrew D.; García-Rodríguez, Raúl; Wright, Dominic S. Coordination chemistry of the bench-stable tris-2-pyridyl pnictogen ligands [E(6-Me-2-py)<sub>3</sub>] (E = As, As[double bond, length as m-dash]O, Sb). Dalton transactions (Cambridge, England : 2003), 2021, 50, 2393-2402
7705782	CIF	C20 H18 Ag As F3 N3 O3	P -1	12.4532; 12.4623; 17.2354 71.064; 70.436; 60.091	2143.73	Plajer, Alex J.; Crusius, Daniel; Jethwa, Rajesh B.; García-Romero, Álvaro; Bond, Andrew D.; García-Rodríguez, Raúl; Wright, Dominic S. Coordination chemistry of the bench-stable tris-2-pyridyl pnictogen ligands [E(6-Me-2-py)<sub>3</sub>] (E = As, As[double bond, length as m-dash]O, Sb). Dalton transactions (Cambridge, England : 2003), 2021, 50, 2393-2402
7705810	CIF	C72 H49 Cl4 N15 P2 Pt	P n m a	12.7351; 29.6484; 17.6754 90; 90; 90	6673.8	Kuzniak-Glanowska, Emilia; Glosz, Dorota; Niedzielski, Grzegorz; Kobylarczyk, Jedrzej; Srebro-Hooper, Monika; Hooper, James G. M.; Podgajny, Robert Binding of anionic Pt(ii) complexes in a dedicated organic matrix: towards new binary crystalline composites. Dalton transactions (Cambridge, England : 2003), 2021, 50, 170-185
7705811	CIF	C72 H49 Br4 N15 P2 Pt	P n m a	12.8291; 30.0209; 17.6145 90; 90; 90	6784.1	Kuzniak-Glanowska, Emilia; Glosz, Dorota; Niedzielski, Grzegorz; Kobylarczyk, Jedrzej; Srebro-Hooper, Monika; Hooper, James G. M.; Podgajny, Robert Binding of anionic Pt(ii) complexes in a dedicated organic matrix: towards new binary crystalline composites. Dalton transactions (Cambridge, England : 2003), 2021, 50, 170-185
7705812	CIF	C48 H40 Br4 P2 Pt	P -1	10.165; 14.041; 14.832 91.767; 92.28; 101.67	2070	Kuzniak-Glanowska, Emilia; Glosz, Dorota; Niedzielski, Grzegorz; Kobylarczyk, Jedrzej; Srebro-Hooper, Monika; Hooper, James G. M.; Podgajny, Robert Binding of anionic Pt(ii) complexes in a dedicated organic matrix: towards new binary crystalline composites. Dalton transactions (Cambridge, England : 2003), 2021, 50, 170-185
7705813	CIF	C55.5 H88 Cu5 Dy4 N12 O33.5	I 1 2/m 1	13.1964; 18.9068; 18.3821 90; 98.374; 90	4537.5	Dermitzaki, Despina; Raptopoulou, Catherine P.; Psycharis, Vassilis; Escuer, Albert; Perlepes, Spyros P.; Mayans, Julia; Stamatatos, Theocharis C. Further synthetic investigation of the general lanthanoid(iii) [Ln(iii)]/copper(ii)/pyridine-2,6-dimethanol/carboxylate reaction system: {CuLn} coordination clusters (Ln = Dy, Tb, Ho) and their yttrium(iii) analogue. Dalton transactions (Cambridge, England : 2003), 2021, 50, 240-251
7705814	CIF	C14 H14 N4 O4	P 1 21/n 1	9.6205; 8.0817; 9.8959 90; 114.017; 90	702.79	Dermitzaki, Despina; Raptopoulou, Catherine P.; Psycharis, Vassilis; Escuer, Albert; Perlepes, Spyros P.; Mayans, Julia; Stamatatos, Theocharis C. Further synthetic investigation of the general lanthanoid(iii) [Ln(iii)]/copper(ii)/pyridine-2,6-dimethanol/carboxylate reaction system: {CuLn} coordination clusters (Ln = Dy, Tb, Ho) and their yttrium(iii) analogue. Dalton transactions (Cambridge, England : 2003), 2021, 50, 240-251
7705815	CIF	C60 H100 Cu5 N6 O32 Y4	P -1	11.8882; 13.9025; 14.6268 109.848; 103.739; 102.604	2087.3	Dermitzaki, Despina; Raptopoulou, Catherine P.; Psycharis, Vassilis; Escuer, Albert; Perlepes, Spyros P.; Mayans, Julia; Stamatatos, Theocharis C. Further synthetic investigation of the general lanthanoid(iii) [Ln(iii)]/copper(ii)/pyridine-2,6-dimethanol/carboxylate reaction system: {CuLn} coordination clusters (Ln = Dy, Tb, Ho) and their yttrium(iii) analogue. Dalton transactions (Cambridge, England : 2003), 2021, 50, 240-251
7705816	CIF	C53 H55 Dy N4 O10	P 1 21/n 1	16.7403; 10.2716; 28.7185 90; 95.079; 90	4918.75	Zhang, Sheng; Shen, Nan; Zhang, Jiangwei; Xu, Fang; Zhang, Jin; Tang, Jiamin; Hu, Dengwei; Yin, Bing; Chen, Sanping Solvent responses and substituent effects upon magnetic properties of mononuclear Dy<sup>III</sup> compounds. Dalton transactions (Cambridge, England : 2003), 2021, 50, 624-637
7705817	CIF	C49 H47 Dy N4 O8	C 1 2/c 1	31.8697; 10.4652; 32.215 90; 115.13; 90	9727.4	Zhang, Sheng; Shen, Nan; Zhang, Jiangwei; Xu, Fang; Zhang, Jin; Tang, Jiamin; Hu, Dengwei; Yin, Bing; Chen, Sanping Solvent responses and substituent effects upon magnetic properties of mononuclear Dy<sup>III</sup> compounds. Dalton transactions (Cambridge, England : 2003), 2021, 50, 624-637
7705818	CIF	C49 H51 Dy N5 O9	C 1 2/c 1	29.3867; 15.1448; 21.454 90; 101.164; 90	9367.5	Zhang, Sheng; Shen, Nan; Zhang, Jiangwei; Xu, Fang; Zhang, Jin; Tang, Jiamin; Hu, Dengwei; Yin, Bing; Chen, Sanping Solvent responses and substituent effects upon magnetic properties of mononuclear Dy<sup>III</sup> compounds. Dalton transactions (Cambridge, England : 2003), 2021, 50, 624-637
7705819	CIF	C52 H53 Dy N4 O7	C 1 2/c 1	31.8719; 10.4645; 33.4231 90; 116.711; 90	9957.8	Zhang, Sheng; Shen, Nan; Zhang, Jiangwei; Xu, Fang; Zhang, Jin; Tang, Jiamin; Hu, Dengwei; Yin, Bing; Chen, Sanping Solvent responses and substituent effects upon magnetic properties of mononuclear Dy<sup>III</sup> compounds. Dalton transactions (Cambridge, England : 2003), 2021, 50, 624-637
7705832	CIF	C14 H10 Cl Eu O6	P 1 21/c 1	15.3572; 11.1641; 8.4085 90; 97.726; 90	1428.54	Li, Hong; Liu, Bing; Xu, Ling; Jiao, Huan A hetero-MOF-based bifunctional ratiometric fluorescent sensor for pH and water detection. Dalton transactions (Cambridge, England : 2003), 2021, 50, 143-150
7705883	CIF	C16 H21 Co Cu N3 O8	P 1 21/c 1	15.3056; 8.3802; 15.8983 90; 98.204; 90	2018.31	Li, Ang; Chamoreau, Lise-Marie; Baptiste, Benoît; Li, Yanling; Journaux, Yves; Lisnard, Laurent Solvothermal synthesis, structure and magnetic properties of heterometallic coordination polymers based on a phenolato-oxamato co-bidentate-tridentate ligand. Dalton transactions (Cambridge, England : 2003), 2021, 50, 681-688
7705884	CIF	C16 H21 Co0.78 Cu Mn0.22 N3 O8	P 1 21/c 1	15.2626; 8.4325; 16.0027 90; 98.269; 90	2038.17	Li, Ang; Chamoreau, Lise-Marie; Baptiste, Benoît; Li, Yanling; Journaux, Yves; Lisnard, Laurent Solvothermal synthesis, structure and magnetic properties of heterometallic coordination polymers based on a phenolato-oxamato co-bidentate-tridentate ligand. Dalton transactions (Cambridge, England : 2003), 2021, 50, 681-688
7705885	CIF	C16 H21 Cu Mn N3 O8	P 1 21/c 1	15.1715; 8.4796; 16.1749 90; 98.443; 90	2058.32	Li, Ang; Chamoreau, Lise-Marie; Baptiste, Benoît; Li, Yanling; Journaux, Yves; Lisnard, Laurent Solvothermal synthesis, structure and magnetic properties of heterometallic coordination polymers based on a phenolato-oxamato co-bidentate-tridentate ligand. Dalton transactions (Cambridge, England : 2003), 2021, 50, 681-688
7705902	CIF	C18 H12 Cu N6	P n a 21	25.6309; 3.625; 21.0696 90; 90; 90	1957.6	Zhao, Yan; Li, Lei; Ding, Bo; Wang, Xiu-Guang; Liu, Zheng-Yu; Yang, En-Cui; Zhao, Xiao-Jun Encapsulated anion-dominated photocatalytic and adsorption performances for organic dye degradation and oxoanion pollutant capture over cationic Cu(i)-organic framework semiconductors. Dalton transactions (Cambridge, England : 2003), 2021, 50, 197-207
7705903	CIF	C18 H16 Cl Cu N6 O6	P n a 21	25.868; 3.756; 20.661 90; 90; 90	2007.4	Zhao, Yan; Li, Lei; Ding, Bo; Wang, Xiu-Guang; Liu, Zheng-Yu; Yang, En-Cui; Zhao, Xiao-Jun Encapsulated anion-dominated photocatalytic and adsorption performances for organic dye degradation and oxoanion pollutant capture over cationic Cu(i)-organic framework semiconductors. Dalton transactions (Cambridge, England : 2003), 2021, 50, 197-207
7705917	CIF	C32 H32 B Cl2 F2 N5 Zn	P -1	9.2744; 9.748; 19.597 89.105; 85.816; 62.062	1560.7	Bhattacharyya, Arnab; Jameei, Aida; Saha, Rupak; Garai, Aditya; Karande, Anjali A.; Chakravarty, Akhil R. BODIPY-linked cis-dichlorido zinc(ii) conjugates: the strategic design of organelle-specific next-generation theranostic photosensitizers. Dalton transactions (Cambridge, England : 2003), 2021, 50, 103-115
7705918	CIF	C32 H30 B Cl2 F2 I2 N5 Zn	P -1	8.292; 14.512; 20.033 72.252; 82.738; 74.828	2213	Bhattacharyya, Arnab; Jameei, Aida; Saha, Rupak; Garai, Aditya; Karande, Anjali A.; Chakravarty, Akhil R. BODIPY-linked cis-dichlorido zinc(ii) conjugates: the strategic design of organelle-specific next-generation theranostic photosensitizers. Dalton transactions (Cambridge, England : 2003), 2021, 50, 103-115
7705925	CIF	C18 H11 Cl N2 S	P 1 21/c 1	11.565; 11.256; 11.423 90; 100.628; 90	1461.5	Mondal, Ashaparna; Sen, Utsav; Roy, Nilmadhab; Muthukumar, Venkatesan; Sahoo, Suban Kumar; Bose, Bipasha; Paira, Priyankar DNA targeting half sandwich Ru(II)-<i>p</i>-cymene-N^N complexes as cancer cell imaging and terminating agents: influence of regioisomers in cytotoxicity. Dalton transactions (Cambridge, England : 2003), 2021, 50, 979-997
7705926	CIF	C17 H10 Cl2 N O5 P W	P 21 21 21	9.085; 13.306; 16.74 90; 90; 90	2024	Junker, Philip; Qu, Zheng-Wang; Kalisch, Tim; Schnakenburg, Gregor; Espinosa Ferao, Arturo; Streubel, Rainer A case study on the conversion of Li/Cl phosphinidenoid into phosphinidene complexes. Dalton transactions (Cambridge, England : 2003), 2021, 50, 739-745
7705927	CIF	C34 H46 N2 O10 P2 W2	P -1	11.588; 11.8529; 16.5434 78.659; 82.857; 62.42	1973.28	Junker, Philip; Qu, Zheng-Wang; Kalisch, Tim; Schnakenburg, Gregor; Espinosa Ferao, Arturo; Streubel, Rainer A case study on the conversion of Li/Cl phosphinidenoid into phosphinidene complexes. Dalton transactions (Cambridge, England : 2003), 2021, 50, 739-745
7705928	CIF	C91 H126 N10 O9 S	P -1	18.519; 20.485; 23.872 75.864; 78.757; 83.012	8587	Zhang, Dan; Zhao, Jie; Cao, Liping; Yang, Dong; Chen, Bozhong; Yu, Le; Yang, Xiao-Juan; Wu, Biao Stepwise enhancement of fluorescence induced by anion coordination and non-covalent interactions. Dalton transactions (Cambridge, England : 2003), 2021, 50, 76-80
7705929	CIF	C80 H97 K2 N8 O20 P	P -1	12.111; 17.685; 25.349 74.055; 88.954; 74.796	5029.2	Zhang, Dan; Zhao, Jie; Cao, Liping; Yang, Dong; Chen, Bozhong; Yu, Le; Yang, Xiao-Juan; Wu, Biao Stepwise enhancement of fluorescence induced by anion coordination and non-covalent interactions. Dalton transactions (Cambridge, England : 2003), 2021, 50, 76-80
7705930	CIF	C74 H74 N10 O10 S2	P 1 21/n 1	9.5514; 29.487; 25.41 90; 95.276; 90	7126	Zhang, Dan; Zhao, Jie; Cao, Liping; Yang, Dong; Chen, Bozhong; Yu, Le; Yang, Xiao-Juan; Wu, Biao Stepwise enhancement of fluorescence induced by anion coordination and non-covalent interactions. Dalton transactions (Cambridge, England : 2003), 2021, 50, 76-80
7705931	CIF	C54 H62 B20 P2 S4	P 1 21/n 1	12.5156; 8.7984; 28.836 90; 100.346; 90	3123.7	Yuan, Run-Ze; Cui, Peng-Fei; Guo, Shu-Ting; Jin, Guo-Xin Regioselective B(3)-H bond activation based on an o-carboranyl dithiocarboxylate ligand and its derivatives. Dalton transactions (Cambridge, England : 2003), 2021, 50, 1060-1068
7705932	CIF	C16 H37 B20 Ir S4	P 1 21/c 1	12.2831; 19.6865; 13.465 90; 90.071; 90	3256	Yuan, Run-Ze; Cui, Peng-Fei; Guo, Shu-Ting; Jin, Guo-Xin Regioselective B(3)-H bond activation based on an o-carboranyl dithiocarboxylate ligand and its derivatives. Dalton transactions (Cambridge, England : 2003), 2021, 50, 1060-1068
7705933	CIF	C4 H14 B10 S2	P 1 21/n 1	6.743; 13.4145; 13.9386 90; 100.698; 90	1238.89	Yuan, Run-Ze; Cui, Peng-Fei; Guo, Shu-Ting; Jin, Guo-Xin Regioselective B(3)-H bond activation based on an o-carboranyl dithiocarboxylate ligand and its derivatives. Dalton transactions (Cambridge, England : 2003), 2021, 50, 1060-1068
7705934	CIF	C13 H26 B10 Cl Ir S2	P 1 21/c 1	13.3076; 13.6172; 13.4642 90; 114.273; 90	2224.19	Yuan, Run-Ze; Cui, Peng-Fei; Guo, Shu-Ting; Jin, Guo-Xin Regioselective B(3)-H bond activation based on an o-carboranyl dithiocarboxylate ligand and its derivatives. Dalton transactions (Cambridge, England : 2003), 2021, 50, 1060-1068
7705935	CIF	C13 H26 B10 Cl Rh S2	P 1 21/c 1	13.3454; 13.2555; 13.4524 90; 114.904; 90	2158.45	Yuan, Run-Ze; Cui, Peng-Fei; Guo, Shu-Ting; Jin, Guo-Xin Regioselective B(3)-H bond activation based on an o-carboranyl dithiocarboxylate ligand and its derivatives. Dalton transactions (Cambridge, England : 2003), 2021, 50, 1060-1068
7705936	CIF	C16 H37 B20 Rh S4	P 1 21/c 1	12.2938; 19.654; 13.4549 90; 90.096; 90	3251	Yuan, Run-Ze; Cui, Peng-Fei; Guo, Shu-Ting; Jin, Guo-Xin Regioselective B(3)-H bond activation based on an o-carboranyl dithiocarboxylate ligand and its derivatives. Dalton transactions (Cambridge, England : 2003), 2021, 50, 1060-1068
7705937	CIF	C20 H33 B10 Ir S3	P -1	8.1015; 9.9248; 17.6172 94.722; 99.047; 102.503	1355.74	Yuan, Run-Ze; Cui, Peng-Fei; Guo, Shu-Ting; Jin, Guo-Xin Regioselective B(3)-H bond activation based on an o-carboranyl dithiocarboxylate ligand and its derivatives. Dalton transactions (Cambridge, England : 2003), 2021, 50, 1060-1068
7705938	CIF	C14 H28 B10 Cl Ir S2	P -1	10.4735; 15.2045; 15.997 99.929; 104.054; 105.83	2298.4	Yuan, Run-Ze; Cui, Peng-Fei; Guo, Shu-Ting; Jin, Guo-Xin Regioselective B(3)-H bond activation based on an o-carboranyl dithiocarboxylate ligand and its derivatives. Dalton transactions (Cambridge, England : 2003), 2021, 50, 1060-1068
7705939	CIF	C28 H66 B30 Ir2 S4	P -1	8.347; 15.93; 21.753 102.28; 95.76; 112.81	2551	Yuan, Run-Ze; Cui, Peng-Fei; Guo, Shu-Ting; Jin, Guo-Xin Regioselective B(3)-H bond activation based on an o-carboranyl dithiocarboxylate ligand and its derivatives. Dalton transactions (Cambridge, England : 2003), 2021, 50, 1060-1068
7705940	CIF	C17 H39 B20 Ir S4	P 1 21/n 1	12.7778; 15.0383; 18.354 90; 108.269; 90	3349.1	Yuan, Run-Ze; Cui, Peng-Fei; Guo, Shu-Ting; Jin, Guo-Xin Regioselective B(3)-H bond activation based on an o-carboranyl dithiocarboxylate ligand and its derivatives. Dalton transactions (Cambridge, England : 2003), 2021, 50, 1060-1068
7705941	CIF	C23 H44 B20 Ir N S3	P b c a	9.176; 22.801; 34.588 90; 90; 90	7237	Yuan, Run-Ze; Cui, Peng-Fei; Guo, Shu-Ting; Jin, Guo-Xin Regioselective B(3)-H bond activation based on an o-carboranyl dithiocarboxylate ligand and its derivatives. Dalton transactions (Cambridge, England : 2003), 2021, 50, 1060-1068
7705942	CIF	C9 H129.44 Na18 O96.8 P9	P -1	11.8896; 20.6949; 22.3509 113.56; 90.6255; 104.866	4832.24	Kaur, Sandeep; Pramanik, Subhamay; Day, Victor W.; Bowman-James, Kristin Snapshots of "crystalline" salt-water solutions of inositol hexaphosphate conformers. Dalton transactions (Cambridge, England : 2003), 2021, 50, 480-484
7705943	CIF	C3 H31 Na4 O25 P3	P -1	7.7646; 12.0563; 13.745 77.893; 89.755; 89.088	1257.92	Kaur, Sandeep; Pramanik, Subhamay; Day, Victor W.; Bowman-James, Kristin Snapshots of "crystalline" salt-water solutions of inositol hexaphosphate conformers. Dalton transactions (Cambridge, England : 2003), 2021, 50, 480-484
7705944	CIF	C53 H44 Cu4 N6 O28	R -3 m :H	18.3936; 18.3936; 36.5323 90; 90; 120	10703.9	Xu, Tingting; He, Minghui; Fan, Lihui; Zhou, Ping; Jiang, Zhenzhen; He, Yabing Engineering ligand conformation by substituent manipulation towards diverse copper-tricarboxylate frameworks with tuned gas adsorption properties. Dalton transactions (Cambridge, England : 2003), 2021, 50, 638-646
7705945	CIF	C84 H122 Cu5 N12 O39	C 1 2/c 1	32.031; 18.235; 41.925 90; 95.246; 90	24385	Xu, Tingting; He, Minghui; Fan, Lihui; Zhou, Ping; Jiang, Zhenzhen; He, Yabing Engineering ligand conformation by substituent manipulation towards diverse copper-tricarboxylate frameworks with tuned gas adsorption properties. Dalton transactions (Cambridge, England : 2003), 2021, 50, 638-646
7705946	CIF	C34 H38 Dy2 N4 O16	P b c n	18.8341; 8.8537; 23.095 90; 90; 90	3851.1	Li, Dawei; Ding, Man-Man; Huang, Yuan; Tello Yepes, David Felipe; Li, Haiyan; Li, Yahong; Zhang, Yi-Quan; Yao, Jinlei Evolution from a single relaxation process to two-step relaxation processes of Dy<sub>2</sub> single-molecule magnets via the modulations of the terminal solvent ligands. Dalton transactions (Cambridge, England : 2003), 2021, 50, 217-228
7705947	CIF	C36 H42 Dy2 N4 O16	P b c n	18.6721; 9.0807; 23.3406 90; 90; 90	3957.5	Li, Dawei; Ding, Man-Man; Huang, Yuan; Tello Yepes, David Felipe; Li, Haiyan; Li, Yahong; Zhang, Yi-Quan; Yao, Jinlei Evolution from a single relaxation process to two-step relaxation processes of Dy<sub>2</sub> single-molecule magnets via the modulations of the terminal solvent ligands. Dalton transactions (Cambridge, England : 2003), 2021, 50, 217-228
7705948	CIF	C38 H44 Dy2 N6 O16	P 1 21/c 1	16.072; 16.4037; 18.1256 90; 100.123; 90	4704.2	Li, Dawei; Ding, Man-Man; Huang, Yuan; Tello Yepes, David Felipe; Li, Haiyan; Li, Yahong; Zhang, Yi-Quan; Yao, Jinlei Evolution from a single relaxation process to two-step relaxation processes of Dy<sub>2</sub> single-molecule magnets via the modulations of the terminal solvent ligands. Dalton transactions (Cambridge, England : 2003), 2021, 50, 217-228
7705949	CIF	C80 H114 Cl8 Dy4 N32 O51	P m -3 n	26.8985; 26.8985; 26.8985 90; 90; 90	19461.9	Wu, Jianfeng; Yang, Qianqian; Wang, Haoyu; Ge, Yan; Tang, Jinkui; Qi, Zhenhui Single-molecule magnets under dc field with an anion effect: self-assembly of pure dysprosium(iii) metallacycles. Dalton transactions (Cambridge, England : 2003), 2021, 50, 262-269
7705950	CIF	C25.77 H37.23 Dy2 N14.77 O19.23	P -1	11.6126; 13.7845; 14.7071 63.176; 88.794; 79.823	2063.23	Wu, Jianfeng; Yang, Qianqian; Wang, Haoyu; Ge, Yan; Tang, Jinkui; Qi, Zhenhui Single-molecule magnets under dc field with an anion effect: self-assembly of pure dysprosium(iii) metallacycles. Dalton transactions (Cambridge, England : 2003), 2021, 50, 262-269
7705951	CIF	C134 H212 Br12 Dy6 N48 O35	P 1 21/n 1	20.2137; 23.1408; 21.4891 90; 104.615; 90	9726.5	Wu, Jianfeng; Yang, Qianqian; Wang, Haoyu; Ge, Yan; Tang, Jinkui; Qi, Zhenhui Single-molecule magnets under dc field with an anion effect: self-assembly of pure dysprosium(iii) metallacycles. Dalton transactions (Cambridge, England : 2003), 2021, 50, 262-269
7705952	CIF	C91.5 H101 Dy4 F24 N34 O34 S8	C 1 2/c 1	25.3943; 26.5959; 43.3898 90; 96.012; 90	29143.6	Wu, Jianfeng; Yang, Qianqian; Wang, Haoyu; Ge, Yan; Tang, Jinkui; Qi, Zhenhui Single-molecule magnets under dc field with an anion effect: self-assembly of pure dysprosium(iii) metallacycles. Dalton transactions (Cambridge, England : 2003), 2021, 50, 262-269