Crystallography Open Database

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7248557 CIFC12 H14 N2 O2 S2P 21 21 2113.9471; 11.0713; 8.2857
90; 90; 90
1279.42Yeo, Chien Ing; Kwong, Huey Chong; Tan, Sang Loon; Tiekink, Edward R. T.
Variable non-covalent interactions in the crystals of a series of 4-Y-benzyl pyrrolidine-1-carbodithioates: Y = Cl, Br, I, Me and NO2
CrystEngComm, 2024
7248558 CIFC12 H14 I N S2P 1 21/n 112.0797; 9.725; 12.7025
90; 117.262; 90
1326.47Yeo, Chien Ing; Kwong, Huey Chong; Tan, Sang Loon; Tiekink, Edward R. T.
Variable non-covalent interactions in the crystals of a series of 4-Y-benzyl pyrrolidine-1-carbodithioates: Y = Cl, Br, I, Me and NO2
CrystEngComm, 2024
7248559 CIFC13 H17 N S2P 1 21/n 112.4564; 5.9662; 17.6358
90; 101.17; 90
1285.82Yeo, Chien Ing; Kwong, Huey Chong; Tan, Sang Loon; Tiekink, Edward R. T.
Variable non-covalent interactions in the crystals of a series of 4-Y-benzyl pyrrolidine-1-carbodithioates: Y = Cl, Br, I, Me and NO2
CrystEngComm, 2024
7248560 CIFC12 H14 Br N S2P 1 21/n 112.1754; 9.6431; 12.347
90; 117.889; 90
1281.28Yeo, Chien Ing; Kwong, Huey Chong; Tan, Sang Loon; Tiekink, Edward R. T.
Variable non-covalent interactions in the crystals of a series of 4-Y-benzyl pyrrolidine-1-carbodithioates: Y = Cl, Br, I, Me and NO2
CrystEngComm, 2024
7248562 CIFC64 H62 N8 O13 Zn2P -112.3978; 13.197; 21.5304
76.78; 75.297; 62.998
3009.5Teng, Yu-Kang; Wu, Qian; Sun, Yao; Wang, Chen; Zhang, Rui; Lu, Zhen-Zhong
Mixed matrix membranes based on fluorescent coordination polymers for the detection of Cr2O72− in water
CrystEngComm, 2024
7248563 CIFC46 H45 Cd2 N6 O10P 1 21/n 113.1661; 20.0691; 17.0366
90; 104.96; 90
4349.03Teng, Yu-Kang; Wu, Qian; Sun, Yao; Wang, Chen; Zhang, Rui; Lu, Zhen-Zhong
Mixed matrix membranes based on fluorescent coordination polymers for the detection of Cr2O72− in water
CrystEngComm, 2024
7248564 CIFC56 H48 N8 O8 Zn2P -111.9919; 16.8356; 17.173
64.117; 79.161; 77.41
3027.2Teng, Yu-Kang; Wu, Qian; Sun, Yao; Wang, Chen; Zhang, Rui; Lu, Zhen-Zhong
Mixed matrix membranes based on fluorescent coordination polymers for the detection of Cr2O72− in water
CrystEngComm, 2024
7248565 CIFC25 H24 F N3 O7C 1 2/c 132.213; 7.738; 19.107
90; 103.238; 90
4636Zhu, Yujun; Liu, Ruoxi; Wang, Leyao; Chen, Chen; Zhao, Yupei; Guo, Wei; Zhang, Zhi-Hui
Ciprofloxacin salts of benzene mono/di-carboxylate: Crystal structures and the improvement of solubility
CrystEngComm, 2024
7248566 CIFC21 H27 F N3 O8P -17.311; 11.567; 13.026
95.552; 98.49; 92.972
1081.9Zhu, Yujun; Liu, Ruoxi; Wang, Leyao; Chen, Chen; Zhao, Yupei; Guo, Wei; Zhang, Zhi-Hui
Ciprofloxacin salts of benzene mono/di-carboxylate: Crystal structures and the improvement of solubility
CrystEngComm, 2024
7248567 CIFC69 H70 F2 N6 O23P -19.194; 12.72; 14.712
82.783; 77.177; 76.989
1629.4Zhu, Yujun; Liu, Ruoxi; Wang, Leyao; Chen, Chen; Zhao, Yupei; Guo, Wei; Zhang, Zhi-Hui
Ciprofloxacin salts of benzene mono/di-carboxylate: Crystal structures and the improvement of solubility
CrystEngComm, 2024
7248568 CIFC29 H21 Cl6 F N3 O9P -19.2235; 11.3207; 15.6694
89.989; 75.496; 85.944
1579.8Zhu, Yujun; Liu, Ruoxi; Wang, Leyao; Chen, Chen; Zhao, Yupei; Guo, Wei; Zhang, Zhi-Hui
Ciprofloxacin salts of benzene mono/di-carboxylate: Crystal structures and the improvement of solubility
CrystEngComm, 2024
7248569 CIFC84 H94 F4 N12 O25P -110.5368; 13.7042; 15.0079
84.737; 86.232; 69.254
2016.8Zhu, Yujun; Liu, Ruoxi; Wang, Leyao; Chen, Chen; Zhao, Yupei; Guo, Wei; Zhang, Zhi-Hui
Ciprofloxacin salts of benzene mono/di-carboxylate: Crystal structures and the improvement of solubility
CrystEngComm, 2024
7248570 CIFC20 H14 N2 O6P -19.0499; 9.5985; 11.2088
64.656; 78.043; 66.903
808.51Yin, Pei-Pei; Chen, Yu-E; Diao, Jia-Wei; Cheng, Yi-Yang; Yang, Xiao-Gang; Liu, Baozhong; Ma, Lufang
Facile synthesis of 2,5-dihydroxyterephthalic acid based charge transfer cocrystal for photoelectric applications
CrystEngComm, 2024
7248571 CIFC15 H16 N2 O5P -17.456; 8.475; 11.895
82.16; 76.38; 71.47
691.1Nag, Sayak; Emmerling, Franziska; Tothadie, Srinu; Bhattacharya, Biswajit; Ghosh, Soumyajit
Distinct Photomechanical Responses of Two new 1,3-Dimethylbarbituric Acid Derivative Crystals
CrystEngComm, 2024
7248572 CIFC16 H16 N2 O4P -17.0505; 8.0193; 13.9507
81.526; 88.415; 70.313
734.35Nag, Sayak; Emmerling, Franziska; Tothadie, Srinu; Bhattacharya, Biswajit; Ghosh, Soumyajit
Distinct Photomechanical Responses of Two new 1,3-Dimethylbarbituric Acid Derivative Crystals
CrystEngComm, 2024
7248573 CIFF4 K2 Mn O3 PP 1 21/c 16.7599; 7.3998; 13.9289
90; 112.268; 90
644.79Luo, Qi; Li, Ningxia; Zhao, Zhiying; Cui, Meiyan; He, Zhangzhen
Synthesis and magnetic properties of two fluorophosphates K2Mn(PO3F)F3 and Na2Mn(HPO4)F3 with a S = 2 uniform spin chain structure
CrystEngComm, 2024
7248574 CIFF3 H Mn Na2 O4 PP 1 21/m 15.6785; 7.7011; 6.8171
90; 109.673; 90
280.72Luo, Qi; Li, Ningxia; Zhao, Zhiying; Cui, Meiyan; He, Zhangzhen
Synthesis and magnetic properties of two fluorophosphates K2Mn(PO3F)F3 and Na2Mn(HPO4)F3 with a S = 2 uniform spin chain structure
CrystEngComm, 2024
7248579 CIFC50 H63 Cd N5 O5P 1 21/c 110.0955; 40.9697; 11.4889
90; 98.139; 90
4704.1Trofimova, Olesya Yur'evna; Meshcheryakova, Irina N.; Druzhkov, Nikolai; Ershova, Irina V.; Maleeva, Aryna Valer'evna; Cherkasov, Anton Vladimirovich; Yakushev, Ilya; Dorovatovskii, Pavel; Aysin, Rinat R.; Piskunov, Alexandr Vladimirovich
STRUCTURAL DIVERSITY OF CADMIUM COORDINATION POLYMERS BASED ON THE EXTENDED ANILATE-TYPE LIGAND
CrystEngComm, 2024
7248580 CIFC53 H70 Cd N6 O6P -112.445; 15.1029; 15.5578
94.759; 113.19; 103.711
2559.9Trofimova, Olesya Yur'evna; Meshcheryakova, Irina N.; Druzhkov, Nikolai; Ershova, Irina V.; Maleeva, Aryna Valer'evna; Cherkasov, Anton Vladimirovich; Yakushev, Ilya; Dorovatovskii, Pavel; Aysin, Rinat R.; Piskunov, Alexandr Vladimirovich
STRUCTURAL DIVERSITY OF CADMIUM COORDINATION POLYMERS BASED ON THE EXTENDED ANILATE-TYPE LIGAND
CrystEngComm, 2024
7248581 CIFC37 H49 Cd N3 O5P 1 21/n 116.372; 10.139; 22.227
90; 101.261; 90
3619Trofimova, Olesya Yur'evna; Meshcheryakova, Irina N.; Druzhkov, Nikolai; Ershova, Irina V.; Maleeva, Aryna Valer'evna; Cherkasov, Anton Vladimirovich; Yakushev, Ilya; Dorovatovskii, Pavel; Aysin, Rinat R.; Piskunov, Alexandr Vladimirovich
STRUCTURAL DIVERSITY OF CADMIUM COORDINATION POLYMERS BASED ON THE EXTENDED ANILATE-TYPE LIGAND
CrystEngComm, 2024
7248582 CIFC80 H110 Cd N12 O8P -110.7318; 14.111; 14.3004
64.885; 72.876; 75.908
1856.3Trofimova, Olesya Yur'evna; Meshcheryakova, Irina N.; Druzhkov, Nikolai; Ershova, Irina V.; Maleeva, Aryna Valer'evna; Cherkasov, Anton Vladimirovich; Yakushev, Ilya; Dorovatovskii, Pavel; Aysin, Rinat R.; Piskunov, Alexandr Vladimirovich
STRUCTURAL DIVERSITY OF CADMIUM COORDINATION POLYMERS BASED ON THE EXTENDED ANILATE-TYPE LIGAND
CrystEngComm, 2024
7248583 CIFC42 H53 Cd N4 O5P -110.0555; 13.6937; 17.1536
92.456; 106.837; 106.896
2142.2Trofimova, Olesya Yur'evna; Meshcheryakova, Irina N.; Druzhkov, Nikolai; Ershova, Irina V.; Maleeva, Aryna Valer'evna; Cherkasov, Anton Vladimirovich; Yakushev, Ilya; Dorovatovskii, Pavel; Aysin, Rinat R.; Piskunov, Alexandr Vladimirovich
STRUCTURAL DIVERSITY OF CADMIUM COORDINATION POLYMERS BASED ON THE EXTENDED ANILATE-TYPE LIGAND
CrystEngComm, 2024
7248584 CIFC42 H58 Cd N4 O6P 1 21/c 110.664; 42.973; 9.228
90; 97.349; 90
4194.1Trofimova, Olesya Yur'evna; Meshcheryakova, Irina N.; Druzhkov, Nikolai; Ershova, Irina V.; Maleeva, Aryna Valer'evna; Cherkasov, Anton Vladimirovich; Yakushev, Ilya; Dorovatovskii, Pavel; Aysin, Rinat R.; Piskunov, Alexandr Vladimirovich
STRUCTURAL DIVERSITY OF CADMIUM COORDINATION POLYMERS BASED ON THE EXTENDED ANILATE-TYPE LIGAND
CrystEngComm, 2024
7248585 CIFC48 H34 N8 O21 Zn3C 1 2/c 114.3702; 13.3514; 24.3154
90; 94.535; 90
4650.6Chen, Qiang; Zhao, Chenzhu; Li, Xu-Sheng; Liu, Hua; Chen, Jiao; Li, Quan-Quan; Liu, Ping; Wang, Yao-Yu
Accelerating interfacial charge transfer and photocatalytic activity of Z-scheme Zn-MOF/GO heterojunction towards the removal of Cr(VI) and methylene blue
CrystEngComm, 2024
7248586 CIFC8 H8 N2 O2 SF d d 222.635; 18.2458; 8.4549
90; 90; 90
3491.8Shaiwale, Mayuri; Narayan, Som; Jha, Prafulla K.; Ballabh, Amar
A simple and efficient synthesis of a series of N -(thiazol-2-yl)piperidine-2,6-dione compounds and their interesting NLO properties
CrystEngComm, 2024
7248587 CIFC9 H10 N2 O2 SP n a 2117.3234; 6.5197; 8.7737
90; 90; 90
990.93Shaiwale, Mayuri; Narayan, Som; Jha, Prafulla K.; Ballabh, Amar
A simple and efficient synthesis of a series of N -(thiazol-2-yl)piperidine-2,6-dione compounds and their interesting NLO properties
CrystEngComm, 2024
7248588 CIFC9 H10 N2 O2 SP 1 21/c 110.4402; 9.0667; 10.6841
90; 103.828; 90
982Shaiwale, Mayuri; Narayan, Som; Jha, Prafulla K.; Ballabh, Amar
A simple and efficient synthesis of a series of N -(thiazol-2-yl)piperidine-2,6-dione compounds and their interesting NLO properties
CrystEngComm, 2024
7248589 CIFC10 H12 N2 O2 SP b c a11.0048; 9.1927; 21.2407
90; 90; 90
2148.8Shaiwale, Mayuri; Narayan, Som; Jha, Prafulla K.; Ballabh, Amar
A simple and efficient synthesis of a series of N -(thiazol-2-yl)piperidine-2,6-dione compounds and their interesting NLO properties
CrystEngComm, 2024
7248590 CIFC12 H10 N2 O2 SP b c a10.7717; 9.2453; 23.0901
90; 90; 90
2299.5Shaiwale, Mayuri; Narayan, Som; Jha, Prafulla K.; Ballabh, Amar
A simple and efficient synthesis of a series of N -(thiazol-2-yl)piperidine-2,6-dione compounds and their interesting NLO properties
CrystEngComm, 2024
7248597 CIFC8 H20 I3 NP n m a14.5312; 13.8795; 15.1632
90; 90; 90
3058.2Hamdouni, Monia; Hrizi, Chakib; Esghaier, Mohsen Ouled Mohamed; Knorr, Michael; Strohmann, Carsten; Chaabouni, Slaheddine
Molecular self-assembly of 1D linear and 2D T-shape polyiodide arrangements in two organic ammonium triiodide salts: supramolecular structures and density functional theory-based optical properties
CrystEngComm, 2024
7248598 CIFC7 H12 I3 N2 O0.5P 1 2/c 116.9466; 6.0287; 13.6214
90; 97.621; 90
1379.35Hamdouni, Monia; Hrizi, Chakib; Esghaier, Mohsen Ouled Mohamed; Knorr, Michael; Strohmann, Carsten; Chaabouni, Slaheddine
Molecular self-assembly of 1D linear and 2D T-shape polyiodide arrangements in two organic ammonium triiodide salts: supramolecular structures and density functional theory-based optical properties
CrystEngComm, 2024
7248599 CIFC21 H30 Cd N5 O12 PP 1 21 18.6015; 11.121; 13.895
90; 90.292; 90
1329.1Khan, Yaqoot; Ismail, Ismail; Ma, Hongwei; Li, Zhongkui; Li, Hui
Sugar–nucleobase hydrogen bonding in cytidine 5′-monophosphate nucleotide-cadmium coordination complexes
CrystEngComm, 2024
7248600 CIFC30 H44 Cd N8 O21 P2P 21 21 2113.813; 14.472; 20.721
90; 90; 90
4142Khan, Yaqoot; Ismail, Ismail; Ma, Hongwei; Li, Zhongkui; Li, Hui
Sugar–nucleobase hydrogen bonding in cytidine 5′-monophosphate nucleotide-cadmium coordination complexes
CrystEngComm, 2024
7248601 CIFC19 H34 Cd N7 O15 PP 1 21 19.3779; 12.2117; 13.625
90; 106.071; 90
1499.4Khan, Yaqoot; Ismail, Ismail; Ma, Hongwei; Li, Zhongkui; Li, Hui
Sugar–nucleobase hydrogen bonding in cytidine 5′-monophosphate nucleotide-cadmium coordination complexes
CrystEngComm, 2024
7248602 CIFC21 H32 Cd N5 O13 PP 1 21 18.31; 11.901; 14.109
90; 92.58; 90
1393.9Khan, Yaqoot; Ismail, Ismail; Ma, Hongwei; Li, Zhongkui; Li, Hui
Sugar–nucleobase hydrogen bonding in cytidine 5′-monophosphate nucleotide-cadmium coordination complexes
CrystEngComm, 2024
7248603 CIFC28 H43 Cd N10 O20 P2P 21 21 2113.5898; 14.6787; 21.008
90; 90; 90
4190.7Khan, Yaqoot; Ismail, Ismail; Ma, Hongwei; Li, Zhongkui; Li, Hui
Sugar–nucleobase hydrogen bonding in cytidine 5′-monophosphate nucleotide-cadmium coordination complexes
CrystEngComm, 2024
7248604 CIFC40 H34 Cd1.5 Cl N8 O8C 1 2/c 134.707; 11.0408; 21.7951
90; 102.202; 90
8163.1Wu, Yu; Li, Junlan; Xu, Jing; Muddassir, Mohammad; Kushwaha, Aparna; Daniel, Omoding; Kumar, Abhinav; Zou, Like
4,4'-bis(imidazolyl)biphenyl appended Cd(II) coordination polymer: A dual functional material for antibiotic sensing and photodegradation
CrystEngComm, 2024
7248608 CIFC42 H34 N3 O24 P3 Zn4P -17.386; 15.868; 19.198
103.38; 95.61; 99.79
2134.9Chen, Xi; Chen, Zi-tong; Xu, Shixian; Chen, Yuan; Tong, Jia-Ping; Li, Bao
A Self-Assembled Metal-Organic Framework for Enhanced UO22+ Fluorescent Sensing: Integration of Octa-Nuclear Zinc Cluster with Hexakis(4-Carboxyphenoxy)Cyclotriphosphazene
CrystEngComm, 2024
7248609 CIFC5 H13 Cl N2 O4P 43 21 28.1484; 8.1484; 26.8449
90; 90; 90
1782.41Yang, Shu-Jing; Bai, Yong-Ju; Qi, Jun-Chao; Huang, Xiao-Yun; Shen, Xin; Lu, Yan-Zi; Xia, Zhang-Tian; Lv, Hui-Peng; Liao, Wei-Qiang
A homochiral polar molecular piezoelectric material with phase transition and high piezoelectricity precisely designed by cyanomethyl group substitution
CrystEngComm, 2024
7248610 CIFC9 H15 Cl N4 O4P 1 21 113.9407; 7.4715; 18.8287
90; 106.62; 90
1879.23Yang, Shu-Jing; Bai, Yong-Ju; Qi, Jun-Chao; Huang, Xiao-Yun; Shen, Xin; Lu, Yan-Zi; Xia, Zhang-Tian; Lv, Hui-Peng; Liao, Wei-Qiang
A homochiral polar molecular piezoelectric material with phase transition and high piezoelectricity precisely designed by cyanomethyl group substitution
CrystEngComm, 2024
7248611 CIFC9 H15 Cl N4 O4P 1 21 18.8528; 7.5471; 9.7043
90; 97.654; 90
642.6Yang, Shu-Jing; Bai, Yong-Ju; Qi, Jun-Chao; Huang, Xiao-Yun; Shen, Xin; Lu, Yan-Zi; Xia, Zhang-Tian; Lv, Hui-Peng; Liao, Wei-Qiang
A homochiral polar molecular piezoelectric material with phase transition and high piezoelectricity precisely designed by cyanomethyl group substitution
CrystEngComm, 2024
7248612 CIFC16 H26 Br Cu S2C 1 2/c 131.366; 10.0042; 22.8146
90; 96.959; 90
7106.3Knorr, Michael; Viau, Lydie; Knauer, Lena; Strohman, Carsten; Rousselin, Yoann; Kubicki, Marek
Polymeric CuX coordination compounds assembled by acetylenic thioether ligands RSCH2C≡CCH2R (R = C6H11, t-Bu): Effect of the RS-group, halide and stoichiometry on the network architecture and the luminescence properties
CrystEngComm, 2024
7248613 CIFC12 H22 Cl2 Cu S2P -18.7545; 10.0042; 11.2498
64.22; 70.764; 82.779
837.5Knorr, Michael; Viau, Lydie; Knauer, Lena; Strohman, Carsten; Rousselin, Yoann; Kubicki, Marek
Polymeric CuX coordination compounds assembled by acetylenic thioether ligands RSCH2C≡CCH2R (R = C6H11, t-Bu): Effect of the RS-group, halide and stoichiometry on the network architecture and the luminescence properties
CrystEngComm, 2024
7248614 CIFC24 H44 Br2 Cu2 S4P 1 21 18.7637; 15.977; 11.262
90; 97.425; 90
1563.7Knorr, Michael; Viau, Lydie; Knauer, Lena; Strohman, Carsten; Rousselin, Yoann; Kubicki, Marek
Polymeric CuX coordination compounds assembled by acetylenic thioether ligands RSCH2C≡CCH2R (R = C6H11, t-Bu): Effect of the RS-group, halide and stoichiometry on the network architecture and the luminescence properties
CrystEngComm, 2024
7248615 CIFC12 H22 Cl Cu S2P 1 21/c 112.0784; 9.6471; 13.6377
90; 107.326; 90
1516.98Knorr, Michael; Viau, Lydie; Knauer, Lena; Strohman, Carsten; Rousselin, Yoann; Kubicki, Marek
Polymeric CuX coordination compounds assembled by acetylenic thioether ligands RSCH2C≡CCH2R (R = C6H11, t-Bu): Effect of the RS-group, halide and stoichiometry on the network architecture and the luminescence properties
CrystEngComm, 2024
7248616 CIFC16 H26 Cl Cu S2P 1 21/c 111.3631; 9.2959; 17.5929
90; 107.327; 90
1774.01Knorr, Michael; Viau, Lydie; Knauer, Lena; Strohman, Carsten; Rousselin, Yoann; Kubicki, Marek
Polymeric CuX coordination compounds assembled by acetylenic thioether ligands RSCH2C≡CCH2R (R = C6H11, t-Bu): Effect of the RS-group, halide and stoichiometry on the network architecture and the luminescence properties
CrystEngComm, 2024
7248617 CIFC24 H44 Cu4 I4 S4P 21 21 219.9428; 18.9973; 19.2437
90; 90; 90
3634.9Knorr, Michael; Viau, Lydie; Knauer, Lena; Strohman, Carsten; Rousselin, Yoann; Kubicki, Marek
Polymeric CuX coordination compounds assembled by acetylenic thioether ligands RSCH2C≡CCH2R (R = C6H11, t-Bu): Effect of the RS-group, halide and stoichiometry on the network architecture and the luminescence properties
CrystEngComm, 2024
7248618 CIFC12 H22 Cu I S2P 1 21/c 111.4251; 16.2605; 8.8793
90; 99.638; 90
1626.29Knorr, Michael; Viau, Lydie; Knauer, Lena; Strohman, Carsten; Rousselin, Yoann; Kubicki, Marek
Polymeric CuX coordination compounds assembled by acetylenic thioether ligands RSCH2C≡CCH2R (R = C6H11, t-Bu): Effect of the RS-group, halide and stoichiometry on the network architecture and the luminescence properties
CrystEngComm, 2024
7248619 CIFC8 H14 Br2 Cu N SP 1 21/n 18.1661; 10.2416; 15.1301
90; 98.034; 90
1252.97Knorr, Michael; Viau, Lydie; Knauer, Lena; Strohman, Carsten; Rousselin, Yoann; Kubicki, Marek
Polymeric CuX coordination compounds assembled by acetylenic thioether ligands RSCH2C≡CCH2R (R = C6H11, t-Bu): Effect of the RS-group, halide and stoichiometry on the network architecture and the luminescence properties
CrystEngComm, 2024
7248620 CIFC16 H26 Cu I S2C 1 2/c 131.853; 10.1612; 22.91
90; 96.804; 90
7362.9Knorr, Michael; Viau, Lydie; Knauer, Lena; Strohman, Carsten; Rousselin, Yoann; Kubicki, Marek
Polymeric CuX coordination compounds assembled by acetylenic thioether ligands RSCH2C≡CCH2R (R = C6H11, t-Bu): Effect of the RS-group, halide and stoichiometry on the network architecture and the luminescence properties
CrystEngComm, 2024

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