Crystallography Open Database

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1567140 CIFC12 H12 N4 Ni O4 SC 1 c 128.3729; 6.5464; 7.3531
90; 97.1; 90
1355.29González Guillén, Anabel B.; Konieczny, Piotr; Luberda-Durnaś, Katarzyna; Oszajca, Marcin; Kozieł, Marcin; Łasocha, Wiesław
Tuning magnetic properties by crystal engineering in a family of coordination polymers based on Ni(ii) sulphates
New Journal of Chemistry, 2022, 46, 14786-14792
1567141 CIFC12 H16 N4 Ni O4 SI 1 2/a 123.012; 6.0848; 10.6386
90; 91.194; 90
1489.3González Guillén, Anabel B.; Konieczny, Piotr; Luberda-Durnaś, Katarzyna; Oszajca, Marcin; Kozieł, Marcin; Łasocha, Wiesław
Tuning magnetic properties by crystal engineering in a family of coordination polymers based on Ni(ii) sulphates
New Journal of Chemistry, 2022, 46, 14786-14792
1567142 CIFC6 H8 N2 Ni O4 SC m c m6.476; 7.2221; 16.615
90; 90; 90
777.09González Guillén, Anabel B.; Konieczny, Piotr; Luberda-Durnaś, Katarzyna; Oszajca, Marcin; Kozieł, Marcin; Łasocha, Wiesław
Tuning magnetic properties by crystal engineering in a family of coordination polymers based on Ni(ii) sulphates
New Journal of Chemistry, 2022, 46, 14786-14792
1567719 CIFC14 H11 N O SP 1 21/c 19.6609; 6.3361; 19.6298
90; 96.172; 90
1194.62Dhara, Samiran; Saha, Moumita; Das, Asish R.
Ligand-free access to benzisothiazolones and benzisoselenazolones through NiFe <sub>2</sub> O <sub>4</sub> catalyzed concomitant annulation of 2-halobenzanilides with chalcogens and their late-stage transformations
New Journal of Chemistry, 2022, 46, 19501-19513
7061065 CIFC29 H27 N O4P 1 21/n 113.578; 11.198; 15.831
90; 94.443; 90
2399.8Hazarika, Hemanta; Chutia, Kangkana; Das, Babulal; Gogoi, Pranjal
One-pot synthesis of 3-substituted-3-hydroxyindolin-2-ones: three component coupling of N-protected isatin, aryne precursor and 1,3-cyclodione under metal-free conditions
New Journal of Chemistry, 2022, 46, 86-96
7061067 CIFC30 H32.5 N4 O5.25P 1 21/c 19.7391; 25.2387; 11.2459
90; 93.42; 90
2759.3Shatokhin, Stanislav S.; Tuskaev, Vladislav A.; Gagieva, Svetlana Ch.; Markova, Alina A.; Pozdnyakov, Dmitry I.; Denisov, Gleb L.; Melnikova, Elizaveta K.; Bulychev, Boris M.; Oganesyan, Eduard T.
Synthesis, cytotoxicity and antioxidant activity of new 1,3-dimethyl-8-(chromon-3-yl)-xanthine derivatives containing 2,6-di-tert-butylphenol fragments
New Journal of Chemistry, 2022, 46, 621-631
7061068 CIFC114 H108 Al Cl4 N64 O53I 1 2/c 128.162; 22.226; 28.39
90; 90.21; 90
17770Luo, Guangyan; Meng, Ye; Zhang, Lin; Li, Xiaoyue; Tao, Zhu; Zhang, Qianjun
Selective recognition of aluminum ions using an esculetin@Q[8] host–guest supramolecular fluorescent probe
New Journal of Chemistry, 2022, 46, 97-102
7061080 CIFC38 H35 O6 SnP -111.815; 11.9686; 12.7177
67.247; 78.484; 85.626
1625.06Kaur, Kulwinder; Singh, Raghubir; Kaur, Varinder; Capalash, Neena
Water stable fluorescent organotin(iv) compounds: aggregation induced emission enhancement and recognition of lead ions in an aqueous system
New Journal of Chemistry, 2022, 46, 148-161
7061081 CIFC40 H40 O6 SnP -18.2279; 12.1695; 18.0429
85.696; 89.597; 75.392
1743.16Kaur, Kulwinder; Singh, Raghubir; Kaur, Varinder; Capalash, Neena
Water stable fluorescent organotin(iv) compounds: aggregation induced emission enhancement and recognition of lead ions in an aqueous system
New Journal of Chemistry, 2022, 46, 148-161
7061082 CIFC40 H40 O6 SnP -18.2415; 12.1785; 18.0555
85.719; 89.598; 75.364
1748.39Kaur, Kulwinder; Singh, Raghubir; Kaur, Varinder; Capalash, Neena
Water stable fluorescent organotin(iv) compounds: aggregation induced emission enhancement and recognition of lead ions in an aqueous system
New Journal of Chemistry, 2022, 46, 148-161
7061083 CIFC34 H28 O6 SnP 1 21/c 111.5018; 14.9532; 17.597
90; 99.344; 90
2986.33Kaur, Kulwinder; Singh, Raghubir; Kaur, Varinder; Capalash, Neena
Water stable fluorescent organotin(iv) compounds: aggregation induced emission enhancement and recognition of lead ions in an aqueous system
New Journal of Chemistry, 2022, 46, 148-161
7061084 CIFC34 H32 O8 SnP 1 21/n 19.466; 16.2902; 19.8338
90; 98.453; 90
3025.21Kaur, Kulwinder; Singh, Raghubir; Kaur, Varinder; Capalash, Neena
Water stable fluorescent organotin(iv) compounds: aggregation induced emission enhancement and recognition of lead ions in an aqueous system
New Journal of Chemistry, 2022, 46, 148-161
7061088 CIFC24 H27 Br N2 O6P -110.1274; 10.9703; 11.701
105.831; 108.602; 98.017
1148.2Wang, Rui; Zhang, Wei; Tang, Ying; Qi, Ze-Hui; Yu, Yuan-Hui; Tan, Hong-Bo; Tang, Dian-Yong; Xu, Zhi-Gang; Chen, Zhong-Zhu
A four-component domino reaction for the synthesis of novel bridgehead nitrogen-containing pyrido[1,2-d][1,4]diazepines
New Journal of Chemistry, 2022, 46, 592-598
7061089 CIFC34 H32 N2 O6P -19.569; 10.7671; 14.771
95.207; 105.767; 94.81
1449.2Wang, Rui; Zhang, Wei; Tang, Ying; Qi, Ze-Hui; Yu, Yuan-Hui; Tan, Hong-Bo; Tang, Dian-Yong; Xu, Zhi-Gang; Chen, Zhong-Zhu
A four-component domino reaction for the synthesis of novel bridgehead nitrogen-containing pyrido[1,2-d][1,4]diazepines
New Journal of Chemistry, 2022, 46, 592-598
7061090 CIFC28 H33 N2 O6P -18.1765; 11.7233; 14.474
103.629; 93.336; 100.024
1320.6Wang, Rui; Zhang, Wei; Tang, Ying; Qi, Ze-Hui; Yu, Yuan-Hui; Tan, Hong-Bo; Tang, Dian-Yong; Xu, Zhi-Gang; Chen, Zhong-Zhu
A four-component domino reaction for the synthesis of novel bridgehead nitrogen-containing pyrido[1,2-d][1,4]diazepines
New Journal of Chemistry, 2022, 46, 592-598
7061091 CIFC16 H18 O2 P S2 TlP 1 21/c 110.9662; 11.3253; 14.7907
90; 100.286; 90
1807.42Firdoos, Tahira; Kumar, Pretam; Radha, Anu; Gomila, Rosa M.; Frontera, Antonio; Sood, Puneet; Pandey, Sushil K.
An insight into triel bonds in O,O′-diarylphosphorodithioates of thallium(i): experimental and theoretical investigations
New Journal of Chemistry, 2022, 46, 832-843
7061092 CIFC18 H22 O2 P S2 TlP -18.4373; 9.6672; 12.6725
107.092; 95.785; 90.443
982.2Firdoos, Tahira; Kumar, Pretam; Radha, Anu; Gomila, Rosa M.; Frontera, Antonio; Sood, Puneet; Pandey, Sushil K.
An insight into triel bonds in O,O′-diarylphosphorodithioates of thallium(i): experimental and theoretical investigations
New Journal of Chemistry, 2022, 46, 832-843
7061093 CIFC29 H18 Br N3 S2P -19.7483; 11.0899; 13.2845
94.979; 109.185; 114.518
1191.75Chernick, Erin T.; Abdollahi, Maryam F.; Tabasi, Zahra A.; Junge, Marc J.; Zhao, Yuming
Study of a carbazole–bromobenzothiadiazole derived fluorescent molecular rotor: crystal structure, redox activity, and solvatofluorochromic effects
New Journal of Chemistry, 2022, 46, 572-581
7061094 CIFC25 H31 Cl N3 PP 21 21 2110.1489; 12.9048; 19.8932
90; 90; 90
2605.4Leitner, Zdeněk; Císařová, Ivana; Štěpnička, Petr
Coordination behaviour of a hybrid phosphinoguanidine ligand
New Journal of Chemistry, 2022, 46, 1060-1071
7061095 CIFC52 H64 B2 Cl2 F8 N6 P2 PdP 1 21/c 112.9302; 18.6083; 22.9758
90; 92.54; 90
5522.8Leitner, Zdeněk; Císařová, Ivana; Štěpnička, Petr
Coordination behaviour of a hybrid phosphinoguanidine ligand
New Journal of Chemistry, 2022, 46, 1060-1071
7061096 CIFC53 H68 Cl4 N6 O P2 PdP 1 21/c 121.5183; 14.4903; 19.5743
90; 115.795; 90
5495.2Leitner, Zdeněk; Císařová, Ivana; Štěpnička, Petr
Coordination behaviour of a hybrid phosphinoguanidine ligand
New Journal of Chemistry, 2022, 46, 1060-1071
7061097 CIFC28 H36 Cl2 N3 O P PdP 1 21/c 18.573; 32.934; 21.093
90; 96.416; 90
5918.2Leitner, Zdeněk; Císařová, Ivana; Štěpnička, Petr
Coordination behaviour of a hybrid phosphinoguanidine ligand
New Journal of Chemistry, 2022, 46, 1060-1071
7061098 CIFC25 H30 N3 P SeP 1 21/c 114.1735; 9.6026; 17.3982
90; 96.21; 90
2354.04Leitner, Zdeněk; Císařová, Ivana; Štěpnička, Petr
Coordination behaviour of a hybrid phosphinoguanidine ligand
New Journal of Chemistry, 2022, 46, 1060-1071
7061099 CIFC27 H36 Cl2 N3 O P Pt SP 1 21/c 113.5803; 10.3485; 21.273
90; 96.195; 90
2972.16Leitner, Zdeněk; Císařová, Ivana; Štěpnička, Petr
Coordination behaviour of a hybrid phosphinoguanidine ligand
New Journal of Chemistry, 2022, 46, 1060-1071
7061100 CIFC25.4 H30.8 Cl2.8 N3 P PtP 4/n :225.1425; 25.1425; 8.4349
90; 90; 90
5332.1Leitner, Zdeněk; Císařová, Ivana; Štěpnička, Petr
Coordination behaviour of a hybrid phosphinoguanidine ligand
New Journal of Chemistry, 2022, 46, 1060-1071
7061101 CIFC25 H31 Cl N3 P SeP b c a11.1802; 13.5729; 33.3512
90; 90; 90
5060.97Leitner, Zdeněk; Císařová, Ivana; Štěpnička, Petr
Coordination behaviour of a hybrid phosphinoguanidine ligand
New Journal of Chemistry, 2022, 46, 1060-1071
7061102 CIFC27 H34 Cl3 N4 P PdP -19.3439; 10.3772; 16.5278
91.699; 97.475; 110.848
1479.94Leitner, Zdeněk; Císařová, Ivana; Štěpnička, Petr
Coordination behaviour of a hybrid phosphinoguanidine ligand
New Journal of Chemistry, 2022, 46, 1060-1071
7061103 CIFC39 H54 Cl2 N3 O2 P PtP 1 21/n 110.7829; 27.7176; 13.6704
90; 94.11; 90
4075.2Leitner, Zdeněk; Císařová, Ivana; Štěpnička, Petr
Coordination behaviour of a hybrid phosphinoguanidine ligand
New Journal of Chemistry, 2022, 46, 1060-1071
7061104 CIFC28 H35 Cl N3 P PdP 1 21/c 18.6425; 13.5124; 24.174
90; 97.545; 90
2798.6Leitner, Zdeněk; Císařová, Ivana; Štěpnička, Petr
Coordination behaviour of a hybrid phosphinoguanidine ligand
New Journal of Chemistry, 2022, 46, 1060-1071
7061105 CIFC40 H48 N2 O2P 1 21/c 136.4315; 7.1569; 6.7041
90; 92.239; 90
1746.67Ramya, N. K.; Femina, C.; Suresh, Suganya; Mohanakumari, Divya S.; Krishnan, Retheesh; Thomas, Reji
Dicyanodistyrylbenzene based positional isomers: a comparative study of AIEE and stimuli responsive multicolour fluorescence switching
New Journal of Chemistry, 2022, 46, 1339-1346
7061106 CIFC40 H48 N2 O2P -18.3073; 14.2311; 15.9393
65.653; 85.245; 78.854
1684.4Ramya, N. K.; Femina, C.; Suresh, Suganya; Mohanakumari, Divya S.; Krishnan, Retheesh; Thomas, Reji
Dicyanodistyrylbenzene based positional isomers: a comparative study of AIEE and stimuli responsive multicolour fluorescence switching
New Journal of Chemistry, 2022, 46, 1339-1346
7061107 CIFC40 H48 N2 O2P -16.9341; 6.9886; 18.4291
94.532; 93.486; 103.581
862.48Ramya, N. K.; Femina, C.; Suresh, Suganya; Mohanakumari, Divya S.; Krishnan, Retheesh; Thomas, Reji
Dicyanodistyrylbenzene based positional isomers: a comparative study of AIEE and stimuli responsive multicolour fluorescence switching
New Journal of Chemistry, 2022, 46, 1339-1346
7061108 CIFC17 H21 N3 O2P 1 21 19.684; 7.971; 10.899
90; 108.39; 90
798.342Todorova, Stanislava E.; Rusew, Rusi I.; Petkova, Zhanina S.; Shivachev, Boris L.; Nikolova, Rositsa P.; Kurteva, Vanya B.
Acylpyrazolones possessing a heterocyclic moiety in the acyl fragment: intramolecular vs. intermolecular zwitterionic structures
New Journal of Chemistry, 2022, 46, 1080-1086
7061109 CIFC18 H23 N3 O2P 1 21/c 16.713; 18.2866; 13.4679
90; 92.78; 90
1651.3Todorova, Stanislava E.; Rusew, Rusi I.; Petkova, Zhanina S.; Shivachev, Boris L.; Nikolova, Rositsa P.; Kurteva, Vanya B.
Acylpyrazolones possessing a heterocyclic moiety in the acyl fragment: intramolecular vs. intermolecular zwitterionic structures
New Journal of Chemistry, 2022, 46, 1080-1086
7061110 CIFC20 H26 Cs N3 O5P 1 21/n 18.1311; 18.283; 14.9298
90; 101.015; 90
2178.59Todorova, Stanislava E.; Rusew, Rusi I.; Petkova, Zhanina S.; Shivachev, Boris L.; Nikolova, Rositsa P.; Kurteva, Vanya B.
Acylpyrazolones possessing a heterocyclic moiety in the acyl fragment: intramolecular vs. intermolecular zwitterionic structures
New Journal of Chemistry, 2022, 46, 1080-1086
7061111 CIFC16 H19 N3 O2P 1 21/n 111.3849; 9.9562; 13.2945
90; 101.34; 90
1477.52Todorova, Stanislava E.; Rusew, Rusi I.; Petkova, Zhanina S.; Shivachev, Boris L.; Nikolova, Rositsa P.; Kurteva, Vanya B.
Acylpyrazolones possessing a heterocyclic moiety in the acyl fragment: intramolecular vs. intermolecular zwitterionic structures
New Journal of Chemistry, 2022, 46, 1080-1086
7061112 CIFC22 H32 Cs N3 O7P 1 21/c 111.8674; 12.8807; 16.3307
90; 92.978; 90
2492.9Todorova, Stanislava E.; Rusew, Rusi I.; Petkova, Zhanina S.; Shivachev, Boris L.; Nikolova, Rositsa P.; Kurteva, Vanya B.
Acylpyrazolones possessing a heterocyclic moiety in the acyl fragment: intramolecular vs. intermolecular zwitterionic structures
New Journal of Chemistry, 2022, 46, 1080-1086
7061113 CIFC17 H20.5 N3.5 O2P -19.9053; 11.6377; 15.0249
86.844; 89.823; 69.381
1618.34Todorova, Stanislava E.; Rusew, Rusi I.; Petkova, Zhanina S.; Shivachev, Boris L.; Nikolova, Rositsa P.; Kurteva, Vanya B.
Acylpyrazolones possessing a heterocyclic moiety in the acyl fragment: intramolecular vs. intermolecular zwitterionic structures
New Journal of Chemistry, 2022, 46, 1080-1086
7061114 CIFC13 H10 Cl Cs N2 O5F d d 248.4669; 32.265; 4.4093
90; 90; 90
6895.2Todorova, Stanislava E.; Rusew, Rusi I.; Petkova, Zhanina S.; Shivachev, Boris L.; Nikolova, Rositsa P.; Kurteva, Vanya B.
Acylpyrazolones possessing a heterocyclic moiety in the acyl fragment: intramolecular vs. intermolecular zwitterionic structures
New Journal of Chemistry, 2022, 46, 1080-1086
7061115 CIFC22 H24 N4 O2P 1 21/c 113.0544; 13.0083; 11.711
90; 104.353; 90
1926.64Todorova, Stanislava E.; Rusew, Rusi I.; Petkova, Zhanina S.; Shivachev, Boris L.; Nikolova, Rositsa P.; Kurteva, Vanya B.
Acylpyrazolones possessing a heterocyclic moiety in the acyl fragment: intramolecular vs. intermolecular zwitterionic structures
New Journal of Chemistry, 2022, 46, 1080-1086
7061116 CIFC19 H25 N3 O2P 1 21/c 16.7988; 18.792; 13.5975
90; 94.066; 90
1732.9Todorova, Stanislava E.; Rusew, Rusi I.; Petkova, Zhanina S.; Shivachev, Boris L.; Nikolova, Rositsa P.; Kurteva, Vanya B.
Acylpyrazolones possessing a heterocyclic moiety in the acyl fragment: intramolecular vs. intermolecular zwitterionic structures
New Journal of Chemistry, 2022, 46, 1080-1086
7061117 CIFC17 H26 Cs N3 O8 SP -17.6127; 11.657; 15.4167
101.296; 103.003; 105.412
1236.6Todorova, Stanislava E.; Rusew, Rusi I.; Petkova, Zhanina S.; Shivachev, Boris L.; Nikolova, Rositsa P.; Kurteva, Vanya B.
Acylpyrazolones possessing a heterocyclic moiety in the acyl fragment: intramolecular vs. intermolecular zwitterionic structures
New Journal of Chemistry, 2022, 46, 1080-1086
7061118 CIFC16 H19 N3 O3P 1 21/n 19.4773; 7.8846; 20.2726
90; 95.646; 90
1507.52Todorova, Stanislava E.; Rusew, Rusi I.; Petkova, Zhanina S.; Shivachev, Boris L.; Nikolova, Rositsa P.; Kurteva, Vanya B.
Acylpyrazolones possessing a heterocyclic moiety in the acyl fragment: intramolecular vs. intermolecular zwitterionic structures
New Journal of Chemistry, 2022, 46, 1080-1086
7061119 CIFC16 H19 N3 O2 SP 1 21 19.6424; 8.0087; 10.9078
90; 109.047; 90
796.22Todorova, Stanislava E.; Rusew, Rusi I.; Petkova, Zhanina S.; Shivachev, Boris L.; Nikolova, Rositsa P.; Kurteva, Vanya B.
Acylpyrazolones possessing a heterocyclic moiety in the acyl fragment: intramolecular vs. intermolecular zwitterionic structures
New Journal of Chemistry, 2022, 46, 1080-1086
7061120 CIFC26 H29 Cs N6 O2P -19.5466; 11.0591; 14.5749
72.225; 80.49; 70.549
1378.2Todorova, Stanislava E.; Rusew, Rusi I.; Petkova, Zhanina S.; Shivachev, Boris L.; Nikolova, Rositsa P.; Kurteva, Vanya B.
Acylpyrazolones possessing a heterocyclic moiety in the acyl fragment: intramolecular vs. intermolecular zwitterionic structures
New Journal of Chemistry, 2022, 46, 1080-1086
7061121 CIFC20 H29 N3 O6P 1 21/c 112.097; 14.929; 11.827
90; 107.816; 90
2033.5Todorova, Stanislava E.; Rusew, Rusi I.; Petkova, Zhanina S.; Shivachev, Boris L.; Nikolova, Rositsa P.; Kurteva, Vanya B.
Acylpyrazolones possessing a heterocyclic moiety in the acyl fragment: intramolecular vs. intermolecular zwitterionic structures
New Journal of Chemistry, 2022, 46, 1080-1086
7061122 CIFC42 H62 B F2 N5 O6P -112.5711; 13.4042; 14.1491
92.556; 105.136; 111.373
2117.2Polishchuk, Vladyslav; Kulinich, Andrii; Suikov, Sergey; Rusanov, Eduard; Shandura, Mykola
‘Hybrid’ mero-anionic polymethines with a 1,3,2-dioxaborine core
New Journal of Chemistry, 2022, 46, 1273-1285
7061123 CIFC78.2 H71.55 Cl5.55 N4.45 O18.45 Zn4P -112.662; 13.459; 24.432
90.626; 96.747; 112.981
3799.3Meng, Wei; Sun, Lin; Long, Yuhao; Wang, Qianping; Zhou, Lian; Zhang, Jun
A novel luminescent phosphor of a metal–organic framework with orange-red emission
New Journal of Chemistry, 2022, 46, 933-935
7061124 CIFC20 H20 Cl2 Co N4 O2C 1 2/c 118.645; 13.0336; 11.1471
90; 121.377; 90
2312.7Muley, Arabinda; Karumban, Kalai Selvan; Kumbhakar, Sadananda; Giri, Bishnubasu; Maji, Somnath
High phenoxazinone synthase activity of two mononuclear cis-dichloro cobalt(ii) complexes with a rigid pyridyl scaffold
New Journal of Chemistry, 2022, 46, 521-532
7061125 CIFC26 H22 Cl2 Co N10P n a 2118.2363; 7.2361; 19.5525
90; 90; 90
2580.14Muley, Arabinda; Karumban, Kalai Selvan; Kumbhakar, Sadananda; Giri, Bishnubasu; Maji, Somnath
High phenoxazinone synthase activity of two mononuclear cis-dichloro cobalt(ii) complexes with a rigid pyridyl scaffold
New Journal of Chemistry, 2022, 46, 521-532

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