Search results

Formula: - C36 H56 Fe O4 P Si4 -
Comments: Hay, Michael T.; Yennawar, Hemant P. Tetraphenylphosphonium tetrakis(trimethylsilanolato)ferrate(III) IUCrData 3(1) (2018) x171823
Space group: I -4
Cell volume: 2169
Cell parameters: 12.589; 12.589; 13.689; 90; 90; 90;

COD ID: 1548667

Formula: - C17 H10 Cl4 O -
Comments: Dravida Thendral, Era; Mohamooda Sumaya, U.; Gomathi, S.; Biruntha, K.; Usha, G. (1E,4E)-1,5-Bis(2,6-dichlorophenyl)penta-1,4-dien-3-one IUCrData 3(1) (2018) x171822
Space group: F d d 2
Cell volume: 12778.7
Cell parameters: 28.1477; 17.3385; 26.1837; 90; 90; 90;

COD ID: 1548668
CIF file HKL data	Formula: - C26 H27 N5 O - Comments: Singh, Vikram. D.; Anthal, Sumati; Desai, N. R.; Arunakumar, D. B.; Sreenivasa, S.; Kamni; Kant, Rajni 3-[6-(4-Methoxyphenyl)-2-methylpyrimidin-4-yl]-2-(4-methylpiperazin-1-yl)quinoline IUCrData 3(1) (2018) x180030 Space group: P 1 21/c 1 Cell volume: 2278.8 Cell parameters: 11.9896; 18.4215; 10.9903; 90; 110.153; 90;

COD ID: 1548669

Formula: - C15 H16 N4 O3 S -
Comments: El-Hiti, Gamal A.; Mohamed, Hanan A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Hegazy, Amany S.; Kariuki, Benson M. Ethyl (Z)-2-[2-(4-methylphenyl)hydrazin-1-ylidene]-3-oxo-3-(thiazol-2-ylamino)propanoate IUCrData 3(1) (2018) x171852
Space group: P 21 21 21
Cell volume: 1605.67
Cell parameters: 5.6487; 16.7479; 16.9726; 90; 90; 90;

COD ID: 1548670

Formula: - C19 H16 N2 O2 -
Comments: El-Hiti, Gamal A.; Mohamed, Hanan A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Hegazy, Amany S.; Kariuki, Benson M. Ethyl 1-phenyl-1,4-dihydroindeno[1,2-c]pyrazole-3-carboxylate IUCrData 3(1) (2018) x171840
Space group: P n a 21
Cell volume: 1597.4
Cell parameters: 32.387; 9.8559; 5.0043; 90; 90; 90;

COD ID: 1548671

Formula: - C37 H28 Br Cl N8 S -
Comments: El-Hiti, Gamal A.; Mohamed, Hanan A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Hegazy, Amany S.; Kariuki, Benson M. 4-(4-Bromophenyl)-2-(3-(4-chlorophenyl)-5-{3-[5-methyl-1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]-1-phenyl-1H-pyrazol-4-yl}-4,5-dihydro-1H-pyrazol-1-yl)thiazole IUCrData 3(1) (2018) x180036
Space group: P 1 21/n 1
Cell volume: 3342.7
Cell parameters: 10.422; 13.4232; 23.8943; 90; 90.198; 90;

COD ID: 1548672

Formula: - C21 H24 N2 O2 -
Comments: Guerrab, Walid; Mague, Joel T.; Taoufik, Jamal; Ramli, Youssef 3-Hexyl-5,5-diphenylimidazolidine-2,4-dione IUCrData 3(1) (2018) x180057
Space group: P 1 21 1
Cell volume: 1789
Cell parameters: 8.5395; 8.9377; 23.444; 90; 91.066; 90;

COD ID: 1548673

Formula: - C19 H20 N2 O2 -
Comments: Guerrab, Walid; Mague, Joel T.; Akrad, Rachida; Ansar, Mhammed; Taoufik, Jamal; Ramli, Youssef 3-Butyl-5,5-diphenylimidazolidine-2,4-dione IUCrData 3(1) (2018) x180050
Space group: P -1
Cell volume: 811.33
Cell parameters: 8.492; 8.5213; 12.6353; 91.9; 99.41; 115.117;

COD ID: 1548674

Formula: - C22 H18 N2 O2 -
Comments: Guerrab, Walid; Akrad, Rachida; Ansar, Mhammed; Taoufik, Jamal; Mague, Joel T.; Ramli, Youssef 3-Benzyl-5,5-diphenylimidazolidine-2,4-dione IUCrData 3(1) (2018) x171832
Space group: P -1
Cell volume: 1755.27
Cell parameters: 8.8897; 13.2911; 16.6864; 67.9; 81.027; 74.294;

COD ID: 1548675

Formula: - C7 H3 Br2 N -
Comments: Noland, Wayland E.; Tritch, Kenneth J. 3,5-Dibromobenzonitrile IUCrData 3(1) (2018) x180059
Space group: P 1 21/m 1
Cell volume: 386.21
Cell parameters: 4.0047; 13.2585; 7.3356; 90; 97.44; 90;

COD ID: 1548676

Formula: - C7 H2 Br2 Cl N -
Comments: Noland, Wayland E.; Tritch, Kenneth J. 2,6-Dibromo-4-chlorophenyl isocyanide IUCrData 3(1) (2018) x171819
Space group: P 1 21/m 1
Cell volume: 414.2
Cell parameters: 4.7215; 10.0181; 8.7689; 90; 93.023; 90;

COD ID: 1548677

Formula: - C5 H3 Cl N2 O3 -
Comments: Shafer, Sarah K.; Lynch, Will E.; Padgett, Clifford W. 2-Chloro-4-nitropyridine N-oxide IUCrData 3(1) (2018) x180016
Space group: P b c a
Cell volume: 1294.3
Cell parameters: 5.9238; 9.735; 22.444; 90; 90; 90;

COD ID: 1548678

Formula: - C11 H19 N O7 S -
Comments: Prabu, P.; Thiruvalluvar, A.; Ramachandra Raja, C. 1-Carboxy-2-hydroxypropan-1-aminium 4-methylbenzenesulfonate monohydrate IUCrData 3(1) (2018) x171848
Space group: P 1 21 1
Cell volume: 731.71
Cell parameters: 8.0762; 6.2486; 14.5096; 90; 92.161; 90;

COD ID: 1548679
CIF file HKL data	Formula: - C10 H13 Br N2 S - Comments: El-Hiti, Gamal A.; Smith, Keith; Hegazy, Amany S.; Alshammari, Mohammed B.; Kariuki, Benson M. 1-(2-Bromo-4-methylphenyl)-3,3-dimethylthiourea IUCrData 3(1) (2018) x180045 Space group: P 1 21/n 1 Cell volume: 1158.76 Cell parameters: 12.2617; 8.0222; 12.7397; 90; 112.38; 90;

COD ID: 1548680

Formula: - C19 H14 O5 -
Comments: Cao, Yi; Mai, Wenpeng; Yuan, Jinwei 3-Benzoyl-4-methyl-2-oxo-2H-chromen-7-yl acetate IUCrData 3(1) (2018) x180015
Space group: P 1 21/n 1
Cell volume: 1578.22
Cell parameters: 9.1617; 10.2307; 16.8581; 90; 92.812; 90;

COD ID: 1548681

Formula: - C8 H7 Br Cl N O2 -
Comments: El-Hiti, Gamal A.; Smith, Keith; Hegazy, Amany S.; Alshammari, Mohammed B.; Kariuki, Benson M. Methyl N-(2-bromo-4-chlorophenyl)carbamate IUCrData 3(1) (2018) x180054
Space group: P -1
Cell volume: 477.25
Cell parameters: 4.6637; 9.4598; 11.9898; 111.639; 101.035; 93.712;

COD ID: 1548682

Formula: - C18 H13 F2 N3 O -
Comments: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Hegazy, Amany S.; Kariuki, Benson M. (E)-3-(4-Fluorophenyl)-1-[1-(4-fluorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]prop-2-en-1-one IUCrData 3(1) (2018) x171841
Space group: P -1
Cell volume: 1506.65
Cell parameters: 8.1891; 14.1804; 14.505; 68.075; 84.22; 74.627;

COD ID: 1548683

Formula: - C19 H18 N2 O3 S -
Comments: Balakumaran, K.; Mosesbabu, J.; Anireddy, Jayashree; Chakkaravarthi, G. (E)-5-{4-[2-(5-Ethylpyridin-2-yl)ethoxy]benzylidene}thiazolidine-2,4-dione IUCrData 3(1) (2018) x171839
Space group: P 1 21/c 1
Cell volume: 1736.7
Cell parameters: 7.6756; 13.6762; 17.6561; 90; 110.442; 90;

COD ID: 1548684

Formula: - C10 H8 Br N3 O2 -
Comments: Mohamed Abdelahi, Mohamed Mokhtar; El Bakri, Youness; Benchidmi, Mohammed; Essassi, El Mokhtar; Mague, Joel T. 3-Bromo-6-nitro-1-(prop-2-en-1-yl)-1H-indazole IUCrData 3(1) (2018) x171837
Space group: P 1 21/n 1
Cell volume: 2151.08
Cell parameters: 7.5971; 9.9501; 28.569; 90; 95.086; 90;

COD ID: 1548685

Formula: - C10 H11 F3 N2 O -
Comments: El-Hiti, Gamal A.; Smith, Keith; Hegazy, Amany S.; Alshammari, Mohammed B.; Kariuki, Benson M. 1,1-Dimethyl-3-[4-(trifluoromethyl)phenyl]urea IUCrData 3(1) (2018) x180040
Space group: P b c a
Cell volume: 2226.9
Cell parameters: 9.8152; 10.0783; 22.512; 90; 90; 90;

COD ID: 1548726
CIF file HKL data	Formula: - C17 H19 N O3 - Comments: Ait Elhad, Mustapha; Benharref, Ahmed; El Ammari, Lahcen; Saadi, Mohamed; Mazoir, Noureddine; Berraho, Moha 1-(2-Isopropyl-4,7-dimethyl-3-nitronaphthalen-1-yl)ethanone IUCrData 3(1) (2018) x180083 Space group: P 1 21/n 1 Cell volume: 1488.2 Cell parameters: 11.172; 8.532; 16.287; 90; 106.54; 90;

COD ID: 1548727

Formula: - C40 H24 F4 N4 S2 -
Comments: Fujii, Takuya; Yamakado, Hideo The 2:1 charge-transfer complex of 4,6-dimethyldibenzothiophene and 7,7,8,8-tetracyano-2,3,5,6-tetrafluoroquinodimethane IUCrData 3(1) (2018) x180077
Space group: P -1
Cell volume: 767.8
Cell parameters: 7.57; 10.206; 11.549; 113.4; 90.01; 108.607;

COD ID: 1548728

Formula: - C7 H5 N O3 -
Comments: Engwerda, Antonius H.J.; Brugman, Sander J.T.; Tinnemans, Paul; Vlieg, Elias 3-Nitrobenzaldehyde IUCrData 3(1) (2018) x180092
Space group: P 1 21 1
Cell volume: 328.39
Cell parameters: 3.7363; 7.0071; 12.5877; 90; 94.8144; 90;

COD ID: 1548729

Formula: - C71 H71 N33 O S8 -
Comments: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Hegazy, Amany S.; Kariuki, Benson M. 2-({6-[5-Methyl-1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]imidazo[2,1-b]thiazol-5-yl}methylidene)hydrazinecarbothioamide dimethylformamide 0.25-solvate IUCrData 3(1) (2018) x180087
Space group: P 1 21/c 1
Cell volume: 3956.4
Cell parameters: 18.3427; 13.5855; 16.9385; 90; 110.393; 90;

COD ID: 1548730

Formula: - C27 H20 Br N5 O -
Comments: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Hegazy, Amany S.; Kariuki, Benson M. (E)-1-(4-Bromophenyl)-3-[3-(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-1-phenyl-1H-pyrazol-4-yl]prop-2-en-1-one IUCrData 3(1) (2018) x180069
Space group: P 1 21/n 1
Cell volume: 2395
Cell parameters: 15.0387; 6.8105; 24.385; 90; 106.473; 90;

COD ID: 1548731

Formula: - C14 H10 O2 S -
Comments: Elumalai, K.; Raja, R.; Karunakaran, Jayachandran; Mohanakrishnan, Arasambattu K.; Murugesan, K. Sakthi (E)-2-(3-Oxo-3-phenylprop-1-enyl)thiophene-3-carbaldehyde IUCrData 3(1) (2018) x180041
Space group: P 1 21/n 1
Cell volume: 2322.6
Cell parameters: 10.4355; 8.6955; 25.7106; 90; 95.42; 90;

COD ID: 1548830

Formula: - C17 H11 Cl N2 O2 -
Comments: Baral, Nilofar; Nayak, Sabita; Pal, Satyanarayan; Mohapatra, Seetaram 5-(2-Chlorophenyl)-3-(2H-chromen-3-yl)-1,2,4-oxadiazole IUCrData 3(1) (2018) x180129
Space group: P -1
Cell volume: 712.65
Cell parameters: 8.7208; 8.7703; 9.6278; 86.035; 80.227; 79.352;

COD ID: 1548831

Formula: - C19 H24 O2 -
Comments: Kotha, Sambasivarao; Cheekatla, Subba Rao; Gunta, Rama 7-Hydroxyhexacyclo[7.5.1.0^1,7^.0^6,13^.0^8,12^.0^10,14^]pentadecan-15-one-11-spirocyclopentane IUCrData 3(1) (2018) x180090
Space group: P -1
Cell volume: 737.06
Cell parameters: 6.36; 11.0807; 11.5351; 114.539; 91.465; 93.401;

COD ID: 1548832

Formula: - C14 H8 N2 S Se -
Comments: Schollmeyer, Dieter; Detert, Heiner Dibenzo[2,3:6,7]thiepino[4,5-d][1,2,3]selenadiazole IUCrData 3(1) (2018) x180070
Space group: P n a 21
Cell volume: 4868.1
Cell parameters: 20.8533; 9.9698; 23.4151; 90; 90; 90;

COD ID: 1548840

Formula: - C6 H12 O6 -
Comments: Taguchi, Hiroaki; Sogo, Kouta; Ishii, Tomohiko; Yoshihara, Akihide; Fukada, Kazuhiro α-D,L-Sorbose IUCrData 3(1) (2018) x180114
Space group: P 1 21/a 1
Cell volume: 1450.85
Cell parameters: 12.8152; 6.29489; 18.9482; 90; 108.347; 90;

COD ID: 1548841

Formula: - C24 H26 O4 -
Comments: Kalaivanan, R.; Sughanya, V.; Sureshbabu, N. 9-(4-Formylphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione IUCrData 3(1) (2018) x180105
Space group: P b c n
Cell volume: 4024.7
Cell parameters: 15.1185; 11.0273; 24.141; 90; 90; 90;

COD ID: 1548842

Formula: - C23 H15 N3 O S -
Comments: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Hegazy, Amany S.; Kariuki, Benson M. (E)-2-Benzoyl-3-[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]acrylonitrile IUCrData 3(1) (2018) x180171
Space group: P 1 21/n 1
Cell volume: 3817.5
Cell parameters: 19.2666; 9.7769; 20.3265; 90; 94.423; 90;

COD ID: 1548843

Formula: - C14 H11 N3 O2 -
Comments: Mohamed Abdelahi, Mohamed Mokhtar; El Bakri, Youness; Benchidmi, Mohammed; Essassi, El Mokhtar; Mague, Joel T. 2-Benzyl-6-nitro-2H-indazole IUCrData 3(1) (2018) x180151
Space group: P 1 21/n 1
Cell volume: 1178.7
Cell parameters: 4.489; 19.77; 13.308; 90; 93.608; 90;

COD ID: 1548889

Formula: - C6 Cl3 N9 -
Comments: Limbach, Daniel; Detert, Heiner; Schollmeyer, Dieter 2,6,10-Trichlorotris[1,2,4]triazolo[1,5-a:1',5'-c:1'',5''-e][1,3,5]triazine IUCrData 3(2) (2018) x180212
Space group: I 1 2/a 1
Cell volume: 6580.9
Cell parameters: 22.2914; 14.1339; 23.1869; 90; 115.732; 90;

COD ID: 1548890

Formula: - C24 H23 N3 O2 -
Comments: Tamam, Asmaa H. A.; Kaur, Manpreet; Akkurt, Mehmet; Mohamed, Shaaban K.; Jasinski, Jerry P.; Hussain, Faiq H. S. 2-Amino-4-(4-methoxyphenyl)-1-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile IUCrData 3(2) (2018) x180167
Space group: P 1 21/c 1
Cell volume: 2013.54
Cell parameters: 9.1066; 19.6406; 11.2901; 90; 94.343; 90;

COD ID: 1548891

Formula: - C22 H17 N3 O -
Comments: Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Said, Awad I.; Hawaiz, Farouq E.; Elgarhy, Sahar M. I. (Z)-1-(1,3-Diphenyl-1H-pyrazol-4-yl)-N-phenylmethanimine N-oxide IUCrData 3(2) (2018) x180208
Space group: P 1 21/c 1
Cell volume: 1694.9
Cell parameters: 9.1084; 10.8314; 17.2226; 90; 94.06; 90;

COD ID: 1548892

Formula: - Al4 Cr -
Comments: Fan, Changzeng; Liu, Cong Crystal structure of ω-Al~4~Cr IUCrData 3(2) (2018) x180216
Space group: C 1 m 1
Cell volume: 451.49
Cell parameters: 5.1574; 17.413; 5.1107; 90; 100.357; 90;

COD ID: 1548930

Formula: - C26 H19 Br N4 O2 S -
Comments: Muthuselvi, C.; Muthu, M.; Athimoolam, S.; Ravikumar, B.; Pandiarajan, S.; Krishnakumar, R. V. 6'-(3-Bromophenyl)-7'-nitro-1',6',7',7a'-tetrahydro-3'H-spiro[indeno[1,2-b]quinoxaline-11,5'-pyrrolo[1,2-c]thiazole] IUCrData 3(2) (2018) x180238
Space group: C 1 2/c 1
Cell volume: 4795.9
Cell parameters: 25.289; 10.076; 19.05; 90; 98.89; 90;

COD ID: 1548931

Formula: - Al10 Fe0.83 Ni3 -
Comments: Wang, Sai; Liu, Cong; Fan, Changzeng Al~10~Ni~3~Fe~0.83~, an Fe-depleted phase in the Al‒Ni‒Fe system IUCrData 3(2) (2018) x180237
Space group: P 63/m m c
Cell volume: 391.227
Cell parameters: 7.6981; 7.6981; 7.6231; 90; 90; 120;

COD ID: 1548932

Formula: - C19 H17 Cl2 N S Si -
Comments: Umezono, Satoru; Okuno, Tsunehisa 10-[1,1-Dichloro-4-(trimethylsilyl)but-1-en-3-yn-2-yl]-10H-phenothiazine IUCrData 3(2) (2018) x180232
Space group: P -1
Cell volume: 951.7
Cell parameters: 10.073; 10.37; 10.547; 105.029; 115.48; 90.3532;

COD ID: 1548972

Formula: - C8 H13 Br N O0.5 -
Comments: Aarthi, R.; Thiruvalluvar, A.; Ramachandra Raja, C. (4-Methylphenyl)methanaminium bromide hemihydrate IUCrData 3(2) (2018) x180270
Space group: C 1 2/c 1
Cell volume: 1844.24
Cell parameters: 30.7456; 5.0266; 12.0636; 90; 98.43; 90;

COD ID: 1548973

Formula: - C9 H5 I3 O2 -
Comments: Szell, Patrick M.J.; Gabidullin, Bulat; Bryce, David L. 3-(1,2,2-Triiodoethenyl)benzoic acid IUCrData 3(2) (2018) x180258
Space group: P 1 21/n 1
Cell volume: 1223.3
Cell parameters: 4.7121; 18.752; 13.856; 90; 92.379; 90;

COD ID: 1548985

Formula: - C22 H16 Br N3 O3 -
Comments: Filali Baba, Yassir; Kandri Rodi, Youssef; Mague, Joel T.; Ouzidan, Younes; Ouazzani Chahdi, Fouad; Essassi, El Mokhtar (Pyridin-2-yl)methyl 6-bromo-2-oxo-1-[(pyridin-2-yl)methyl]-1,2-dihydroquinoline-4-carboxylate IUCrData 3(2) (2018) x180288
Space group: C 1 2/c 1
Cell volume: 3673.9
Cell parameters: 34.0146; 4.9522; 23.4539; 90; 111.578; 90;

COD ID: 1548986

Formula: - C22 H14 O6 -
Comments: Mohamed, Shaaban K.; Mague, Joel T.; Akkurt, Mehmet; Hawaiz, Farouq E.; Ayoob, Mzgin M.; Hussein, Awaz J. Bis(2-formylphenyl) benzene-1,2-dicarboxylate IUCrData 3(2) (2018) x180251
Space group: P -1
Cell volume: 1762.9
Cell parameters: 8.1833; 15.4412; 15.525; 110.657; 104.919; 90.516;

COD ID: 1548987

Formula: - C13 H8 Br N3 O2 -
Comments: Sikine, Meriem; Kandri Rodi, Youssef; Ouzidan, Younes; Jasinski, Jerry P.; Kaur, Manpreet; Essassi, El Mokhtar 7-Bromo-1,4-bis(prop-2-ynyl)pyrido[2,3-b]pyrazine-2,3(1H,4H)-dione IUCrData 3(2) (2018) x180266
Space group: P 1 21/c 1
Cell volume: 1240.37
Cell parameters: 10.1922; 17.347; 7.0216; 90; 92.382; 90;

COD ID: 1548988
CIF file HKL data	Formula: - C15 H17 N O2 - Comments: Dakir, Mohamed; Benharref, Ahmed; El Ammari, Lahcen; Saadi, Mohamed; Oukhrib, Abdelouahd; Berraho, Moha 6-Methyl-1-(nitromethyl)-4-(propan-2-yl)naphthalene IUCrData 3(2) (2018) x180274 Space group: C 1 2/c 1 Cell volume: 2642.9 Cell parameters: 29.001; 4.8412; 20.474; 90; 113.16; 90;

COD ID: 1549006

Formula: - C19 H18 N2 O2 -
Comments: Samba, Mohamed; Minnih, Mohamed Said; El Bakri, Youness; Essassi, El Mokhtar; Mague, Joel T. A monoclinic modification of (4Z)-1-benzyl-4-(2-oxopropylidene)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-2-one IUCrData 3(2) (2018) x180326
Space group: P 1 21/n 1
Cell volume: 1582.73
Cell parameters: 8.9229; 18.8922; 9.7147; 90; 104.879; 90;

COD ID: 1549007

Formula: - C10 H13 N O -
Comments: Bosch, Eric; Jeffries, Laura 1-(2-Amino-4,5-dimethylphenyl)ethanone IUCrData 3(2) (2018) x180313
Space group: P n m a
Cell volume: 929.35
Cell parameters: 10.4838; 6.8965; 12.8538; 90; 90; 90;

COD ID: 1549019

Formula: - C10 H10 N2 O4 S2 -
Comments: Lynch, Will; Padgett, Clifford W. 2,2′-Disulfanediylbis(pyridine N-oxide)‒hydrogen peroxide (1/1) IUCrData 3(3) (2018)
Space group: P 21 21 2
Cell volume: 607.2
Cell parameters: 11.232; 12.283; 4.401; 90; 90; 90;

COD ID: 1549037

Formula: - C16 H14 N2 O -
Comments: Ramli, Youssef; El Bakri, Youness; El Ghayati, L'houssaine; Essassi, El Mokhtar; Mague, Joel T. 1-Benzyl-3-methylquinoxalin-2(1H)-one IUCrData 3(3) (2018) x180390
Space group: P -1
Cell volume: 1965.63
Cell parameters: 7.3502; 17.3508; 17.9449; 118.226; 100.042; 92.294;

COD ID: 1549038

Formula: - C13 H18 F N O5 -
Comments: Mossine, Valeri V.; Barnes, Charles L.; Mawhinney, Thomas P. 1-Deoxy-1-(N-methyl-4-fluorophenylamino)-D-arabino-hexulose IUCrData 3(3) (2018) x180369
Space group: P 1 21 1
Cell volume: 680.8
Cell parameters: 10.561; 5.156; 12.504; 90; 90.606; 90;

COD ID: 1549065

Formula: - C14 H11 Br2 N O2 -
Comments: Pal, Tarun Kumar; Hossain, Md Dulal; Sheikh, Md Chanmiya; Miyatake, Ryuta; Alam, Md Ashraful 2,4-Dibromo-6-[(2-hydroxy-5-methylanilino)methylidene]cyclohexa-2,4-dienone IUCrData 3(3) (2018) x180388
Space group: P 1 21/n 1
Cell volume: 2628.07
Cell parameters: 16.7219; 6.90389; 23.0811; 90; 99.502; 90;

COD ID: 1549066

Formula: - C15 H21 N3 O2 S -
Comments: Chaurasia, Rahul; Bharti, Akhilesh; Butcher, Ray J.; Wikaira, Jan L.; Bharty, Manoj K. 4-Cyclohexyl-1-(2-methoxybenzoyl)thiosemicarbazide with an unknown solvent IUCrData 3(3) (2018) x180383
Space group: P c c n
Cell volume: 3340.4
Cell parameters: 29.5823; 15.1971; 7.4303; 90; 90; 90;

COD ID: 1549074

Formula: - C14 H7 Br2 N O2 -
Comments: El-Hiti, Gamal A.; Smith, Keith; Alamri, Mesfer; Morris, Ceri A.; Kille, Peter; Kariuki, Benson M. 5-Bromo-1-(4-bromophenyl)isatin IUCrData 3(3) (2018) x180426
Space group: P n m a
Cell volume: 1324.5
Cell parameters: 15.116; 6.8728; 12.7492; 90; 90; 90;

COD ID: 1549075

Formula: - C24 H22 N4 O2 S -
Comments: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Khidre, Rizk E.; Mostafa, Mohamed S.; Hegazy, Amany S.; Kariuki, Benson M. 1-{2-Anilino-4-methyl-5-[5-methyl-1-(4-methylphenyl)-1H-1,2,3-triazole-4-carbonyl]thiophen-3-yl}ethanone IUCrData 3(3) (2018) x180402
Space group: P 1 21/c 1
Cell volume: 2147.4
Cell parameters: 6.2938; 10.9254; 31.229; 90; 90.221; 90;

COD ID: 1549076

Formula: - C20 H18 N8 O2 -
Comments: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Mostafa, Mohamed S.; Khidre, Rizk E.; Hegazy, Amany S.; Kariuki, Benson M. 5-Methyl-N'-(5-methyl-1-phenyl-1H-1,2,3-triazole-4-carbonyl)-1-phenyl-1H-1,2,3-triazole-4-carbohydrazide IUCrData 3(3) (2018) x180424
Space group: C 1 2/c 1
Cell volume: 6042.8
Cell parameters: 61.5399; 11.8988; 8.2661; 90; 93.301; 90;

COD ID: 1549125

Formula: - C16 H12 N2 O -
Comments: Umezono, Satoru; Okuno, Tsunehisa 5-[Phenyl(pyridin-4-yl)amino]penta-2,4-diyn-1-ol IUCrData 3(3) (2018) x180454
Space group: P -1
Cell volume: 621.5
Cell parameters: 4.0205; 11.316; 13.781; 85.067; 88.517; 84.335;

COD ID: 1549126
CIF file HKL data	Formula: - C20 H20 N2 O2 - Comments: Yousufuddin, Muhammed; Morales, Ruth; Cassis, Waleed; Brown, Gary W.; Singh, Ravi P.; Lovely, Carl J. [1,4-Bis(4-methoxyphenyl)but-3-yn-2-yl](cyano)methylamine IUCrData 3(3) (2018) x180389 Space group: P 1 21/c 1 Cell volume: 1782.9 Cell parameters: 15.6203; 8.6349; 13.9758; 90; 108.948; 90;

COD ID: 1549127

Formula: - C33 H40 N4 O9 S3 -
Comments: Amirthakumar, C.; Pandi, P.; Kumar, R. Mohan; Chakkaravarthi, G. 2-Aminoanilinium benzene-1,2-diaminium tris(4-methylbenzene-1-sulfonate) IUCrData 3(3) (2018) x180437
Space group: P -1
Cell volume: 1793.17
Cell parameters: 10.5058; 12.8929; 14.0425; 80.187; 73.218; 89.188;

COD ID: 1549128

Formula: - C37 H28 Br Cl N8 S -
Comments: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Khidre, Rizk E.; Mostafa, Mohamed S.; Hegazy, Amany S.; Kariuki, Benson M. 4-(4-Bromophenyl)-2-(3-(4-chlorophenyl)-5-{3-[5-methyl-1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]-1-phenyl-1H-pyrazol-4-yl}-4,5-dihydro-1H-pyrazol-1-yl)-1,3-thiazole IUCrData 3(3) (2018) x180443
Space group: P 1 21/n 1
Cell volume: 3344.25
Cell parameters: 10.4422; 13.3065; 24.0683; 90; 90.181; 90;

COD ID: 1549129

Formula: - C2 H6 Ni O6 -
Comments: Weil, Matthias Redetermination of nickel(II) formate dihydrate IUCrData 3(3) (2018) x180428
Space group: P 1 21/c 1
Cell volume: 550.91
Cell parameters: 8.5806; 7.0202; 9.2257; 90; 97.551; 90;

COD ID: 1549130

Formula: - C6 H5 F N2 O2 -
Comments: Moorthy, K.; NizamMohideen, M.; Vetrivel, S.; Vinoth, E.; Arun, A. 2-Fluoro-5-nitroaniline IUCrData 3(3) (2018) x180425
Space group: P 1 21/n 1
Cell volume: 647.31
Cell parameters: 12.1967; 3.7559; 14.4539; 90; 102.143; 90;

COD ID: 1549131

Formula: - C37 H28 Br2 N8 S -
Comments: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Khidre, Rizk E.; Mostafa, Mohamed S.; Hegazy, Amany S.; Kariuki, Benson M. 4-(4-Bromophenyl)-2-(3-(4-bromophenyl)-5-{3-[5-methyl-1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]-1-phenyl-1H-pyrazol-4-yl}-4,5-dihydro-1H-pyrazol-1-yl)-1,3-thiazole IUCrData 3(3) (2018) x180449
Space group: P 1 21/n 1
Cell volume: 3363.02
Cell parameters: 10.3624; 13.5082; 24.0262; 90; 90.457; 90;

COD ID: 1549173

Formula: - C8 H5 Cl N2 Se -
Comments: Ravichandran, K.; Ranjith, S.; Sankari, S.; Beemarao, M.; Ponnuswamy, M. N. 4-(4-Chlorophenyl)-1,2,3-selenadiazole IUCrData 3(3) (2018) x180462
Space group: P 1 21/c 1
Cell volume: 854.84
Cell parameters: 10.3353; 14.0058; 5.954; 90; 97.32; 90;

COD ID: 1549174

Formula: - C14 H13 N O -
Comments: Swetha, G.; Ida Malarselvi, R.; Ramachandra Raja, C.; Thiruvalluvar, A.; Priscilla, J. (E)-4-Methyl-2-(N-phenylcarboximidoyl)phenol IUCrData 3(3) (2018) x180464
Space group: P 1 21/n 1
Cell volume: 1114.21
Cell parameters: 4.6976; 19.3656; 12.3116; 90; 95.831; 90;

COD ID: 1549176

Formula: - C6 H6 N4 O -
Comments: El Hafi, Mohamed; Lahmidi, Sanae; Boulhaoua, Mohammed; Ramli, Youssef; Essassi, El Mokhtar; Mague, Joel T. 1-Methyl-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one IUCrData 3(3) (2018) x180483
Space group: P -1
Cell volume: 319.83
Cell parameters: 3.8342; 5.5701; 15.0346; 93.396; 92.812; 92.361;

COD ID: 1549177

Formula: - C21 H14 N6 -
Comments: Wang, Jianwei; Yuan, Caixia 4-(1H-Indol-3-yl)-2,6-bis(pyrazin-2-yl)pyridine IUCrData 3(3) (2018) x180492
Space group: P 1 21/c 1
Cell volume: 1683
Cell parameters: 8.556; 8.982; 22.13; 90; 98.28; 90;

COD ID: 1549178

Formula: - C17 H41 B Co N O P2 -
Comments: Junge, Kathrin; Cingolani, Andrea; Spannenberg, Anke; Beller, Matthias {Bis[2-(diisopropylphosphanyl)ethyl]amine}carbonyl(tetrahydroborato)cobalt(I) IUCrData 3(3) (2018) x180471
Space group: P 1 21/n 1
Cell volume: 2252.73
Cell parameters: 8.0249; 27.32; 10.3546; 90; 97.101; 90;

COD ID: 1549340

Formula: - C11 H6 F5 N O -
Comments: Zhao, Hui 3-Difluoromethyl-5-[4-(trifluoromethyl)phenyl]isoxazole IUCrData 3(4) (2018) x180445
Space group: P b c m
Cell volume: 1049.3
Cell parameters: 13.1081; 11.1491; 7.1798; 90; 90; 90;

COD ID: 1549341

Formula: - C56 H50 N2 -
Comments: Adas, Sonya K.; Peloquin, Andrew J.; Iacono, Scott T.; Balaich, Gary J. 9-(3,5-Dimethylbenzylidene)-8-(3,5-dimethylphenyl)-1,3,5,7-tetraphenyl-2,4,7,8-tetrahydro-4,7-methanoazulene acetonitrile disolvate IUCrData 3(4) (2018) x180553
Space group: P -1
Cell volume: 2150.3
Cell parameters: 10.4026; 13.6115; 16.5769; 105.502; 105.796; 94.038;

COD ID: 1549342

Formula: - C16 H19 N5 O -
Comments: Abad, Nadeem; Ramli, Youssef; Sebbar, Nada Kheira; Kaur, Manpreet; Essassi, El Mokhtar; Jasinski, Jerry P. 1-[(1-Butyl-1H-1,2,3-triazol-5-yl)methyl]-3-methylquinoxalin-2(1H)-one IUCrData 3(4) (2018) x180482
Space group: P 1 21/c 1
Cell volume: 1532.97
Cell parameters: 15.8299; 10.627; 9.2041; 90; 98.084; 90;

COD ID: 1549343

Formula: - C18 H22 -
Comments: Brieger, Lukas; Unkelbach, Christian; Strohmann, Carsten 1,2-Bis(3,5-dimethylphenyl)ethane IUCrData 3(4) (2018) x180636
Space group: P -1
Cell volume: 719.18
Cell parameters: 7.9315; 8.2047; 12.3474; 108.513; 98.09; 103.805;

COD ID: 1549344

Formula: - C15 H14 Br2 -
Comments: Peloquin, Andrew J.; Godman, Nicholas P.; Allison, Bruce D.; Balaich, Gary J.; Iacono, Scott T. 1,3-Bis(4-bromophenyl)propane IUCrData 3(4) (2018) x180563
Space group: P 1 21 1
Cell volume: 694
Cell parameters: 7.4526; 5.8441; 16.278; 90; 101.808; 90;

COD ID: 1549345

Formula: - C15 H12 Cl N O2 -
Comments: Zhong, Ling; Shi, Jianyou; Zhong, Lei; Wei, Xin; Xhang, Hongjia; Cheng, Liang; Bai, Lan 2-(3-Chlorophenyl)-3,4-dihydrobenzo[f][1,4]oxazepin-5(2H)-one IUCrData 3(4) (2018) x180587
Space group: P -1
Cell volume: 660.1
Cell parameters: 7.2162; 8.0068; 11.65; 80.123; 84.57; 88.084;

COD ID: 1549346

Formula: - C16 H20 N2 O2 -
Comments: El Foujji, Laila; Sebhaoui, Jihad; El Bakri, Youness; El Ghayati, L'houssaine; Essassi, El Mokhtar; Mague, Joel T. (3R,4Z)-1,3-Diethyl-4-(2-oxopropylidene)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-2-one IUCrData 3(4) (2018) x180515
Space group: P -1
Cell volume: 710
Cell parameters: 8.8546; 8.9841; 9.5523; 98.481; 96.412; 106.772;

COD ID: 1549347

Formula: - C17 H16 O -
Comments: Seidel, Nadine; Seichter, Wilhelm; Weber, Edwin 1-Methoxy-1,1-diphenylbut-2-yne IUCrData 3(4) (2018) x180415
Space group: P 1 21/c 1
Cell volume: 1333.59
Cell parameters: 9.6483; 10.606; 13.4332; 90; 104.034; 90;

COD ID: 1549348

Formula: - C13 H15 N5 O2 S -
Comments: Choudhury, Manisha; Viswanathan, Vijayan; Timiri, Ajay Kumar; Sinha, Barij Nayan; Jeyaprakash, Venkatesan; Velmurugan, Devadasan 2-[(4,6-Diaminopyrimidin-2-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide IUCrData 3(4) (2018) x180600
Space group: P b c a
Cell volume: 2782.59
Cell parameters: 18.2763; 7.5909; 20.0571; 90; 90; 90;

COD ID: 1549349

Formula: - C18 H16 N2 O3 -
Comments: Abad, Nadeem; El Bakri, Youness; Sebhaoui, Jihad; Ramli, Youssef; Essassi, El Mokhtar; Mague, Joel T. Ethyl 2-(2-oxo-3-phenyl-1,2-dihydroquinoxalin-1-yl)acetate IUCrData 3(4) (2018) x180519
Space group: P 1 21/c 1
Cell volume: 1508.64
Cell parameters: 18.171; 4.9012; 16.9492; 90; 91.923; 90;

COD ID: 1549350

Formula: - C27 H37 Cl N2 O4 -
Comments: Minaker, Samuel A.; Wang, Ruiyao; Aquino, Manuel A. S. 1,3-Bis(2,6-diisopropylphenyl)imidazolium perchlorate IUCrData 3(4) (2018) x180516
Space group: P c c n
Cell volume: 2742.7
Cell parameters: 11.0729; 12.6284; 19.6141; 90; 90; 90;

COD ID: 1549351

Formula: - C12 H14 N2 O3 -
Comments: Abad, Nadeem; Sebhaoui, Jihad; El Bakri, Youness; Ramli, Youssef; Essassi, El Mokhtar; Mague, Joel T. Ethyl 2-(3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)acetate IUCrData 3(4) (2018) x180596
Space group: P -1
Cell volume: 561.7
Cell parameters: 4.8082; 8.26; 14.413; 84.072; 81.473; 85.14;

COD ID: 1549352

Formula: - C47.8 H42 Au Co2 F12.6 Fe2 N6 O5.4 P1.2 S1.8 -
Comments: Vanicek, Stefan; Wurst, Klaus; Kopacka, Holger; Bildstein, Benno Bis(4-cobaltoceniumyl-1-ferrocenyl-3-methyl-1,2,3-triazolylidene)gold(I) hexafluoridophosphate‒trifluoromethanesulfonate (1.2/1.8) IUCrData 3(4) (2018) x180623
Space group: P -1
Cell volume: 2637.9
Cell parameters: 12.1395; 13.8587; 17.366; 85.994; 80.863; 66.136;

COD ID: 1549353

Formula: - C21.2 H22.4 Cl6.4 Co3 -
Comments: Shaw, Michael J.; Xu, Nan; Caveny, Ian E.; Abucayon, Erwin G.; Ramuglia, Anthony R.; Richter-Addo, George B. Bis(cobaltocenium) tetrachloridocobaltate(II) dichloromethane 1.2-solvate IUCrData 3(4) (2018) x180552
Space group: P -1
Cell volume: 6441.7
Cell parameters: 18.1419; 19.9967; 20.3048; 79.631; 78.398; 63.844;

COD ID: 1549354

Formula: - C17 H14 N2 O2 -
Comments: Abad, Nadeem; El Bakri, Youness; Sebhaoui, Jihad; Ramli, Youssef; Essassi, El Mokhtar; Mague, Joel T. 1-[(Oxiran-2-yl)methyl]-3-phenyl-1,2-dihydroquinoxalin-2-one IUCrData 3(4) (2018) x180610
Space group: P 1 21 1
Cell volume: 1376.59
Cell parameters: 12.7853; 7.0167; 15.4215; 90; 95.718; 90;

COD ID: 1549355

Formula: - C28 H20 Br2 O -
Comments: Seidel, Nadine; Seichter, Wilhelm; Weber, Edwin 3,4-Dibromo-2,2,5,5-tetraphenyl-2,5-dihydrofuran IUCrData 3(4) (2018) x180416
Space group: P 21 21 21
Cell volume: 2216.6
Cell parameters: 9.4301; 9.4561; 24.8572; 90; 90; 90;

COD ID: 1549356

Formula: - C56 H52 As2 Cl6 N4 Zr -
Comments: Borjas, Rosendo; Mariappan Balasekaran, Samundeeswari; Poineau, Frederic Bis(tetraphenylarsonium) hexachloridozirconate(IV) acetonitrile tetrasolvate IUCrData 3(4) (2018) x180528
Space group: P 1 21/c 1
Cell volume: 2797.8
Cell parameters: 9.6505; 19.378; 15.1026; 90; 97.849; 90;

COD ID: 1549358

Formula: - C16 H24 Br4 N2 Zn -
Comments: Aarthi, Ramkumar; Thiruvalluvar, Aravazhi Amalan; Ramachandra Raja, Chidambaram Bis(4-methylbenzylammonium) tetrabromidozincate IUCrData 3(5) (2018) x180648
Space group: P n a 21
Cell volume: 2229.95
Cell parameters: 11.0702; 26.0585; 7.7302; 90; 90; 90;

COD ID: 1549359

Formula: - Br F4 K -
Comments: Ivlev, Sergei I.; Kraus, Florian Redetermination of the crystal structure of K[BrF4] from single-crystal X-ray diffraction data IUCrData 3(5) (2018)
Space group: I 4/m c m
Cell volume: 411.19
Cell parameters: 6.0999; 6.0999; 11.0509; 90; 90; 90;

COD ID: 1549381

Formula: - C15 H11 N3 O4 -
Comments: AaminaNaaz, Y.; Kamalraja, Jayabal; Perumal, Paramasivam T.; SubbiahPandi, A. 5'-Nitro-1,4-dihydrospiro[3,1-benzoxazine-2,3'-indolin]-2'-one IUCrData 3(5) (2018) x180664
Space group: P 1 21/c 1
Cell volume: 1302.98
Cell parameters: 12.8698; 8.1365; 13.0309; 90; 107.275; 90;

COD ID: 1549393

Formula: - C24 H22 N2 O2 P2 -
Comments: Höhne, Martha; Aluri, Bhaskar R.; Spannenberg, Anke; Müller, Bernd H.; Peulecke, Normen; Rosenthal, Uwe 1,1-Bis(diphenylphosphoryl)hydrazine IUCrData 3(5) (2018) x180679
Space group: P -1
Cell volume: 1043.56
Cell parameters: 8.6901; 10.1547; 12.6282; 71.352; 84.442; 81.817;

COD ID: 1549394

Formula: - C22 H32 N2 O3 -
Comments: Abad, Nadeem; El Bakri, Youness; Ramli, Youssef; Essassi, El Mokhtar; Mague, Joel T. Ethyl 2-[(2E)-4-decyl-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-ylidene]acetate IUCrData 3(5) (2018) x180680
Space group: P 1 21/c 1
Cell volume: 2053.98
Cell parameters: 28.061; 4.765; 15.3667; 90; 91.503; 90;

COD ID: 1549412

Formula: - C18 H16 Cu Na2 O16 -
Comments: Yang, Annabeth P.; LaDuca, Robert L. Poly[diaquabis(μ-hydrogen benzene-1,2,4-tricarboxylato)copper(II)disodium]: a novel 4,5,6-connected trinodal net IUCrData 3(5) (2018) x180676
Space group: P -1
Cell volume: 517.26
Cell parameters: 6.9048; 7.0555; 11.8449; 105.071; 93.073; 109.955;

COD ID: 1549413

Formula: - C14 H21 N O4 -
Comments: Seye, Dame; Diop, Libasse; Diop, Cheikh Abdoul Khadir; Geiger, David K. Diisopropylammonium hydrogen phthalate IUCrData 3(5) (2018) x180704
Space group: P 1 21/c 1
Cell volume: 1520.9
Cell parameters: 8.16; 14.876; 12.549; 90; 93.192; 90;

COD ID: 1549439

Formula: - C61 H81 B F15 N3 Zr -
Comments: Frerichs, Nils; Adler, Christian; Schmidtmann, Marc; Beckhaus, Rüdiger Crystal structure of a zwitterionic azaallyl zirconiumamide complex bearing a Zr^+^-μ-CH~3~—B^{-^} moiety and one equivalent of n-hexane as a solvent IUCrData 3(5) (2018) x180644
Space group: P 1 21/c 1
Cell volume: 5966.9
Cell parameters: 23.493; 11.9942; 21.8489; 90; 104.259; 90;

COD ID: 1549440

Formula: - C23 H18 Fe2 O S2 -
Comments: Sánchez García, Jessica J.; Flores-Alamo, Marcos; Klimova, Elena I. 4,5-Diferrocenyl-1,2-dithiol-3-one IUCrData 3(5) (2018) x180685
Space group: P -1
Cell volume: 1904.76
Cell parameters: 9.8525; 10.6407; 19.272; 98.867; 95.255; 105.512;

COD ID: 1549494

Formula: - C10 H23 Cl3 N2 Pd -
Comments: Oberley, Alan J.; Kadel, Lava R.; Senaratne, Nilmini K.; Eichhorn, David M. Tetraethylammonium (acetonitrile)trichloridopalladate(II) IUCrData 3(5) (2018) x180750
Space group: P 1 21/c 1
Cell volume: 1599.2
Cell parameters: 7.286; 17.379; 12.95; 90; 102.769; 90;

COD ID: 1549518

Formula: - C17 H19 N -
Comments: Peloquin, Andrew J.; Smith, Madelyn B.; Balaich, Gary J.; Iacono, Scott T. (E)-1-[1-(3-Phenylcyclopenta-2,4-dien-1-ylidene)ethyl]pyrrolidine IUCrData 3(6) (2018) x180764
Space group: P 1 21/n 1
Cell volume: 1300.3
Cell parameters: 6.7724; 7.1774; 26.793; 90; 93.184; 90;

COD ID: 1549520

Formula: - C19 H19 N3 O3 -
Comments: Koh, Dongsoo; Lee, Ji Hye 4-(3,5-Dimethoxyphenyl)-6-(2-methoxyphenyl)pyrimidin-2-amine IUCrData 3(6) (2018) x180796
Space group: P -1
Cell volume: 806.72
Cell parameters: 7.5867; 10.268; 11.4684; 95.592; 102.147; 109.987;

COD ID: 1549521

Formula: - C16 H24 Br4 Cd N2 O2 -
Comments: Umarani, Parthasarathy; Thiruvalluvar, Aravazhi Amalan; Ramachandra Raja, Chidambaram Bis(4-methoxybenzylammonium) tetrabromidocadmate(II) IUCrData 3(6) (2018)
Space group: P 1 21/n 1
Cell volume: 2317
Cell parameters: 16.7564; 7.9403; 17.9303; 90; 103.777; 90;

COD ID: 1549528

Formula: - C19 H16 O3 -
Comments: Biruntha, K.; Reuben Jonathan, D.; Mohamooda Sumaya, U.; Dravida Thendral, E. R. A.; Usha, G. (3E)-3-[(2E)-3-(4-Methoxyphenyl)prop-2-enylidene]-2,3-dihydro-4H-chromen-4-one IUCrData 3(6) (2018) x180829
Space group: P -1
Cell volume: 738.4
Cell parameters: 6.8573; 7.4073; 15.55; 87.843; 78.892; 72.347;

COD ID: 1549529

Formula: - C19.83 H29 Cl3 N4 O2.17 -
Comments: Van Erdewyk, Martha L.; Oshin, Kayode D. Crystal structure of tris[(pyridin-1-ium-2-yl)methyl]amine trichloride‒methanol‒water (1/1.829/0.342) IUCrData 3(6) (2018) x180826
Space group: P -1
Cell volume: 1220.4
Cell parameters: 11.0118; 11.7295; 11.7453; 66.009; 67.12; 66.057;

COD ID: 1549562

Formula: - C5 H17 I N Na O5 -
Comments: Nazarenko, Alexander Y. Betaine (trimethylammonioacetate) binary compound with sodium iodide IUCrData 3(6) (2018) x180864
Space group: P -1
Cell volume: 1190.29
Cell parameters: 5.8131; 7.6682; 26.7168; 90.221; 91.168; 91.44;

COD ID: 1549563

Formula: - C19 H16 N4 O3 -
Comments: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Mostafa, Mohamed S.; Khidre, Rizk E.; Hegazy, Amany S.; Kariuki, Benson M. (E)-1-[5-Methyl-1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]-3-(4-nitrophenyl)prop-2-en-1-one IUCrData 3(6) (2018) x180841
Space group: P 1 21/c 1
Cell volume: 3404.9
Cell parameters: 37.0489; 13.3154; 6.917; 90; 93.771; 90;

COD ID: 1549576
CIF file Original IUCr paper	Formula: - C14 H12 O3 - Comments: Kotha, Sambasivarao; Cheekatla, Subba Rao; Gunta, Rama Hexacyclo[6.5.1.0^1,5^.0^5,12^.0^7,11^.0^9,13^]tetradecane-4,6,14-trione IUCrData 3(6) (2018) x180852 Space group: P 21 21 21 Cell volume: 1008.78 Cell parameters: 7.4539; 7.8553; 17.2286; 90; 90; 90;

COD ID: 1549584

Formula: - C18 H16 N4 O2 -
Comments: Moussaif, Ahmed; Ramli, Youssef; El Ghayati, Lhoussaine; Essassi, El Mokhtar; Mague, Joel T. Ethyl 5-(4-methylphenyl)-2,4,5,7-tetraazatricyclo[6.4.0.0^2,6^]dodeca-1(8),3,6,9,11-pentaene-3-carboxylate IUCrData 3(6) (2018) x180892
Space group: P 1 21/n 1
Cell volume: 1525.1
Cell parameters: 9.2366; 10.2045; 16.1922; 90; 92.144; 90;

COD ID: 1549585

Formula: - C11 H14 N2 O5 -
Comments: Missioui, Mohcine; El Fal, Mohammed; Taoufik, Jamal; Essassi, El Mokhtar; Mague, Joel T.; Ramli, Youssef 2-(3-Methyl-2-oxo-1,2-dihydroquinoxalin-1-yl)acetic acid dihydrate IUCrData 3(6) (2018) x180882
Space group: P 1 21/n 1
Cell volume: 1183.2
Cell parameters: 7.7306; 16.8048; 9.3113; 90; 102.001; 90;

COD ID: 1549586

Formula: - C17 H13 Cl O3 S -
Comments: Piontek, Aleksandra; Siodłak, Dawid; Zarychta, Bartosz 4-Chloronaphthalen-1-yl 4-methylbenzenesulfonate IUCrData 3(6) (2018) x180889
Space group: P 1 21/c 1
Cell volume: 1509.9
Cell parameters: 13.1301; 11.9592; 10.3738; 90; 112.041; 90;

COD ID: 1549587

Formula: - C24 H20 O6 S2 -
Comments: Piontek, Aleksandra; Siodłak, Dawid; Zarychta, Bartosz Naphthalene-2,6-diyl bis(4-methylbenzenesulfonate) IUCrData 3(6) (2018) x180890
Space group: P 1 21/n 1
Cell volume: 1048.68
Cell parameters: 12.227; 5.7229; 15.9353; 90; 109.869; 90;

COD ID: 1549604

Formula: - C45 H39 F6 Fe O4 P3 -
Comments: Ma, Yuzhi; Lindeman, Sergey; Donaldson, William A. Dicarbonyl{[(E,E)-(2,3,4,5-η)-6-methoxy-6-oxo-2,4-hexadienyl]triphenylphosphonium}(triphenylphosphane-κP)iron(1+) hexafluoridophosphate IUCrData 3(6) (2018) x180902
Space group: P 1 21/n 1
Cell volume: 4000.71
Cell parameters: 9.10074; 17.7897; 24.9408; 90; 97.7826; 90;

COD ID: 1549605

Formula: - C12 H21 N O3 S -
Comments: Seye, Dame; Diop, Cheikh Abdoul Khadir; Diop, Libasse; Geiger, David K. Diisopropylammonium benzenesulfonate IUCrData 3(6) (2018) x180876
Space group: P 1 21/c 1
Cell volume: 1434.1
Cell parameters: 11.737; 8.8719; 14.3722; 90; 106.616; 90;

COD ID: 1549606

Formula: - C28 H30 Mo N2 O4 P2 -
Comments: Höhne, Martha; Gongoll, Marc; Spannenberg, Anke; Müller, Bernd H.; Peulecke, Normen; Rosenthal, Uwe Tetracarbonyl[N-(diphenylphosphanyl-κP)-N,N'-diisopropyl-P-phenylphosphorus diamide-κP]molybdenum(0) with an unknown solvent IUCrData 3(6) (2018) x180846
Space group: P b c a
Cell volume: 5999
Cell parameters: 15.634; 17.716; 21.661; 90; 90; 90;

COD ID: 1549607

Formula: - C19 H13 F3 N4 -
Comments: El Hafi, Mohamed; Boulhaoua, Mohammed; Lahmidi, Sanae; Ramli, Youssef; Essassi, El Mokhtar; Mague, Joel T. 1-Methyl-4-phenyl-3-[4-(trifluoromethyl)phenyl]-1H-pyrazolo[3,4-d]pyrimidine IUCrData 3(6) (2018) x180875
Space group: P 1 21/c 1
Cell volume: 1628.2
Cell parameters: 15.0553; 15.7338; 6.9701; 90; 99.54; 90;

COD ID: 1549608

Formula: - C12 H15 N O4 S -
Comments: Baryala, Yamna; El Bakri, Youness; Anouar, El Hassane; Zerzouf, Abdelfettahb; Essassi, El Mokhtar; Mague, Joel T. Ethyl 3-methyl-1-oxo-4H-1,4-benzothiazine-2-carboxylate monohydrate IUCrData 3(6) (2018) x180887
Space group: P 1 21/c 1
Cell volume: 1269.35
Cell parameters: 8.834; 18.6849; 7.6927; 90; 91.478; 90;

COD ID: 1549628

Formula: - C14 H16 N2 Na O10 Rb S2 -
Comments: Nazarenko, Alexander Y. Sodium rubidium disaccharinate tetrahydrate IUCrData 3(6) (2018) x180867
Space group: P n m a
Cell volume: 2023.9
Cell parameters: 14.2754; 6.5831; 21.5365; 90; 90; 90;

COD ID: 1549664

Formula: - C21 H24 N2 O S -
Comments: Akrad, Rachida; Guerrab, Walid; Lazrak, Fatima; Ansar, Mhammed; Taoufik, Jamal; Mague, Joel T.; Ramli, Youssef 4,4-Diphenyl-1-propyl-2-propylsulfanyl-4,5-dihydro-1H-imidazol-5-one IUCrData 3(7) (2018) x180934
Space group: P 1 21/c 1
Cell volume: 1849
Cell parameters: 14.898; 14.878; 8.4007; 90; 96.78; 90;

COD ID: 1549665

Formula: - C15 H13 N3 -
Comments: El Ghayati, Lhoussaine; Ramli, Youssef; Moussaif, Ahmed; Koubachi, Jamal; Taha, Mohamed Labd; Essassi, El Mokhtar; Mague, Joel T. 2-Methyl-4-(pyridin-2-yl)-3H-1,5-benzodiazepine IUCrData 3(7) (2018) x180953
Space group: P 1 21/n 1
Cell volume: 1182.2
Cell parameters: 5.9642; 17.7004; 11.3963; 90; 100.695; 90;

COD ID: 1549666

Formula: - C17 H12 O4 -
Comments: Djandé, Abdoulaye; Abou, Akoun; Kini, Félix; Kambo, Konan René; Giorgi, Michel 2-Oxo-2H-chromen-7-yl 4-methylbenzoate IUCrData 3(7) (2018) x180927
Space group: P 1 c 1
Cell volume: 665.09
Cell parameters: 5.7029; 4.0346; 28.9081; 90; 90.751; 90;

COD ID: 1549667

Formula: - C16 H16 Cd2 O8 -
Comments: LaDuca, Andrew R.; LaDuca, Robert L. Poly[(μ5-cis-cyclohex-4-ene-1,2-dicarboxylato)(μ3-cis-cyclohex-4-ene-1,2-dicarboxylato)dicadmium(II)] IUCrData 3(7) (2018)
Space group: P 1 21/n 1
Cell volume: 1661.6
Cell parameters: 9.8377; 7.07; 24.268; 90; 100.12; 90;

COD ID: 1549674

Formula: - C25 H20 N2 O5 -
Comments: Mahfoud, Asmae; Al Houari, Ghali; El Yazidi, Mohamed; Saadi, Mohamed; El Ammari, Lahcen 2-Methyl-3'-(4-methylphenyl)-4'-(2-nitrophenyl)-4'H-spiro[chroman-3,5'-isoxazol]-4-one IUCrData 3(7) (2018) x180962
Space group: P -1
Cell volume: 2150.18
Cell parameters: 11.5219; 14.2321; 14.7033; 72.201; 73.469; 73.647;

COD ID: 1549675

Formula: - C17 H13 N5 O -
Comments: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Mostafa, Mohamed S.; Khidre, Rizk E.; Hegazy, Amany S.; Kariuki, Benson M. 2-(5-Methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-5-phenyl-1,3,4-oxadiazole IUCrData 3(7) (2018) x180966
Space group: P c a 21
Cell volume: 5853.1
Cell parameters: 23.5234; 10.5928; 23.4895; 90; 90; 90;

COD ID: 1549702

Formula: - C17 H18 N2 O2 S2 -
Comments: Aziz, Hamid; Saeed, Aamer; Simpson, Jim 5,5-Diphenyl-2-thioxoimidazolidin-4-one dimethyl sulfoxide monosolvate IUCrData 3(7) (2018) x181010
Space group: P 1 21/n 1
Cell volume: 1737.49
Cell parameters: 7.3167; 15.5894; 15.5627; 90; 101.82; 90;

COD ID: 1549703

Formula: - C15 H18 N2 O -
Comments: Al Garadi, Wedad; Ramli, Youssef; El Ghayati, Lhoussaine; Moussaif, Ahmed; Essassi, El Mokhtar; Mague, Joel T. 4-Phenyl-5a,6,7,8,9,9a-hexahydro-1H-1,5-benzodiazepin-2(5H)-one IUCrData 3(7) (2018) x181011
Space group: P 1 21/c 1
Cell volume: 1294.6
Cell parameters: 11.4283; 9.2294; 12.3632; 90; 96.89; 90;

COD ID: 1549714

Formula: - C22 H15 N O2 S -
Comments: Bakhouch, Mohamed; El Yazidi, Mohamed; Al Houari, Ghali; Saadi, Mohamed; El Ammari, Lahcen 3',4'-Diphenyl-3H,4'H-spiro[benzo[b]thiophene-2,5'-isoxazol]-3-one IUCrData 3(7) (2018) x181019
Space group: P b c a
Cell volume: 3459.6
Cell parameters: 9.265; 10.3523; 36.0698; 90; 90; 90;

COD ID: 1549720

Formula: - C14 H18 N2 O3 -
Comments: Rasheeda, Kedila; Samshuddin, Seranthimata; Swathi, Phadke N.; Alva, Vijaya D. P.; Mague, Joel T.; Ramli, Youssef 2-(4-Hydroxyphenyl)-4,6-dimethyl-2,3-dihydropyrimidin-1-ium acetate IUCrData 3(7) (2018) x181046
Space group: P n a 21
Cell volume: 1403.2
Cell parameters: 12.2836; 14.5343; 7.8596; 90; 90; 90;

COD ID: 1549721

Formula: - C19 H16 O5 -
Comments: Goyal, Navneet; Do, Camilla; Donahue, James P.; Mague, Joel T.; Foroozesh, Maryam Ethyl 2-[2-(4-oxo-4H-chromen-2-yl)phenoxy]acetate IUCrData 3(7) (2018) x180993
Space group: P 21 21 21
Cell volume: 1553.07
Cell parameters: 4.6852; 17.5786; 18.8573; 90; 90; 90;

COD ID: 1549779

Formula: - C25 H24 N4 O3 S -
Comments: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M. Ethyl 2-anilino-4-methyl-5-[5-methyl-1-(4-methylphenyl)-1H-1,2,3-triazole-4-carbonyl]thiophene-3-carboxylate IUCrData 3(8) (2018) x181106
Space group: P 1 2/c 1
Cell volume: 2350.7
Cell parameters: 8.3287; 13.8956; 20.3124; 90; 90.635; 90;

COD ID: 1549780

Formula: - H4 N O3 V -
Comments: Pérez-Benítez, Aarón; Bernès, Sylvain Redetermination of ammonium metavanadate IUCrData 3(8) (2018)
Space group: P b c m
Cell volume: 336.84
Cell parameters: 4.9045; 11.7945; 5.8231; 90; 90; 90;

COD ID: 1549781

Formula: - C19 H14 O2 -
Comments: Devassia, Tomson; Mathew, Eason M.; Sithambaresan, M.; Unnikrishnan, P. A.; Kurup, M. R. Prathapachandra 10-Methyl-9,11-annulated dibenzobarrelene IUCrData 3(8) (2018) x181102
Space group: P b c n
Cell volume: 2773.4
Cell parameters: 19.7403; 9.3294; 15.0595; 90; 90; 90;

COD ID: 1549793

Formula: - C10 H7 Cl N3 Na O2 -
Comments: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M. Sodium 1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate IUCrData 3(8) (2018) x181127
Space group: P 1 21/c 1
Cell volume: 1090.26
Cell parameters: 11.6462; 6.3754; 14.7003; 90; 92.711; 90;

COD ID: 1549794

Formula: - C37 H31 B Cl3 F4 N P2 -
Comments: Manandhar, Rachana; Rath, Nigam P.; Jones, Myron W. Bis(triphenylphosphine)iminium tetrafluoroborate chloroform monosolvate IUCrData 3(8) (2018) x181108
Space group: P -1
Cell volume: 1764.6
Cell parameters: 9.6306; 10.813; 17.0381; 91.826; 95.619; 90.734;

COD ID: 1549795

Formula: - C15 H22 I N -
Comments: da Costa Duarte, Rodrigo; Kommers Reimann, Louise; Severo Rodembusch, Fabiano; Gustavo Teixeira Alves Duarte, Luís 1-Butyl-2,3,3-trimethylindol-1-ium iodide IUCrData 3(8) (2018) x181130
Space group: P b c a
Cell volume: 3082
Cell parameters: 15.631; 11.614; 16.976; 90; 90; 90;

COD ID: 1549803

Formula: - C16 H12 O3 -
Comments: Padgett, Clifford W.; Lynch, Will E.; Sheriff, Kirkland; Dean, Raven; Zingales, Sarah 3-Hydroxy-2-(4-methylphenyl)-4H-chromen-4-one IUCrData 3(8) (2018) x181138
Space group: P 1 21/n 1
Cell volume: 1228.02
Cell parameters: 13.2958; 5.1981; 18.8162; 90; 109.212; 90;

COD ID: 1549804

Formula: - C18 H18 Cl N3 O -
Comments: Lee, Ji Hye; Koh, Dongsoo 2-Amino-4-(4-methoxyphenyl)-6-(4-methylphenyl)pyrimidin-1-ium chloride IUCrData 3(8) (2018) x181152
Space group: P 65
Cell volume: 2460.5
Cell parameters: 9.9013; 9.9013; 28.981; 90; 90; 120;

COD ID: 1549819

Formula: - C17 H20 N6 O2 -
Comments: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M. 5-Methyl-1-(4-methylphenyl)-N'-[1-(1H-pyrrol-2-yl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide monohydrate IUCrData 3(8) (2018) x181162
Space group: P -1
Cell volume: 872.83
Cell parameters: 7.3968; 10.6475; 12.7769; 106.577; 100.809; 108.208;

COD ID: 1549869

Formula: - C25 H47 N O7 -
Comments: Eitel, Michael; Schollmeyer, Dieter; Gross, Harald; Koch, Pierre (2S,3S)-2-Azaniumyl-4-[(1S,4aS,4bS,6S,7S,8aS,10aS)-6,7-dihydroxy-2,4b,8,8,10a-pentamethyl-1,4,4a,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-yl]-3-methoxybutanoate‒methanol‒water (1/1/1) IUCrData 3(8) (2018) x181194
Space group: P 21 21 21
Cell volume: 2682.72
Cell parameters: 7.9093; 13.3712; 25.3669; 90; 90; 90;

COD ID: 1549870

Formula: - C9 H14 Br4 Co N4 -
Comments: Peppel, Tim; Spannenberg, Anke 3,3'-Dimethyl-1,1'-methylenediimidazolium tetrabromidocobaltate(II) IUCrData 3(8) (2018) x181212
Space group: C 1 2/c 1
Cell volume: 3322.2
Cell parameters: 15.7782; 7.4076; 28.567; 90; 95.7271; 90;

COD ID: 1549871

Formula: - C18 H13 Cl2 N O2 -
Comments: Grinev, Vyacheslav S.; Osipov, Alexander K.; Yegorova, Alevtina Yu. (Z)-3-[(3,5-Dichloroanilino)methylidene]-5-(4-methylphenyl)furan-2(3H)-one IUCrData 3(8) (2018) x181224
Space group: P -1
Cell volume: 768.3
Cell parameters: 7.4005; 10.4272; 10.5704; 86.076; 72.382; 81.325;

COD ID: 1549872

Formula: - C13 H13 N2 O7 -
Comments: Dziuk, Błażej; Jezuita, Anna 2,2'-Bipyridin-1-ium hemioxalate oxalic acid monohydrate IUCrData 3(8) (2018) x181219
Space group: P -1
Cell volume: 687.84
Cell parameters: 7.2618; 8.9419; 11.0001; 85.545; 86.177; 75.248;

COD ID: 1549898

Formula: - C22 H36 N2 -
Comments: Grace, P. Selvarathy; Nirmalram, Jeyaraman Selvaraj; Nayagam, B. Ravindran Durai; Schollmeyer, Dieter 1,1'-[(2,3,5,6-Tetramethyl-1,4-phenylene)bis(methylene)]dipiperidine IUCrData 3(9) (2018) x181237
Space group: P 1 21/n 1
Cell volume: 948.95
Cell parameters: 5.6271; 21.1764; 8.2787; 90; 105.86; 90;

COD ID: 1549899

Formula: - C15 H14 N4 O3 -
Comments: Wang, Zhaodong; Ni, Haitao Methyl 4-{N'-[(1E)-1-(pyrazin-2-yl)ethylidene]hydrazinecarbonyl}benzoate IUCrData 3(9) (2018) x181230
Space group: P 1
Cell volume: 711.7
Cell parameters: 5.859; 7.479; 16.329; 93.818; 91.29; 94.252;

COD ID: 1549950

Formula: - C20 H19 N O2 -
Comments: Biruntha, K.; Reuben Jonathan, D.; Mohamooda Sumaya, U.; Dravida Thendral, E. R. A.; Usha, G. Crystal structure of (3E)-3-{(2E)-3-[4-(dimethylamino)phenyl]prop-2-enylidene}-3,4-dihydro-2H-chromen-4-one IUCrData 3(9) (2018) x181273
Space group: P 1 21/c 1
Cell volume: 1618.43
Cell parameters: 9.362; 11.6073; 15.0732; 90; 98.859; 90;

COD ID: 1549951

Formula: - C17 H24 N2 O S -
Comments: Al Garadi, Wedad; Ramli, Youssef; El Ghayati, Lhoussaine; El Hafi, Mohamed; Moussaif, Ahmed; Essassi, El Mokhtar; Mague, Joel T. 4-Phenyl-2,5,5a,6,7,8,9,9a-hexahydro-1H-1,5-benzodiazepine-2-thione ethanol monosolvate IUCrData 3(9) (2018) x181276
Space group: P 1 21/n 1
Cell volume: 1696.84
Cell parameters: 12.0255; 8.9303; 15.8822; 90; 95.813; 90;

COD ID: 1549952

Formula: - C21 H16 O4 -
Comments: Sung, Jiha 6-Methoxy-2-(2-methoxynaphthalen-1-yl)-4H-chromen-4-one IUCrData 3(9) (2018) x181277
Space group: P -1
Cell volume: 804.06
Cell parameters: 7.9937; 9.3819; 12.2131; 72.552; 86.895; 67.288;

COD ID: 1549966

Formula: - C30 H24 N4 O2 S -
Comments: Muthuselvi, C.; Athimoolam, S.; Srinivasan, N.; Ravikumar, B.; Pandiarajan, S.; Krishnakumar, R. V. Ethyl 6'-cyano-7'-phenyl-1',6',7',7a'-tetrahydro-3'H-spiro[indeno[1,2-b]quinoxaline-11,5'-pyrrolo[1,2-c]thiazole-6'-carboxylate IUCrData 3(9) (2018) x181286
Space group: C 1 2/c 1
Cell volume: 5039.2
Cell parameters: 18.6131; 18.2243; 15.8867; 90; 110.757; 90;

COD ID: 1549978

Formula: - C15 H9 F O3 -
Comments: Koh, Dongsoo 2-(2-Fluorophenyl)-3-hydroxy-4H-chromen-4-one IUCrData 3(9) (2018) x181332
Space group: P 1 21/c 1
Cell volume: 2337.88
Cell parameters: 22.3701; 6.8836; 15.7987; 90; 106.058; 90;

COD ID: 1549979

Formula: - C8 H12 N2 O8 -
Comments: Seidel, Rüdiger W. Revision of the crystal structure of `bis(glycine) squaric acid' IUCrData 3(9) (2018) x181324
Space group: C 1 2/c 1
Cell volume: 2168.5
Cell parameters: 16.805; 8.3008; 15.7976; 90; 100.259; 90;

COD ID: 1549980

Formula: - C18 H14 O2 S -
Comments: Hemanathan, K.; Raja, R.; Murugesan, K. Sakthi 8,9-Dimethoxybenzo[b]naphtho[2,3-d]thiophene IUCrData 3(9) (2018) x181257
Space group: P 1 21/n 1
Cell volume: 1383.05
Cell parameters: 13.0062; 5.9631; 18.3801; 90; 104.019; 90;

COD ID: 1549981

Formula: - C27 H22 N4 O2 -
Comments: Liu, Gang; Liu, Qingsong; Zhang, Huihui; Yu, Jianhua 2-(4-Aminophenyl)-3-[3,4-bis(pyridin-2-ylmethoxy)phenyl]acrylonitrile IUCrData 3(9) (2018) x181329
Space group: P 1 21/c 1
Cell volume: 2261.2
Cell parameters: 8.0233; 16.877; 17.013; 90; 101.021; 90;

COD ID: 1549982

Formula: - C13 H16 N4 O2 -
Comments: Lahmidi, Sanae; El Hafi, Mohamed; Moussaif, Ahmed; Benchidmi, Mohammed; Essassi, El Mokhtar; Mague, Joel T. Ethyl 2-(5-methyl-1,2,4-triazolo[1,5-a]pyrimidin-7-yl)pent-4-enoate IUCrData 3(9) (2018) x181280
Space group: P 1 21/n 1
Cell volume: 1325.7
Cell parameters: 9.069; 13.319; 11.851; 90; 112.161; 90;

COD ID: 1549983

Formula: - C17 H19 N O5 -
Comments: Wang, Junjun; Zhu, Yin; Wang, Haiyan; Yang, Mingdi 3-Acetyl-7-(2-morpholin-4-yl-ethoxy)-chromen-2-one IUCrData 3(9) (2018) x181327
Space group: P 1 21/c 1
Cell volume: 1575.2
Cell parameters: 8.462; 16.243; 11.477; 90; 93.091; 90;

COD ID: 1549987

Formula: - C17 H18 O2 -
Comments: Goyal, Navneet; Donahue, James P.; Do, Camilla; Perry, Timothy; Bongay-Williams, Kyla; Foroozesh, Maryam A dibenzofuran derivative: 2-(pentyloxy)dibenzo[b,d]furan IUCrData 3(9) (2018) x181306
Space group: P -1
Cell volume: 672.8
Cell parameters: 7.841; 8.203; 11.08; 79.131; 85.616; 74.077;

COD ID: 1549988

Formula: - C21 H15 N3 O3 -
Comments: Rao, Qingpeng; Wang, Zepeng; Yang, Mingdi; Wu, Zhichao (Z)-2-(4-Nitrophenyl)-3-[4-(pyridin-4-ylmethoxy)phenyl]acrylonitrile IUCrData 3(9) (2018) x181328
Space group: P 1 21/c 1
Cell volume: 1763.4
Cell parameters: 10.1759; 23.521; 7.4038; 90; 95.674; 90;

COD ID: 1549989

Formula: - C11 H11 N3 O4 -
Comments: Marten, Jan; Seichter, Wilhelm; Weber, Edwin 3-[2-(3-Nitrophenyl)hydrazin-1-ylidene]pentane-2,4-dione IUCrData 3(9) (2018) x181344
Space group: P -1
Cell volume: 1659.74
Cell parameters: 10.1251; 11.1335; 15.9006; 102.745; 101.1; 101.52;

COD ID: 1550027

Formula: - C21.5 H20.5 Br N6.5 O0.5 S -
Comments: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M. 5-[(4-Bromophenyl)diazenyl]-2-{2-[1-(1H-indol-3-yl)ethylidene]hydrazinyl}-4-methylthiazole dimethylformamide hemisolvate IUCrData 3(10) (2018) x181378
Space group: P -1
Cell volume: 2225.6
Cell parameters: 9.9957; 14.5325; 15.8353; 81.671; 81.344; 80.469;

COD ID: 1550028

Formula: - C17 H17 N5 O S -
Comments: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M. 5-Methyl-1-(4-methylphenyl)-N′-[1-(thiophen-2-yl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide IUCrData 3(10) (2018)
Space group: P -1
Cell volume: 847.86
Cell parameters: 9.0292; 9.864; 10.8754; 111.021; 105.103; 96.945;

COD ID: 1550078

Formula: - C24 H23 N3 O2 -
Comments: Jouha, Jabrane; Loubidi, Mohamed; El Hafi, Mohamed; Tber, Zahira; Essassi, El Mokhtar; Mague, Joel T. Ethyl 4-(3,4,6-trimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-5-yl)benzoate IUCrData 3(10) (2018) x181449
Space group: P -1
Cell volume: 969.6
Cell parameters: 8.6962; 8.7349; 14.559; 106.468; 92.949; 111.771;

COD ID: 1550079

Formula: - C11 H23 N10 O15 Sm -
Comments: Gioia, Michael; Crundwell, Guy; Westcott, Barry L. Tetraaqua[2,6-diacetylpyridine bis(semicarbazone)]samarium(III) trinitrate IUCrData 3(10) (2018) x181454
Space group: P 1 21/c 1
Cell volume: 2293.3
Cell parameters: 10.0164; 22.7494; 15.0848; 90; 138.151; 90;

COD ID: 1550080

Formula: - C18 H19 N O7 -
Comments: Bouzian, Younos; Hlimi, Fouzia; kheira Sebbar, Nada; El Hafi, Mohamed; Hni, Brahim; Essassi, El Mokhtar; Mague, Joel T. Ethyl 2-{[2-(2-ethoxy-2-oxoethoxy)quinolin-4-yl]carbonyloxy}acetate IUCrData 3(10) (2018) x181438
Space group: P -1
Cell volume: 869.06
Cell parameters: 4.9417; 7.6157; 23.4472; 94.49; 92.997; 98.136;

COD ID: 1550081

Formula: - C8 H20 Cl6 N2 Sn -
Comments: Gotoh, Kazuma; Ishida, Hiroyuki Bis(pyrrolidinium) hexachloridostannate: a redetermination IUCrData 3(10) (2018)
Space group: C 1 2/m 1
Cell volume: 857.04
Cell parameters: 16.3784; 7.3134; 7.1566; 90; 91.205; 90;

COD ID: 1550082

Formula: - C19 H28 Cl N3 O5 -
Comments: Rasheeda, Kedila; Samshuddin, Seranthimata; Swathi, Phadke N.; Alva, Vijaya D. P.; Mague, Joel T.; Ramli, Youssef Diethyl 4-(4-chloro-2-propyl-1H-imidazol-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate monohydrate IUCrData 3(10) (2018) x181470
Space group: P 43
Cell volume: 2321
Cell parameters: 8.5308; 8.5308; 31.893; 90; 90; 90;

COD ID: 1550129

Formula: - C12 H8 Br2 N2 O -
Comments: Goswami, Shailesh K.; Hanton, Lyall R.; McAdam, C. John; Moratti, Stephen C.; Simpson, Jim (Z)-1,2-Bis(3-bromophenyl)diazene 1-oxide IUCrData 3(10) (2018) x181486
Space group: P 1 21/n 1
Cell volume: 586
Cell parameters: 3.8938; 5.8223; 25.8645; 90; 92.044; 90;

COD ID: 1550130

Formula: - C13 H10 Cl N O -
Comments: Javed, Saleem; Faizi, Md. Serajul Haque; Nazia, Siddiqui; Iskenderov, Turganbay 2-Amino-5-chlorobenzophenone IUCrData 3(10) (2018) x181444
Space group: P -1
Cell volume: 2274.1
Cell parameters: 9.7335; 10.6473; 24.7554; 87.443; 84.272; 62.978;

COD ID: 1550169

Formula: - C10 H28 Cl6 N6 Te -
Comments: Giltzau, Niels Ole; Köckerling, Martin Bis(tetramethylguanidinium) hexachloridotellurate(IV) IUCrData 3(10) (2018) x181488
Space group: F d d d
Cell volume: 4729.6
Cell parameters: 7.3899; 22.447; 28.512; 90; 90; 90;

COD ID: 1550200

Formula: - C7 H9 I N2 S -
Comments: Shotonwa, Ibukun O.; Boeré, René T. 1-Methyl-4-thiocarbamoylpyridin-1-ium iodide IUCrData 3(11) (2018)
Space group: C 1 2/c 1
Cell volume: 2002.5
Cell parameters: 19.6249; 7.2198; 14.9117; 90; 108.592; 90;

COD ID: 1550216

Formula: - C19 H37 Cl2 Co Li N2 O3 -
Comments: Vinocour, Felipe A.; Soto-Navarro, Andrea; Pineda, Leslie W. μ2-Chlorido-chlorido(μ2-4-{[2-(diethylamino)ethyl]imino}pent-2-en-2-olato)bis(tetrahydrofuran-κO)cobalt(II)lithium IUCrData 3(11) (2018)
Space group: P 1 21/n 1
Cell volume: 2316.4
Cell parameters: 10.0535; 12.3705; 19.236; 90; 104.476; 90;

COD ID: 1550217

Formula: - C16 H14 O2 -
Comments: Detert, Heiner; Schollmeyer, Dieter The rel-R,R-enantiomer of 7-[7-hydroxybicyclo[4.2.0]octa-1(6),2,4-trien-7-yl]bicyclo[4.2.0]octa-1(6),2,4-trien-7-ol IUCrData 3(11) (2018) x181550
Space group: P 1 21 1
Cell volume: 599.95
Cell parameters: 10.1497; 5.1276; 11.6896; 90; 99.541; 90;

COD ID: 1550273

Formula: - C16 H14 O -
Comments: Umaña, Christian A.; Pineda, Leslie W.; Cabezas, Jorge A. Homopropargyl alcohol 1,1-diphenylbut-3-yn-1-ol IUCrData 3(11) (2018) x181619
Space group: P 21 21 21
Cell volume: 1166.9
Cell parameters: 7.485; 9.173; 16.995; 90; 90; 90;

COD ID: 1550274
CIF file HKL data	Formula: - C19 H18 O7 - Comments: Abou, Akoun; Akonan, Ludovic; Koblavi-Mansilla, Frédérica; N'gouan, Aka Joseph; Kambo, Konan René 3-Hydroxy-3-methylisochroman-1-one‒2-(carboxymethyl)benzoic acid (1/1) IUCrData 3(11) (2018) x181653 Space group: P 1 21/c 1 Cell volume: 1688.53 Cell parameters: 12.1143; 9.8134; 14.2602; 90; 95.116; 90;

COD ID: 1550275

Formula: - C20 H16 O S -
Comments: Umaña, Christian A.; Pineda, Leslie W.; Cabezas, Jorge A. 1,1-Diphenyl-4-(thiophen-2-yl)but-3-yn-1-ol IUCrData 3(11) (2018) x181616
Space group: P 1 21/n 1
Cell volume: 3116
Cell parameters: 9.424; 16.0262; 20.8913; 90; 99.042; 90;

COD ID: 1550276

Formula: - C2 H10 N4 O8 S4 -
Comments: Zouihri, Hafid; El Korchi, Khadija; Yamni, Khalid; Tijani, Najib Dithiobis(formamidinium) bis(hydrogen sulfate) IUCrData 3(11) (2018) x181540
Space group: P -1
Cell volume: 600.32
Cell parameters: 5.1371; 9.5237; 12.9884; 106.521; 96.067; 95.618;

COD ID: 1550277

Formula: - C17 H16 O2 -
Comments: Umaña, Christian A.; Pineda, Leslie W.; Cabezas, Jorge A. Homopropargyl alcohol 5,5-diphenylpent-2-yne-1,5-diol IUCrData 3(11) (2018) x181618
Space group: P 1 21/c 1
Cell volume: 1330.59
Cell parameters: 7.9772; 22.8528; 7.3075; 90; 92.791; 90;

COD ID: 1550278

Formula: - C6 H7 N5 O -
Comments: Lahmidi, Sanae; El Hafi, Mohamed; kheira Sebbar, Nada; Abad, Nadeem; Essassi, El Mokhtar; Mague, Joel T. 2-Amino-5-methyl-1,2,4-triazolo[1,5-a]pyrimidin-7(4H)-one IUCrData 3(11) (2018) x181500
Space group: P -1
Cell volume: 710.1
Cell parameters: 6.5921; 8.3935; 13.185; 92.023; 98.309; 99.741;

COD ID: 1550294

Formula: - C19 H22 O2 -
Comments: Kotha, Sambasivarao; Gunta, Rama; Cheekatla, Subba Rao; Mhatre, Darshan S. Spiro[cyclopentane-1,11'-hexacyclo[7.6.0.0^1,6^.0^6,13^.0^8,12^.0^10,14^]pentadecane]-7',15'-dione IUCrData 3(11) (2018) x181590
Space group: P 1 21/c 1
Cell volume: 1424.3
Cell parameters: 10.865; 14.3936; 9.8008; 90; 111.68; 90;

COD ID: 1550295

Formula: - Ca2 Cl2 Cu O2 -
Comments: Baptiste, Benoît; Azuma, Masaki; Yu, Runze; Giura, Paola; d'Astuto, Matteo Ca2CuO2Cl2, a redetermination from single-crystal X-ray diffraction data IUCrData 3(11) (2018)
Space group: I 4/m m m
Cell volume: 224.9
Cell parameters: 3.868; 3.868; 15.0321; 90; 90; 90;

COD ID: 1550311

Formula: - C17 H16 N2 O2 -
Comments: Abad, Nadeem; Ramli, Youssef; Lahmidi, Sanae; El Hafi, Mohamed; Essassi, El Mokhtar; Mague, Joel T. 1-(3-Hydroxypropyl)-3-phenylquinoxalin-2(1H)-one IUCrData 3(11) (2018) x181633
Space group: P 1 21/n 1
Cell volume: 1380.9
Cell parameters: 8.1914; 9.5151; 17.781; 90; 94.88; 90;

COD ID: 1550312

Formula: - C19 H17 N3 S -
Comments: Loubidi, Mohamed; Jouha, Jabrane; Tber, Zahira; El Hafi, Mohamed; Essassi, El Mokhtar; Mague, Joel T. 3,4,6-Trimethyl-1-phenyl-5-(thiophen-3-yl)-1H-pyrazolo[3,4-b]pyridine IUCrData 3(11) (2018) x181593
Space group: P -1
Cell volume: 822.39
Cell parameters: 7.6672; 9.9098; 11.4101; 82.548; 78.176; 76.607;

COD ID: 1550313

Formula: - C13 H12 Cl N3 O2 -
Comments: Stondus, Jigmat; Anthal, Sumati; Jayashree, A.; Narayana, B.; Sarojini, B. K.; Kant, Rajni Polymorph of (E)-N'-(4-chlorobenzylidene)isonicotinohydrazide monohydrate IUCrData 3(11) (2018) x181634
Space group: P 21 21 21
Cell volume: 1314.1
Cell parameters: 6.4405; 7.266; 28.081; 90; 90; 90;

COD ID: 1550314

Formula: - C10 H12 O3 -
Comments: Abdou, Moaz M.; Matziari, Magdalini; O'Neill, Paul M.; Amigues, Eric; Zhou, Ruixue; Wang, Ruiyao; Ali, Basem F. Methyl 3-(4-hydroxyphenyl)propionate IUCrData 3(11) (2018) x181662
Space group: P 21 21 21
Cell volume: 889.74
Cell parameters: 5.4774; 11.1557; 14.561; 90; 90; 90;

COD ID: 1550336

Formula: - C9 H11 N O3 -
Comments: Baillargeon, Pierre; Rahem, Tarik; Amigo, Carl; Fortin, Daniel; Dory, Yves L. Polar crystal of vanillylformamide through replacement of the alkene by an isosteric formamide group IUCrData 3(12) (2018) x181630
Space group: P 1
Cell volume: 223.575
Cell parameters: 4.8011; 6.5522; 7.5052; 93.618; 107.044; 95.658;

COD ID: 1550356

Formula: - C11 H11 N O2 -
Comments: Furuya, Tetsundo; Yagi, Shiomi; Yamazaki, Shu; Haraguchi, Tomoyuki; Akitsu, Takashiro; Mahesha, Ninganayaka; Sagar, Belakavadi K.; Yathirajan, Hemmige S. Methyl 1-methyl-1H-indole-3-carboxylate IUCrData 3(12) (2018) x181728
Space group: P b c m
Cell volume: 933.5
Cell parameters: 8.3019; 16.628; 6.7622; 90; 90; 90;

COD ID: 1550362

Formula: - C188 H140 Cl12 N16 O8 Zn3 -
Comments: Makino, Masatomo; Matsubayashi, Kazuhiko; Kodama-Oda, Yukiko; Imawaka, Naoto; Mizuno, Nobuhiro; Kumasaka, Takashi; Yoshino, Katsumi Construction of a supramolecule comprising [2,3,9,10,16,17,23,24-octakis(2,6-dimethylphenoxy)phthalocyaninato]zinc(II) and (5,10,15,20-tetraphenylporphyrinato)zinc(II) IUCrData 3(12) (2018) x181741
Space group: P 1 21/n 1
Cell volume: 8088
Cell parameters: 20.216; 21.275; 20.821; 90; 115.414; 90;

COD ID: 1550363

Formula: - C10 H13 N O4 -
Comments: Suresh, S.; Pandi, P.; Akilan, R.; Kumar, R. Mohan; Chakkaravarthi, G. 4-Methylanilinium 2-carboxyacetate IUCrData 3(12) (2018) x181714
Space group: P 1 21/c 1
Cell volume: 1007.1
Cell parameters: 12.996; 9.2813; 8.665; 90; 105.503; 90;

COD ID: 1550364
CIF file HKL data	Formula: - C11 H8 Cl2 N2 O3 - Comments: Stondus, Jigmat; Anthal, Sumati; Karanth, S.; Narayana, B.; Sarojini, B. K.; Kant, Rajni 2,4-Dichloro-<i>N</i>-(2,5-dioxopyrrolidin-1-yl)benzamide IUCrData 3(12) (2018) x181740 Space group: P 1 21/c 1 Cell volume: 1175.92 Cell parameters: 7.8233; 7.4705; 20.1932; 90; 94.866; 90;

COD ID: 1550365

Formula: - C10 H10 N2 O -
Comments: Dioukhane, Khadim; Aouine, Younas; Faraj, Hassane; Alami, Anouar; Essassi, El Mokhtar; Zouihri, Hafid 4-Methyl-1H-1,5-benzodiazepin-2(3H)-one IUCrData 3(12) (2018) x181718
Space group: P 21 21 21
Cell volume: 930.77
Cell parameters: 7.5676; 10.7802; 11.4092; 90; 90; 90;

COD ID: 1550374

Formula: - C22 H28 Cl18 N2 Nb6 O2 S2 -
Comments: Sperlich, Eric; Köckerling, Martin (C~7~H~6~NS)~2~[Nb~6~Cl~18~]·2C~4~H~8~O: first niobium cluster with an N,S-heterocyclic cation IUCrData 3(12) (2018) x181760
Space group: P 1 21/c 1
Cell volume: 2273.75
Cell parameters: 8.711; 24.171; 11.0653; 90; 102.598; 90;

COD ID: 1550385

Formula: - C5 H10 N2 O3 S -
Comments: Hmissa, Taha; Mathivathanan, Logesh; Thompson, Alexander P.; Mirjafari, Arsalan 1-Methyl-1H-imidazol-3-ium methanesulfonate IUCrData 3(12) (2018) x181781
Space group: P 1 21/n 1
Cell volume: 812.02
Cell parameters: 10.1891; 7.4627; 11.4884; 90; 111.635; 90;

COD ID: 1550386
CIF file Original IUCr paper	Formula: - C10 H12 O4 - Comments: Xiong, Huiping; Mao, Shilong; Lv, Qianzhou; Zhang, Ning Crystal structure of the ethyl 2,4-dihydroxy-6-methylbenzoate from <i>Illicium difengpi</i> K.I.B et K.I.M. IUCrData 3(12) (2018) x181776 Space group: P 1 21/n 1 Cell volume: 966.7 Cell parameters: 7.818; 17.017; 8.189; 90; 117.459; 90;

COD ID: 1550387

Formula: - C24 H22 N2 O P2 -
Comments: Höhne, Martha; Aluri, Bhaskar R.; Spannenberg, Anke; Müller, Bernd H.; Peulecke, Normen; Rosenthal, Uwe 1-Diphenylphosphanyl-2-(diphenylphosphoryl)hydrazine IUCrData 3(12) (2018) x181784
Space group: P -1
Cell volume: 1057.04
Cell parameters: 8.4464; 10.4163; 13.488; 71.55; 76.477; 71.75;

COD ID: 1552859

Formula: - C36 H38 Cl4 Cu2 N6 O2 -
Comments: Naugle, Mercedes S.; Keller, Brittany T.; Zeller, Matthias; Zaleski, Curtis M. Di-μ-chlorido-bis[chlorido(dimethylformamide-κN)(3,5-diphenyl-1H-pyrazole-κN^2^)copper(II)] IUCrData 3(8) (2018) x181186
Space group: P 1 21/n 1
Cell volume: 1950.9
Cell parameters: 12.004; 9.7942; 17.4116; 90; 107.633; 90;

COD ID: 1552860