Crystallography Open Database

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1500045 CIFC14 H10 Br2 N2 O7 RuP 1 21/c 16.5744; 19.604; 13.4362
90; 92.7382; 90		1729.74Luukkanen, Saija; Haukka, Matti; Eskelinen, Esa; Pakkanen, Tapani A.; Lehtovuori, Viivi; Kallioinen, Jani; Myllyperkiö, Pasi; Korppi-Tommola, Jouko
Photochemical reactivity of halogen-containing ruthenium‒dcbpy (dcbpy = 4,4'-dicarboxylic acid-2,2'-bipyridine) compounds, trans(Br)-[Ru(dcbpy)(CO)2Br2] and trans(I)-[Ru(dcbpy)(CO)2I2]
Physical Chemistry Chemical Physics, 2001, 3, 1992
1551263 CIFC29 H21 Br2 F6 N2 PP 1 21/c 129.7525; 5.9838; 15.591
90; 98.639; 90		2744.2Ma, Xiao; Li, Jipeng; Lin, Chensheng; Chai, Guoliang; Xie, Yangbin; Huang, Wei; Wu, Dayu; Wong, Wai-Yeung
Reversible two-channel mechanochromic luminescence for a pyridinium-based white-light emitter with room-temperature fluorescence–phosphorescence dual emission
Physical Chemistry Chemical Physics, 2019, 21, 14728-14733
3000174 CIFAl4.8 Na0.7 O24 Si7.2F d -3 m :224.4901; 24.4901; 24.4901
90; 90; 90		14688.3Jenny G. Vitillo; Torstein Fjermestad; Maddalena D Amore; Marco Milanesio; Luca Palin; Gabriele Ricchiardi; Silvia Bordiga
On the Structure of Superbasic (MgO)n sites solvated in a Faujasite Zeolite
Physical Chemistry Chemical Physics, 2018, 27, 18503
3000175 CIFAl4.8 Mg0.45 O25.1 Si7.2F d -3 m :224.4379; 24.4379; 24.4379
90; 90; 90		14594.6Jenny G. Vitillo; Torstein Fjermestad; Maddalena D Amore; Marco Milanesio; Luca Palin; Gabriele Ricchiardi; Silvia Bordiga
On the Structure of Superbasic (MgO)n sites solvated in a Faujasite Zeolite
Physical Chemistry Chemical Physics, 2018, 27, 18503
7200205 CIFC13 H13 NP 1 21/c 19.5107; 11.0673; 10.0425
90; 108.888; 90		1000.13Gibson, Emma K.; Winfield, John M.; Muir, Kenneth W.; Carr, Robert H.; Eaglesham, Archie; Gavezzotti, Angelo; Parker, Stewart F.; Lennon, David
A structural and spectroscopic investigation of the hydrochlorination of 4-benzylaniline: the interaction of anhydrous hydrogen chloride with chlorobenzene
Physical Chemistry Chemical Physics, 2009, 11, 288-297
7200206 CIFC13 H14 Cl NP 1 21/n 15.5504; 22.093; 9.7906
90; 106.436; 90		1151.51Gibson, Emma K.; Winfield, John M.; Muir, Kenneth W.; Carr, Robert H.; Eaglesham, Archie; Gavezzotti, Angelo; Parker, Stewart F.; Lennon, David
A structural and spectroscopic investigation of the hydrochlorination of 4-benzylaniline: the interaction of anhydrous hydrogen chloride with chlorobenzene
Physical Chemistry Chemical Physics, 2009, 11, 288-297
7200451 CIFC18 H16 OP 1 21 116.312; 7.247; 16.383
90; 90.243; 90		1936.7Aliev, Abil E.; Moïse, Joëlle; Motherwell, William B.; Nič, Miloslav; Courtier-Murias, Denis; Tocher, Derek A.
Probing weak non-covalent interactions in solution and solid states with designed molecules
Physical Chemistry Chemical Physics, 2009, 11, 97-100
7200452 CIFC18 H16 N2P 1 21/c 113.8169; 11.8799; 8.5789
90; 100.271; 90		1385.6Aliev, Abil E.; Moïse, Joëlle; Motherwell, William B.; Nič, Miloslav; Courtier-Murias, Denis; Tocher, Derek A.
Probing weak non-covalent interactions in solution and solid states with designed molecules
Physical Chemistry Chemical Physics, 2009, 11, 97-100
7200569 CIFC14 H10 Cl2 N4 O4P 1 21/c 13.73872; 20.1285; 9.6317
90; 98.9799; 90		715.95Seliger, Janez; Žagar, Veselko; Gotoh, Kazuma; Ishida, Hiroyuki; Konnai, Akiko; Amino, Daiki; Asaji, Tetsuo
Hydrogen bonding in 1,2-diazine‒chloranilic acid (2 : 1) studied by a 14N nuclear quadrupole coupling tensor and multi-temperature X-ray diffraction
Physical Chemistry Chemical Physics, 2009, 11, 2281-2286
7200570 CIFC14 H10 Cl2 N4 O4P 1 21/c 13.75092; 20.1711; 9.6437
90; 99.1239; 90		720.41Seliger, Janez; Žagar, Veselko; Gotoh, Kazuma; Ishida, Hiroyuki; Konnai, Akiko; Amino, Daiki; Asaji, Tetsuo
Hydrogen bonding in 1,2-diazine‒chloranilic acid (2 : 1) studied by a 14N nuclear quadrupole coupling tensor and multi-temperature X-ray diffraction
Physical Chemistry Chemical Physics, 2009, 11, 2281-2286
7200571 CIFC14 H10 Cl2 N4 O4P 1 21/c 13.7572; 20.1855; 9.6392
90; 99.189; 90		721.66Seliger, Janez; Žagar, Veselko; Gotoh, Kazuma; Ishida, Hiroyuki; Konnai, Akiko; Amino, Daiki; Asaji, Tetsuo
Hydrogen bonding in 1,2-diazine‒chloranilic acid (2 : 1) studied by a 14N nuclear quadrupole coupling tensor and multi-temperature X-ray diffraction
Physical Chemistry Chemical Physics, 2009, 11, 2281-2286
7200572 CIFC14 H10 Cl2 N4 O4P 1 21/c 13.76378; 20.2105; 9.6548
90; 99.2919; 90		724.78Seliger, Janez; Žagar, Veselko; Gotoh, Kazuma; Ishida, Hiroyuki; Konnai, Akiko; Amino, Daiki; Asaji, Tetsuo
Hydrogen bonding in 1,2-diazine‒chloranilic acid (2 : 1) studied by a 14N nuclear quadrupole coupling tensor and multi-temperature X-ray diffraction
Physical Chemistry Chemical Physics, 2009, 11, 2281-2286
7200573 CIFC14 H10 Cl2 N4 O4P 1 21/c 13.7657; 20.2197; 9.6515
90; 99.334; 90		725.15Seliger, Janez; Žagar, Veselko; Gotoh, Kazuma; Ishida, Hiroyuki; Konnai, Akiko; Amino, Daiki; Asaji, Tetsuo
Hydrogen bonding in 1,2-diazine‒chloranilic acid (2 : 1) studied by a 14N nuclear quadrupole coupling tensor and multi-temperature X-ray diffraction
Physical Chemistry Chemical Physics, 2009, 11, 2281-2286
7200574 CIFC14 H10 Cl2 N4 O4P 1 21/c 13.7825; 20.2466; 9.6556
90; 99.515; 90		729.28Seliger, Janez; Žagar, Veselko; Gotoh, Kazuma; Ishida, Hiroyuki; Konnai, Akiko; Amino, Daiki; Asaji, Tetsuo
Hydrogen bonding in 1,2-diazine‒chloranilic acid (2 : 1) studied by a 14N nuclear quadrupole coupling tensor and multi-temperature X-ray diffraction
Physical Chemistry Chemical Physics, 2009, 11, 2281-2286
7200622 CIFC5 H12 Cl N O2P b c a8.553; 8.713; 22.141
90; 90; 90		1650Dittrich, Birger; Warren, John E.; Fabbiani, Francesca P. A.; Morgenroth, Wolfgang; Corry, Ben
Temperature dependence of rotational disorder in a non-standard amino acid from X-ray crystallography and molecular dynamics simulation
Physical Chemistry Chemical Physics, 2009, 11, 2601-2609
7200623 CIFC5 H12 Cl N O2P b c a8.5862; 8.7421; 22.2501
90; 90; 90		1670.12Dittrich, Birger; Warren, John E.; Fabbiani, Francesca P. A.; Morgenroth, Wolfgang; Corry, Ben
Temperature dependence of rotational disorder in a non-standard amino acid from X-ray crystallography and molecular dynamics simulation
Physical Chemistry Chemical Physics, 2009, 11, 2601-2609
7200624 CIFC5 H12 Cl N O2P b c a8.5889; 8.7603; 22.2425
90; 90; 90		1673.56Dittrich, Birger; Warren, John E.; Fabbiani, Francesca P. A.; Morgenroth, Wolfgang; Corry, Ben
Temperature dependence of rotational disorder in a non-standard amino acid from X-ray crystallography and molecular dynamics simulation
Physical Chemistry Chemical Physics, 2009, 11, 2601-2609
7200625 CIFC5 H12 Cl N O2P b c a8.5921; 8.7611; 22.2484
90; 90; 90		1674.78Dittrich, Birger; Warren, John E.; Fabbiani, Francesca P. A.; Morgenroth, Wolfgang; Corry, Ben
Temperature dependence of rotational disorder in a non-standard amino acid from X-ray crystallography and molecular dynamics simulation
Physical Chemistry Chemical Physics, 2009, 11, 2601-2609
7200626 CIFC5 H12 Cl N O2P b c a8.6018; 8.7828; 22.2584
90; 90; 90		1681.58Dittrich, Birger; Warren, John E.; Fabbiani, Francesca P. A.; Morgenroth, Wolfgang; Corry, Ben
Temperature dependence of rotational disorder in a non-standard amino acid from X-ray crystallography and molecular dynamics simulation
Physical Chemistry Chemical Physics, 2009, 11, 2601-2609
7200713 CIFC27 H33 O13 Zr2P -111.1545; 11.845; 12.0487
76.062; 85.173; 85.04		1536Walther, Philip; Puchberger, Michael; Kogler, F. Rene; Schwarz, Karlheinz; Schubert, Ulrich
Ligand dynamics on the surface of zirconium oxo clusters
Physical Chemistry Chemical Physics, 2009, 11, 3640-3647
7200803 CIFC5.275 H5.475 Ga0.5 N0.425 O2.925I 1 2/a 16.712; 11.2486; 17.965
90; 91.975; 90		1355.6Chaplais, Gérald; Simon-Masseron, Angélique; Porcher, Florence; Lecomte, Claude; Bazer-Bachi, Delphine; Bats, Nicolas; Patarin, Joël
IM-19: a new flexible microporous gallium based-MOF framework with pressure- and temperature-dependent openings
Physical Chemistry Chemical Physics, 2009, 11, 5241-5245
7200804 CIFC7 H4.75 Ga0.5 O4P n m a17.437; 6.7475; 12.1541
90; 90; 90		1430Chaplais, Gérald; Simon-Masseron, Angélique; Porcher, Florence; Lecomte, Claude; Bazer-Bachi, Delphine; Bats, Nicolas; Patarin, Joël
IM-19: a new flexible microporous gallium based-MOF framework with pressure- and temperature-dependent openings
Physical Chemistry Chemical Physics, 2009, 11, 5241-5245
7200806 CIFC22 H18 F3 O3 S17P -18.7924; 11.6205; 17.1222
77.617; 87.597; 77.705		1669.51Olejniczak, Iwona; Barszcz, Bolesław; Szutarska, Anna; Graja, Andrzej; Wojciechowski, Roman; Schlueter, John A.; Hata, Aaron N.; Ward, Brian H.
IR and Raman spectra of β″-(BEDT-TTF)2RCH2SO3 (R = SF5, CF3): dimerization related to hydrogen bonding
Physical Chemistry Chemical Physics, 2009, 11, 3910-3920
7200807 CIFC22 H18 F3 O3 S17P -18.889; 11.7375; 17.219
77.299; 86.942; 77.239		1709.27Olejniczak, Iwona; Barszcz, Bolesław; Szutarska, Anna; Graja, Andrzej; Wojciechowski, Roman; Schlueter, John A.; Hata, Aaron N.; Ward, Brian H.
IR and Raman spectra of β″-(BEDT-TTF)2RCH2SO3 (R = SF5, CF3): dimerization related to hydrogen bonding
Physical Chemistry Chemical Physics, 2009, 11, 3910-3920
7200970 CIFC11 H23 B F4 SP b c a13.559; 11.37; 19.264
90; 90; 90		2970Destro, Riccardo; Ortoleva, Emanuele; Soave, Raffaella; Loconte, Laura; Lo Presti, Leonardo
Detection and kinetics of the single-crystal to single-crystal complete transformation of a thiiranium ion into thietanium ion
Physical Chemistry Chemical Physics, 2009, 11, 7181-7188
7200971 CIFC11 H23 B F4 SP b c a13.626; 11.655; 18.899
90; 90; 90		3001.4Destro, Riccardo; Ortoleva, Emanuele; Soave, Raffaella; Loconte, Laura; Lo Presti, Leonardo
Detection and kinetics of the single-crystal to single-crystal complete transformation of a thiiranium ion into thietanium ion
Physical Chemistry Chemical Physics, 2009, 11, 7181-7188
7200972 CIFC11 H23 B F4 SP b c a13.563; 11.474; 19.182
90; 90; 90		2985.1Destro, Riccardo; Ortoleva, Emanuele; Soave, Raffaella; Loconte, Laura; Lo Presti, Leonardo
Detection and kinetics of the single-crystal to single-crystal complete transformation of a thiiranium ion into thietanium ion
Physical Chemistry Chemical Physics, 2009, 11, 7181-7188
7200973 CIFC11 H23 B F4 SP b c a13.55; 11.403; 19.242
90; 90; 90		2973Destro, Riccardo; Ortoleva, Emanuele; Soave, Raffaella; Loconte, Laura; Lo Presti, Leonardo
Detection and kinetics of the single-crystal to single-crystal complete transformation of a thiiranium ion into thietanium ion
Physical Chemistry Chemical Physics, 2009, 11, 7181-7188
7200974 CIFC11 H23 B F4 SP b c a13.704; 11.701; 18.657
90; 90; 90		2992Destro, Riccardo; Ortoleva, Emanuele; Soave, Raffaella; Loconte, Laura; Lo Presti, Leonardo
Detection and kinetics of the single-crystal to single-crystal complete transformation of a thiiranium ion into thietanium ion
Physical Chemistry Chemical Physics, 2009, 11, 7181-7188
7200975 CIFC11 H23 B F4 SP b c a13.561; 11.5; 19.157
90; 90; 90		2988Destro, Riccardo; Ortoleva, Emanuele; Soave, Raffaella; Loconte, Laura; Lo Presti, Leonardo
Detection and kinetics of the single-crystal to single-crystal complete transformation of a thiiranium ion into thietanium ion
Physical Chemistry Chemical Physics, 2009, 11, 7181-7188
7200976 CIFC11 H23 B F4 SP b c a13.547; 11.406; 19.256
90; 90; 90		2975.4Destro, Riccardo; Ortoleva, Emanuele; Soave, Raffaella; Loconte, Laura; Lo Presti, Leonardo
Detection and kinetics of the single-crystal to single-crystal complete transformation of a thiiranium ion into thietanium ion
Physical Chemistry Chemical Physics, 2009, 11, 7181-7188
7200977 CIFC11 H23 B F4 SP b c a13.552; 11.396; 19.273
90; 90; 90		2976Destro, Riccardo; Ortoleva, Emanuele; Soave, Raffaella; Loconte, Laura; Lo Presti, Leonardo
Detection and kinetics of the single-crystal to single-crystal complete transformation of a thiiranium ion into thietanium ion
Physical Chemistry Chemical Physics, 2009, 11, 7181-7188
7201054 CIFC16 H18 Cu F12 N2 O4F d d 217.7404; 26.0745; 9.83
90; 90; 90		4547.1Bandoli, Giuliano; Barreca, Davide; Gasparotto, Alberto; Seraglia, Roberta; Tondello, Eugenio; Devi, Anjana; Fischer, Roland A.; Winter, Manuela; Fois, Ettore; Gamba, Aldo; Tabacchi, Gloria
An integrated experimental and theoretical investigation on Cu(hfa)2·TMEDA: structure, bonding and reactivity
Physical Chemistry Chemical Physics, 2009, 11, 5998-6007
7201111 CIFC6 H15 N3 O7P 1 21 17.7153; 5.4523; 12.7639
90; 94.607; 90		535.19Hudson, Matthew R.; Allis, Damian G.; Ouellette, Wayne; Hudson, Bruce S.
Inelastic neutron scattering and Raman spectroscopic investigation of l-alanine alaninium nitrate, a homologue of a ferroelectric material
Physical Chemistry Chemical Physics, 2009, 11, 9474-9483
7201172 CIFC28 H40 Cl2 Cu2 N10 O10 S4P -18.2044; 10.5939; 12.6014
111.339; 97.147; 99.073		987.54Balasubramanian, Vimalkumar; Ezhevskaya, Maria; Moons, Hans; Neuburger, Markus; Cristescu, Carol; Van Doorslaer, Sabine; Palivan, Cornelia
Structural characterization of a highly active superoxide-dismutase mimic
Physical Chemistry Chemical Physics, 2009, 11, 6778-6787
7201194 CIFC28 H30 Cu F12 N4 O6P -110.0757; 13.044; 13.736
99.469; 103.364; 105.094		1646.6Fedin, Matvey V.; Veber, Sergey L.; Romanenko, Galina V.; Ovcharenko, Victor I.; Sagdeev, Renad Z.; Klihm, Gudrun; Reijerse, Edward; Lubitz, Wolfgang; Bagryanskaya, Elena G.
Dynamic mixing processes in spin triads of “breathing crystals” Cu(hfac)2LR: a multifrequency EPR study at 34, 122 and 244 GHz
Physical Chemistry Chemical Physics, 2009, 11, 6654-6663
7201195 CIFC28 H30 Cu F12 N4 O6P -110.086; 12.989; 13.689
99.323; 103.599; 104.982		1635.7Fedin, Matvey V.; Veber, Sergey L.; Romanenko, Galina V.; Ovcharenko, Victor I.; Sagdeev, Renad Z.; Klihm, Gudrun; Reijerse, Edward; Lubitz, Wolfgang; Bagryanskaya, Elena G.
Dynamic mixing processes in spin triads of “breathing crystals” Cu(hfac)2LR: a multifrequency EPR study at 34, 122 and 244 GHz
Physical Chemistry Chemical Physics, 2009, 11, 6654-6663
7201196 CIFC28 H30 Cu F12 N4 O6P -110.141; 12.98; 13.738
99.39; 103.585; 104.953		1649.3Fedin, Matvey V.; Veber, Sergey L.; Romanenko, Galina V.; Ovcharenko, Victor I.; Sagdeev, Renad Z.; Klihm, Gudrun; Reijerse, Edward; Lubitz, Wolfgang; Bagryanskaya, Elena G.
Dynamic mixing processes in spin triads of “breathing crystals” Cu(hfac)2LR: a multifrequency EPR study at 34, 122 and 244 GHz
Physical Chemistry Chemical Physics, 2009, 11, 6654-6663
7201197 CIFC28 H30 Cu F12 N4 O6P -110.2433; 13.051; 13.874
99.494; 103.534; 104.78		1693.1Fedin, Matvey V.; Veber, Sergey L.; Romanenko, Galina V.; Ovcharenko, Victor I.; Sagdeev, Renad Z.; Klihm, Gudrun; Reijerse, Edward; Lubitz, Wolfgang; Bagryanskaya, Elena G.
Dynamic mixing processes in spin triads of “breathing crystals” Cu(hfac)2LR: a multifrequency EPR study at 34, 122 and 244 GHz
Physical Chemistry Chemical Physics, 2009, 11, 6654-6663
7201198 CIFC28 H30 Cu F12 N4 O6P -110.276; 12.984; 13.88
99.1; 104.02; 104.2		1694.6Fedin, Matvey V.; Veber, Sergey L.; Romanenko, Galina V.; Ovcharenko, Victor I.; Sagdeev, Renad Z.; Klihm, Gudrun; Reijerse, Edward; Lubitz, Wolfgang; Bagryanskaya, Elena G.
Dynamic mixing processes in spin triads of “breathing crystals” Cu(hfac)2LR: a multifrequency EPR study at 34, 122 and 244 GHz
Physical Chemistry Chemical Physics, 2009, 11, 6654-6663
7201199 CIFC28 H30 Cu F12 N4 O6P -110.387; 13.198; 14.134
100.262; 103.434; 103.705		1774.3Fedin, Matvey V.; Veber, Sergey L.; Romanenko, Galina V.; Ovcharenko, Victor I.; Sagdeev, Renad Z.; Klihm, Gudrun; Reijerse, Edward; Lubitz, Wolfgang; Bagryanskaya, Elena G.
Dynamic mixing processes in spin triads of “breathing crystals” Cu(hfac)2LR: a multifrequency EPR study at 34, 122 and 244 GHz
Physical Chemistry Chemical Physics, 2009, 11, 6654-6663
7201300 CIFC8 H16 Au2 N8 ZnC 1 2/m 110.516; 13.2522; 6.4403
90; 119.508; 90		781.1Aguiar, Pedro M.; Katz, Michael J.; Leznoff, Daniel B.; Kroeker, Scott
Natural abundance 13C and 15N solid-state NMR analysis of paramagnetic transition-metal cyanide coordination polymers
Physical Chemistry Chemical Physics, 2009, 11, 6925-6934
7201928 CIFC28 H23 FC 1 2/c 110.1807; 12.6858; 17.0404
90; 106.996; 90		2104.7Cozzi, Franco; Annunziata, Rita; Benaglia, Maurizio; Baldridge, Kim K.; Aguirre, Gerardo; Estrada, Jesús; Sritana-Anant, Yongsak; Siegel, Jay S.
Through-space interactions between parallel-offset arenes at the van der Waals distance: 1,8-diarylbiphenylene syntheses, structure and QM computations
Physical Chemistry Chemical Physics, 2008, 10, 2686-2694
7201929 CIFC28 H24P 1 21/n 18.27; 18.901; 13.723
90; 103.554; 90		2085.3Cozzi, Franco; Annunziata, Rita; Benaglia, Maurizio; Baldridge, Kim K.; Aguirre, Gerardo; Estrada, Jesús; Sritana-Anant, Yongsak; Siegel, Jay S.
Through-space interactions between parallel-offset arenes at the van der Waals distance: 1,8-diarylbiphenylene syntheses, structure and QM computations
Physical Chemistry Chemical Physics, 2008, 10, 2686-2694
7201930 CIFC28 H23 ClP b c a8.084; 15.976; 32.417
90; 90; 90		4187Cozzi, Franco; Annunziata, Rita; Benaglia, Maurizio; Baldridge, Kim K.; Aguirre, Gerardo; Estrada, Jesús; Sritana-Anant, Yongsak; Siegel, Jay S.
Through-space interactions between parallel-offset arenes at the van der Waals distance: 1,8-diarylbiphenylene syntheses, structure and QM computations
Physical Chemistry Chemical Physics, 2008, 10, 2686-2694
7201931 CIFC29 H23 NP 1 21/c 18.3064; 32.077; 8.3998
90; 108.092; 90		2127.4Cozzi, Franco; Annunziata, Rita; Benaglia, Maurizio; Baldridge, Kim K.; Aguirre, Gerardo; Estrada, Jesús; Sritana-Anant, Yongsak; Siegel, Jay S.
Through-space interactions between parallel-offset arenes at the van der Waals distance: 1,8-diarylbiphenylene syntheses, structure and QM computations
Physical Chemistry Chemical Physics, 2008, 10, 2686-2694
7201997 CIFC46 H56 O8P 4/n :212.7212; 12.7212; 12.5853
90; 90; 90		2036.67Udachin, Konstantin A.; Moudrakovski, Igor L.; Enright, Gary D.; Ratcliffe, Christopher I.; Ripmeester, John A.
Loading-dependent structures of CO2 in the flexible molecular van der Waals host p-tert-butylcalix[4]arene with 1 : 1 and 2 : 1 guest‒host stoichiometries
Physical Chemistry Chemical Physics, 2008, 10, 4636-4643
7201998 CIFC45 H56 O6P 1 21/n 112.5069; 25.538; 12.5939
90; 90.013; 90		4022.5Udachin, Konstantin A.; Moudrakovski, Igor L.; Enright, Gary D.; Ratcliffe, Christopher I.; Ripmeester, John A.
Loading-dependent structures of CO2 in the flexible molecular van der Waals host p-tert-butylcalix[4]arene with 1 : 1 and 2 : 1 guest‒host stoichiometries
Physical Chemistry Chemical Physics, 2008, 10, 4636-4643
7202061 CIFC115.76 H152.28 N O18.88P 4/n n c :215.5514; 15.5514; 22.5951
90; 90; 90		5464.5Polovyanenko, Dmitriy N.; Bagryanskaya, Elena G.; Schnegg, Alexander; Möbius, Klaus; Coleman, Anthony W.; Ananchenko, Gennady S.; Udachin, Konstantin A.; Ripmeester, John A.
Inclusion of 4-methoxy-2,2,6,6-tetramethylpiperidine-N-oxyl in a calixarene nanocapsule in the solid state
Physical Chemistry Chemical Physics, 2008, 10, 5299-5307
7202076 CIFC31 H41 F6 P4 RhP 1 21/n 113.0859; 17.6276; 14.3952
90; 93.396; 90		3314.8Bernard, Guy M.; Feindel, Kirk W.; Wasylishen, Roderick E.; Cameron, T. Stanley
Solid-state phosphorus-31 NMR spectroscopy of a multiple-spin system: an investigation of a rhodium‒triphosphine complex
Physical Chemistry Chemical Physics, 2008, 10, 5552-5563
7202108 CIFC H9 N9 O4P b c a12.5217; 8.1036; 16.9859
90; 90; 90		1723.57Klapötke, Thomas M.; Stierstorfer, Jörg
Triaminoguanidinium dinitramide—calculations, synthesis and characterization of a promising energetic compound
Physical Chemistry Chemical Physics, 2008, 10, 4340-4346
7202463 CIFC6 H14 N4 S2P -16.6966; 9.2281; 9.6691
68.627; 81.3; 75.717		537.98Wolstenholme, David J.; Weigand, Jan J.; M. Cameron, Elinor; Cameron, T. Stanley
The progression of strong and weak hydrogen bonds in a series of ethylenediammonium dithiocyanate derivatives—a new bonding protocol for macromolecules?
Physical Chemistry Chemical Physics, 2008, 10, 3569-3577
7202464 CIFC4 H10 N4 S2P 1 21/c 17.1297; 7.7609; 16.002
90; 101.346; 90		868.13Wolstenholme, David J.; Weigand, Jan J.; M. Cameron, Elinor; Cameron, T. Stanley
The progression of strong and weak hydrogen bonds in a series of ethylenediammonium dithiocyanate derivatives—a new bonding protocol for macromolecules?
Physical Chemistry Chemical Physics, 2008, 10, 3569-3577
7202465 CIFC10 H22 N4 S2P 1 21/n 19.0787; 7.8491; 10.5697
90; 98.575; 90		744.77Wolstenholme, David J.; Weigand, Jan J.; M. Cameron, Elinor; Cameron, T. Stanley
The progression of strong and weak hydrogen bonds in a series of ethylenediammonium dithiocyanate derivatives—a new bonding protocol for macromolecules?
Physical Chemistry Chemical Physics, 2008, 10, 3569-3577
7203848 CIFC28 H60 Cl3 Gd N8 O20P 4 21 215.501; 15.497; 10.428
89.99; 90.02; 90		2505Umebayashi, Yasuhiro; Matsumoto, Kai; Mekata, Isamu; Ishiguro, Shin-ichi
Solvation structure of lanthanide(iii) ions in solvent mixtures of N,N-dimethylformamide and N,N-dimethylacetamide studied by titration Raman spectroscopy
Physical Chemistry Chemical Physics, 2002, 4, 5599-5605
7203849 CIFC19 H21 I N2 O SP -17.5429; 10.9459; 12.1974
76.36; 78.1; 74.491		931.94Tang, Xin-Jing; Wu, Li-Zhu; Zhang, Li-Ping; Tung, Chen-Ho
Two-photon-pumped frequency-upconverted lasing and optical power limiting properties of vinylbenzothiazole-containing compounds in solution
Physical Chemistry Chemical Physics, 2002, 4, 5744-5747
7203851 CIFC20 H30 Au2 S6 W2P 1 21/a 117.123; 9.373; 18.019
90; 107.43; 90		2759.2Lang, Jian-Ping; Yu, Hong; Ji, Shun-Jun; Sun, Zhen-Rong
Synthesis, crystal structure and third-order nonlinear optical (NLO) properties of a novel tetranuclear organometallic cluster [(?5?C5Me5)WS3Au]2
Physical Chemistry Chemical Physics, 2003, 5, 5127
7203914 CIFC11.56 H26.43 Al7.35 Co1.65 N1.65 O37.05 P9R -3 c :H13.192; 13.192; 46.149
90; 90; 120		6955Barrett, P. A.; Jones, R. H.
Evidence for ordering of cobalt ions in the microporous solid acid catalyst CoDAF-4 by single crystal X-ray diffraction and resonant X-ray powder diffraction
Physical Chemistry Chemical Physics, 2000, 2, 407
7203981 CIFC10 H25 N3 O7 SP 1 21/c 113.503; 8.435; 14.839
90; 112.24; 90		1564.4Ilczyszyn, Maria M.; Wierzejewska, Maria; Ciunik, Zbigniew
Crystal structure and vibrational spectra of bis(betaine) sulfamate
Physical Chemistry Chemical Physics, 2000, 2, 3503
7203982 CIFC10 H25 N3 O7 SP 1 21/c 113.467; 8.353; 14.701
90; 112; 90		1533.3Ilczyszyn, Maria M.; Wierzejewska, Maria; Ciunik, Zbigniew
Crystal structure and vibrational spectra of bis(betaine) sulfamate
Physical Chemistry Chemical Physics, 2000, 2, 3503
7204003 CIFC20 H28 Cl2 N6 Ni O9P b c a15.043; 15.37; 21.872
90; 90; 90		5057Bazzicalupi, Carla; Bencini, Andrea; Bianchi, Antonio; Ciattini, Samuele; Giorgi, Claudia; Paoletti, Piero; Valtancoli, Barbara; Secco, Fernando; Rosaria Tinè, Maria; Venturini, Marcella
Ni(II) and Co(II) complexes with a phenanthroline-containing macrocycle. Thermodynamic, structural and kinetic considerations
Physical Chemistry Chemical Physics, 2000, 2, 4864
7204010 CIFC19 H12 N2 SP -110.437; 12.707; 12.841
91.22; 108.34; 111.03		1491.4Borowicz, Paweł; Herbich, Jerzy; Kapturkiewicz, Andrzej; Anulewicz-Ostrowska, Romana; Nowacki, Jacek; Grampp, Günter
Nature of the lowest triplet states of 4'-substituted N-phenylphenothiazine derivatives
Physical Chemistry Chemical Physics, 2000, 2, 4275
7204892 CIFC60 H42 Cu N6 Ni2 S20P -112.7989; 13.3927; 11.2746
94.064; 96.445; 61.588		1688.74Sakai, Ken-ichi; Akutagawa, Tomoyuki; Hasegawa, Tatsuo; Nakamura, Takayoshi
The d-L(?)-? type of charge-transfer salt [Cu(Me-tri)2][Ni(dmit)2]2: Interaction between copper(ii) d- and Ni(dmit)2 ?-electrons via�?-conjugated macrocyclic ligandsElectronic supplementary information (ESI) available: crystallographic data in cif format. See http://www.rsc.org/suppdata/cp/b2/b212555b/
Physical Chemistry Chemical Physics, 2003, 5, 2469
7204893 CIFC92 H157 N5 O13P -19.773; 17.05; 27.745
78.31; 89.92; 77.1		4408.3Kuzmicz, Rafal; Dobrzycki, Lukasz; Wozniak, Krzysztof; Benevelli, Francesca; Klinowski, Jacek; Kolodziejski, Waclaw
X-ray diffraction and 13C solid-state NMR studies of the solvate of tetra(C-undecyl)calix[4]resorcinarene with dimethylacetamide
Physical Chemistry Chemical Physics, 2002, 4, 2387-2391
7204901 CIFC5 H6 Bi Cl4 NC 1 c 112.717; 12.894; 7.274
90; 118.49; 90		1048.3Jóźków, Jolanta; Medycki, Wojciech; Zaleski, Jacek; Jakubas, Ryszard; Bator, Grażyna; Ciunik, Zbigniew
Structure, phase transition and molecular motions in (C5H5NH)BiCl4
Physical Chemistry Chemical Physics, 2001, 3, 3222
7204902 CIFC80 H91 Cl N Na O14P 1 21/n 119.8693; 13.459; 30.405
90; 108.422; 90		7714.3Danil de Namor, Angela F.; Kowalska, Dorota; Castellano, Eduardo E.; Piro, Oscar E.; Sueros Velarde, Felix J.; Villanueva Salas, Jose
Lower rim calix(4)arene ketone derivatives and their interaction with alkali metal cations. Structural and thermodynamic (solution and complexation) characterisation of the tetraphenyl ketone derivative and its sodium complex
Physical Chemistry Chemical Physics, 2001, 3, 4010
7204903 CIFC76 H80 O8C 1 2/c 129.487; 24.884; 20.322
90; 115.49; 90		13460Danil de Namor, Angela F.; Kowalska, Dorota; Castellano, Eduardo E.; Piro, Oscar E.; Sueros Velarde, Felix J.; Villanueva Salas, Jose
Lower rim calix(4)arene ketone derivatives and their interaction with alkali metal cations. Structural and thermodynamic (solution and complexation) characterisation of the tetraphenyl ketone derivative and its sodium complex
Physical Chemistry Chemical Physics, 2001, 3, 4010
7204905 CIFC14 H10 I2 N2 O7 RuP 1 21/c 16.8645; 19.7584; 13.7107
90; 95.978; 90		1849.49Luukkanen, Saija; Haukka, Matti; Eskelinen, Esa; Pakkanen, Tapani A.; Lehtovuori, Viivi; Kallioinen, Jani; Myllyperkiö, Pasi; Korppi-Tommola, Jouko
Photochemical reactivity of halogen-containing ruthenium‒dcbpy (dcbpy = 4,4'-dicarboxylic acid-2,2'-bipyridine) compounds, trans(Br)-[Ru(dcbpy)(CO)2Br2] and trans(I)-[Ru(dcbpy)(CO)2I2]
Physical Chemistry Chemical Physics, 2001, 3, 1992
7204907 CIFC6 H10 F6 Li N O6 S2P 1 21/n 19.55; 17.179; 9.784
90; 112.75; 90		1480.3Brouillette, Dany; Irish, Donald E.; Taylor, Nicholas J.; Perron, Gérald; Odziemkowski, Marek; Desnoyers, Jacques E.
Stable solvates in solution of lithium bis(trifluoromethylsulfone)imide in glymes and other aprotic solvents: Phase diagrams, crystallography and Raman spectroscopy
Physical Chemistry Chemical Physics, 2002, 4, 6063-6071
7205024 CIFAg5 I2 S3 SbP n n m10.9411; 13.449; 7.714
90; 90; 90		1135.09Nilges, Tom; Reiser, Sara; Hong, Jung Hoon; Gaudin, Etienne; Pfitzner, Arno
Preparation, structural, Raman and impedance spectroscopic characterisation of the silver ion conductor (AgI)2Ag3SbS3
Physical Chemistry Chemical Physics, 2002, 4, 5888-5894
7205025 CIFAg5 I2 S3 SbP n n m10.9674; 13.52; 7.7392
90; 90; 90		1147.56Nilges, Tom; Reiser, Sara; Hong, Jung Hoon; Gaudin, Etienne; Pfitzner, Arno
Preparation, structural, Raman and impedance spectroscopic characterisation of the silver ion conductor (AgI)2Ag3SbS3
Physical Chemistry Chemical Physics, 2002, 4, 5888-5894
7205026 CIFAg5 I2 S3 SbP n n m11.0033; 13.569; 7.746
90; 90; 90		1156.51Nilges, Tom; Reiser, Sara; Hong, Jung Hoon; Gaudin, Etienne; Pfitzner, Arno
Preparation, structural, Raman and impedance spectroscopic characterisation of the silver ion conductor (AgI)2Ag3SbS3
Physical Chemistry Chemical Physics, 2002, 4, 5888-5894
7205027 CIFAg5 I2 S3 SbP n n m11.0243; 13.598; 7.7442
90; 90; 90		1160.92Nilges, Tom; Reiser, Sara; Hong, Jung Hoon; Gaudin, Etienne; Pfitzner, Arno
Preparation, structural, Raman and impedance spectroscopic characterisation of the silver ion conductor (AgI)2Ag3SbS3
Physical Chemistry Chemical Physics, 2002, 4, 5888-5894
7205028 CIFAg5 I2 S3 SbP n n m11.0359; 13.612; 7.7424
90; 90; 90		1163.07Nilges, Tom; Reiser, Sara; Hong, Jung Hoon; Gaudin, Etienne; Pfitzner, Arno
Preparation, structural, Raman and impedance spectroscopic characterisation of the silver ion conductor (AgI)2Ag3SbS3
Physical Chemistry Chemical Physics, 2002, 4, 5888-5894
7205029 CIFAg5 I2 S3 SbP n n m11.0602; 13.656; 7.7527
90; 90; 90		1170.95Nilges, Tom; Reiser, Sara; Hong, Jung Hoon; Gaudin, Etienne; Pfitzner, Arno
Preparation, structural, Raman and impedance spectroscopic characterisation of the silver ion conductor (AgI)2Ag3SbS3
Physical Chemistry Chemical Physics, 2002, 4, 5888-5894
7205030 CIFAg5 I2 S3 SbP n n m11.071; 13.699; 7.7633
90; 90; 90		1177.39Nilges, Tom; Reiser, Sara; Hong, Jung Hoon; Gaudin, Etienne; Pfitzner, Arno
Preparation, structural, Raman and impedance spectroscopic characterisation of the silver ion conductor (AgI)2Ag3SbS3
Physical Chemistry Chemical Physics, 2002, 4, 5888-5894
7207891 CIFC119 H104 N22 O12 Yb2P -112.755; 13.8809; 16.4661
104.344; 104.593; 99.8816		2646.82Sanguineti, Alessandro; Monguzzi, Angelo; Vaccaro, Gianfranco; Meinardi, Franco; Ronchi, Elisabetta; Moret, Massimo; Cosentino, Ugo; Moro, Giorgio; Simonutti, Roberto; Mauri, Michele; Tubino, Riccardo; Beverina, Luca
NIR emitting ytterbium chelates for colourless luminescent solar concentrators
Physical Chemistry Chemical Physics, 2012, 14, 6452-6455
7207892 CIFC42 H32 N11 O6 YbP -110.102; 12.5751; 16.8441
71.39; 75.122; 79.674		1948.81Sanguineti, Alessandro; Monguzzi, Angelo; Vaccaro, Gianfranco; Meinardi, Franco; Ronchi, Elisabetta; Moret, Massimo; Cosentino, Ugo; Moro, Giorgio; Simonutti, Roberto; Mauri, Michele; Tubino, Riccardo; Beverina, Luca
NIR emitting ytterbium chelates for colourless luminescent solar concentrators
Physical Chemistry Chemical Physics, 2012, 14, 6452-6455
7208023 CIFC19 H18 OP 1 21/n 17.5369; 10.941; 16.6813
90; 102.521; 90		1342.8Brogaard, Rasmus Y.; Schalk, Oliver; Boguslavskiy, Andrey E.; Enright, Gary D.; Hopf, Henning; Raev, Vitaly; Tarcoveanu, Eliza; Sølling, Theis I.; Stolow, Albert
The Paternò‒Büchi reaction: importance of triplet states in the excited-state reaction pathway
Physical Chemistry Chemical Physics, 2012, 14, 8572
7213049 CIFC26 H25 Cu3 Mo N6 O S4P 1 21/c 118.856; 13.736; 12.722
90; 90.156; 90		3295.1Hou, Hongwei; Ghee Ang, How; Gek Ang, Siau; Fan, Yaoting; Low, Michael K. M.; Ji, Wei; Wang Lee, Yiew
Synthesis, crystal structure and large third-order nonlinear optical properties of two novel nest-shaped clusters [MOS3Cu3(SCN)(Py)5] (M=Mo, W)
Physical Chemistry Chemical Physics, 1999, 1, 3145
7213065 CIFC19 H17 N3 O5P -112.812; 9.449; 8.199
111.55; 74.84; 111.21		851.1Hobley, Jonathan; Malatesta, Vincenzo; Millini, Roberto; Montanari, Luciano; O Neil Parker, Jr, Wallace
Proton exchange and isomerisation reactions of photochromic and reverse photochromic spiro-pyrans and their merocyanine forms
Physical Chemistry Chemical Physics, 1999, 1, 3259
7217109 CIFC3 H5 N3P c c n10.468; 13.484; 5.7549
90; 90; 90		812.3Antonio Jime´nez, Jose´; María Claramunt, Rosa; Mó, Otilia; Yáñez, Manuel; Wehrmann, Frank; Buntkowsky, Gerd; Limbach, Hans-Heinrich; Goddard, Richard; Elguero, Jose´
The structure of N-aminopyrazole in the solid state and in solution: an experimental and computational study
Physical Chemistry Chemical Physics, 1999, 1, 5113
7217110 CIFC70 H79 Cl N5 Na O8P 4 c c21.791; 21.791; 26.958
90; 90; 90		12801Danil de Namor, Angela F.; Castellano, Eduardo E.; Pulcha Salazar, Lupe E.; Piro, Oscar E.; Jafou, Olga
Thermodynamics of cation (alkali-metal) complexation by 5,11,17,23-tetra-tert-butyl[25,26,27,28-tetrakis(2-pyridylmethyl)oxy]- calix(4)arene and the crystal structure‒superstructure of its 1:1 complex with sodium and acetonitrile
Physical Chemistry Chemical Physics, 1999, 1, 285
7217111 CIFC8 H16 N2 O4P 1 21/c 18.0254; 7.4851; 17.7967
90; 90.98; 90		1068.9Lunelli, Bruno; Soave, Raffaella; Destro, Riccardo
Structure and stability of bis(dimethylamino)squaraine and its hydrates: A study using XRD, IR spectroscopy, and thermodynamic measurements
Physical Chemistry Chemical Physics, 1999, 1, 1469
7217112 CIFC4 H10 N O3P b c n21.6397; 8.3029; 7.1004
90; 90; 90		1275.7Lunelli, Bruno; Soave, Raffaella; Destro, Riccardo
Structure and stability of bis(dimethylamino)squaraine and its hydrates: A study using XRD, IR spectroscopy, and thermodynamic measurements
Physical Chemistry Chemical Physics, 1999, 1, 1469
7217113 CIFC50 H61 F O4P 4/n :212.8581; 12.8581; 13.2833
90; 90; 90		2196.14Brouwer, Eric B.; Gougeon, Regis D. M.; Hirschinger, Je´rôme; Udachin, Kostantin A.; Harris, Robin K.; Ripmeester, John A.
Intermolecular distance measurements in supramolecular solids: 13C‒19F REDOR NMR spectroscopy of p-tert-butylcalix[4]arene‒fluorobenzene
Physical Chemistry Chemical Physics, 1999, 1, 4043
7221277 CIFCa10 H2 O26 V6P 63/m9.7405; 9.7405; 7.004
90; 90; 120		575.492Bauer Boechat, C.; Eon, J.G.; da Silva San Gil, R.A.; Malta Rossi, A.; de Castro Perez, C.A.
Structure of vanadate in calcium phosphate and vanadate apatite solid solutions
Physical Chemistry Chemical Physics, 2000, 2, 4225-4230
7221305 CIFC Cl N O2 S2P c a 2113.89; 7.286; 5.172
90; 90; 90		523.42Romano, R.M.; Della Vedova, C.O.; Boese, R.; Hildebrandt, P.
Structural and spectroscopic characterization of Cl C (O) S N S O. A theoretical and experimental study
Physical Chemistry Chemical Physics, 1999, 1, 2551-2557
7221623 CIF
HKL		Al6 Ca4 F2 O12R -3 :H17.323748; 17.323748; 7.000171
90; 90; 120		1819.38Zhiguo, Xia; Molokeev, Maxim; Oreshonkov, Alexander; Atuchin, Victor; Ru-Shi, Liu; Cheng, Dong
Crystal and local structure refinement in Ca2Al3O6F explored by X-ray diffraction and Raman spectroscopy
Physical Chemistry Chemical Physics, 2014, 16, 5952
7222335 CIFC12.864 Al54.0096 Cl36.864 F12.864 Na47.808 O384 Si137.99F d -3 m :224.76; 24.76; 24.76
90; 90; 90		15179.3Mellot-Draznieks, C.; Rodriguez-Carvajal, J.; Cox, D.E.; Cheetham, A.K.
Adsorption of chlorofluorocarbons in nanoporous solids: a combined powder neutron diffraction and computational study of C F Cl3 in NaY zeolite
Physical Chemistry Chemical Physics, 2003, 5, 1882-1887
7222416 CIFMo0.12 O5 V1.88P m m n :211.5439; 3.5714; 4.3362
90; 90; 90		178.772Haas, F.; Fuess, H.; Adams, A.H.; Schimanke, G.; Martin, M.; Buhrmester, T.
X-ray absorption and X-ray diffraction studies on molybdenum doped vanadium pentoxide
Physical Chemistry Chemical Physics, 2003, 5, 4317-4324
7222419 CIFNa3 O4 PF m -3 m7.5438; 7.5438; 7.5438
90; 90; 90		429.309Harrison, R.J.; Putnis, A.; Kockelmann, W.
Phase transition behaviour and equilibrium phase relations in the fast-ion conductor system (Na3 P O4) - (Na2 S O4)
Physical Chemistry Chemical Physics, 2002, 4, 3252-3259
7223849 CIFC10 H20 Cl NP 21 21 218.1634; 8.9539; 14.4292
90; 90; 90		1054.69Clough, Matthew T.; Geyer, Karolin; Hunt, Patricia A.; McIntosh, Alastair J. S.; Rowe, Rebecca; Welton, Tom; White, Andrew J. P.
Azoniaspiro salts: towards bridging the gap between room-temperature ionic liquids and molten salts
Phys. Chem. Chem. Phys., 2016
7223850 CIFC8 H18 Cl N OP b c a12.5408; 11.0072; 14.1345
90; 90; 90		1951.11Clough, Matthew T.; Geyer, Karolin; Hunt, Patricia A.; McIntosh, Alastair J. S.; Rowe, Rebecca; Welton, Tom; White, Andrew J. P.
Azoniaspiro salts: towards bridging the gap between room-temperature ionic liquids and molten salts
Phys. Chem. Chem. Phys., 2016
7225871 CIFC5 H9 Cl4 Fe N2P 21 21 219.1242; 13.8132; 9.0359
90; 90; 90		1138.83de Pedro, Imanol; Fabelo, Oscar; Garcia Saiz, Abel; Vallcorba, Oriol; Junquera, Javier; Blanco, Jesus A.; Waerenborgh, João C.; Andreica, Daniel; Wildes, Andrew; Fernandez-Diaz, Maria Teresa; Rogriguez, Jesus
Dynamically Slow Solid-to-Solid Phase Transition Induced by Thermal Treatment on DimimFeCl4 Magnetic Ionic Liquid
Phys. Chem. Chem. Phys., 2016
7225872 CIFC5 H9 Cl4 Fe N2P 1 21/c 114.1391; 13.7039; 13.2935
90; 115.539; 90		2324.09de Pedro, Imanol; Fabelo, Oscar; Garcia Saiz, Abel; Vallcorba, Oriol; Junquera, Javier; Blanco, Jesus A.; Waerenborgh, João C.; Andreica, Daniel; Wildes, Andrew; Fernandez-Diaz, Maria Teresa; Rogriguez, Jesus
Dynamically Slow Solid-to-Solid Phase Transition Induced by Thermal Treatment on DimimFeCl4 Magnetic Ionic Liquid
Phys. Chem. Chem. Phys., 2016
7225873 CIFC5 H9 Cl4 Fe N2P 1 21 16.5434; 14.0286; 6.5314
90; 89.921; 90		599.55de Pedro, Imanol; Fabelo, Oscar; Garcia Saiz, Abel; Vallcorba, Oriol; Junquera, Javier; Blanco, Jesus A.; Waerenborgh, João C.; Andreica, Daniel; Wildes, Andrew; Fernandez-Diaz, Maria Teresa; Rogriguez, Jesus
Dynamically Slow Solid-to-Solid Phase Transition Induced by Thermal Treatment on DimimFeCl4 Magnetic Ionic Liquid
Phys. Chem. Chem. Phys., 2016
7226004 CIFC84 H122 N4 O17 S Si2 ZnP -111.4105; 17.6824; 22.7971
79.762; 89.224; 74.592		4361Alam, Md. M.; Bolze, F.; Daniel, C.; Flamigni, L.; Gourlaouen, C.; Heitz, V.; Jenni, S.; Schmitt, J.; Sour, A.; Ventura, B.
π-Extended diketopyrrolopyrrole‒porphyrin arrays: one- and two-photon photophysical investigations and theoretical studies
Phys. Chem. Chem. Phys., 2016
7226121 CIF
HKL		Bi2 CaC m c m4.697; 17.069; 4.6127
90; 90; 90		369.81Winiarski, M.J.; Wiendlocha, B.; Golab, S.; Kushwaha, S.K.; Wisniewski, P.; Kaczorowski, D.; Thompson, J.D.; Cava, R.J.; Klimczuk, T.
Superconductivity in CaBi2
Physical Chemistry Chemical Physics, 2016, 18, 21737-21745
7228030 CIFC25 H22 N2P -18.1532; 10.2921; 12.9838
66.763; 88.564; 73.285		953.98Fu, Hongyu; Xu, Ning; Pan, Yi-Ming; Lu, Xiao-Lin; Xia, Min
Emission behaviours of novel V- and X-shaped fluorophores in response to pH and force stimuli
Phys. Chem. Chem. Phys., 2017
7228034 CIFC26 H29 I N2 O2C 1 2/c 119.3336; 23.1519; 14.0857
90; 130.241; 90		4812.7Thapaliya, Ek Raj; Garcia-Amorós, Jaume; Nonell, Santi; Captain, Burjor; Raymo, Francisco M.
Structural Implications on the Excitation Dynamics of Fluorescent 3H-Indolium Cations
Phys. Chem. Chem. Phys., 2017
7228035 CIFC27 H31 Cl2 F6 N2 O2 PP 1 21/c 18.4113; 15.752; 21.6939
90; 95.3864; 90		2861.6Thapaliya, Ek Raj; Garcia-Amorós, Jaume; Nonell, Santi; Captain, Burjor; Raymo, Francisco M.
Structural Implications on the Excitation Dynamics of Fluorescent 3H-Indolium Cations
Phys. Chem. Chem. Phys., 2017
7228097 CIFC10 H22 Cr K N2 O12R -3 :H8.5676; 8.5676; 23.7293
90; 90; 120		1508.46Ptak, Maciej; Gągor, Anna; Sieradzki, Adam; Bondzior, Bartosz; Dereń, Przemysław Jacek; Ciupa, Aneta; Trzebiatowska, Monika; Maczka, Miroslaw
Effect of K+ cations on phase transitions, structural, dielectric and luminescent properties of [cat][K0.5Cr0.5(HCOO)3], where cat is protonated dimethylamine or ethylamine
Phys. Chem. Chem. Phys., 2017
7228098 CIFC5 H11 Cr0.5 K0.5 N O6P -18.559; 8.602; 9.156
63.07; 63.19; 61.08		502.3Ptak, Maciej; Gągor, Anna; Sieradzki, Adam; Bondzior, Bartosz; Dereń, Przemysław Jacek; Ciupa, Aneta; Trzebiatowska, Monika; Maczka, Miroslaw
Effect of K+ cations on phase transitions, structural, dielectric and luminescent properties of [cat][K0.5Cr0.5(HCOO)3], where cat is protonated dimethylamine or ethylamine
Phys. Chem. Chem. Phys., 2017
7228099 CIFC10 H22 Cr K N2 O12P 1 21/n 18.0147; 9.8547; 12.3886
90; 90.052; 90		978.48Ptak, Maciej; Gągor, Anna; Sieradzki, Adam; Bondzior, Bartosz; Dereń, Przemysław Jacek; Ciupa, Aneta; Trzebiatowska, Monika; Maczka, Miroslaw
Effect of K+ cations on phase transitions, structural, dielectric and luminescent properties of [cat][K0.5Cr0.5(HCOO)3], where cat is protonated dimethylamine or ethylamine
Phys. Chem. Chem. Phys., 2017
7228159 CIFC14 H8 N2 S3P c a b9.969; 12.775; 20.278
90; 90; 90		2582.5Iagatti, Alessandro; Patrizi, Barbara; Basagni, Andrea; Marcelli, Agnese; Alessi, Andrea; Zanardi, Stefano; Fusco, Roberto; Salvalaggio, Mario; Bussotti, Laura; FOGGI, Paolo
Photophysical properties and excited state dynamics of 4,7-dithien-2-yl-2,1,3-benzothiadiazole
Phys. Chem. Chem. Phys., 2017
7228165 CIFC23 H28 B10P -110.2378; 10.7582; 11.6502
90.007; 102.099; 110.257		1173.35Wang, Zhaojin; Wang, Tianyu; Zhang, Chi; Humphrey, Mark G.
Efficient crystallization-induced emission in fluorenyl-tethered carboranes
Phys. Chem. Chem. Phys., 2017
7228166 CIFC27 H28 B10I 41/a :229.1255; 29.1255; 14.6448
90; 90; 90		12423.1Wang, Zhaojin; Wang, Tianyu; Zhang, Chi; Humphrey, Mark G.
Efficient crystallization-induced emission in fluorenyl-tethered carboranes
Phys. Chem. Chem. Phys., 2017
7228167 CIFC32 H36 B10P -110.7377; 15.4048; 18.3711
90.481; 97.83; 91.483		3009.2Wang, Zhaojin; Wang, Tianyu; Zhang, Chi; Humphrey, Mark G.
Efficient crystallization-induced emission in fluorenyl-tethered carboranes
Phys. Chem. Chem. Phys., 2017
7228295 CIFC18 H26 Cl4 Fe GaP -19.0583; 15.893; 16.379
70.496; 89.297; 86.103		2217.4Mochida, Tomoyuki; Ishida, Mai; Tominaga, Takumi; Takahashi, Kazuyuki; Sakurai, Takahiro; Ohta, Hitoshi
Paramagnetic ionic plastic crystals containing the octamethylferrocenium cation: counteranion dependence of phase transitions and crystal structures
Phys. Chem. Chem. Phys., 2017
7228296 CIFC22 H26 Fe N3P b c a12.203; 11.584; 28.223
90; 90; 90		3989.6Mochida, Tomoyuki; Ishida, Mai; Tominaga, Takumi; Takahashi, Kazuyuki; Sakurai, Takahiro; Ohta, Hitoshi
Paramagnetic ionic plastic crystals containing the octamethylferrocenium cation: counteranion dependence of phase transitions and crystal structures
Phys. Chem. Chem. Phys., 2017
7228297 CIFC21 H26 F6 Fe N O4 S2P 1 21/n 18.9842; 14.8711; 19.182
90; 102.447; 90		2502.57Mochida, Tomoyuki; Ishida, Mai; Tominaga, Takumi; Takahashi, Kazuyuki; Sakurai, Takahiro; Ohta, Hitoshi
Paramagnetic ionic plastic crystals containing the octamethylferrocenium cation: counteranion dependence of phase transitions and crystal structures
Phys. Chem. Chem. Phys., 2017
7228298 CIFC21 H26 F6 Fe N O4 S2P 1 21/n 18.917; 14.441; 19.074
90; 102.995; 90		2393.3Mochida, Tomoyuki; Ishida, Mai; Tominaga, Takumi; Takahashi, Kazuyuki; Sakurai, Takahiro; Ohta, Hitoshi
Paramagnetic ionic plastic crystals containing the octamethylferrocenium cation: counteranion dependence of phase transitions and crystal structures
Phys. Chem. Chem. Phys., 2017
7228299 CIFC18 H26 Cl4 Fe2P -19.064; 15.866; 16.381
70.651; 89.289; 86.092		2217Mochida, Tomoyuki; Ishida, Mai; Tominaga, Takumi; Takahashi, Kazuyuki; Sakurai, Takahiro; Ohta, Hitoshi
Paramagnetic ionic plastic crystals containing the octamethylferrocenium cation: counteranion dependence of phase transitions and crystal structures
Phys. Chem. Chem. Phys., 2017
7228300 CIFC22 H26 B Fe N4I 41/a c d19.357; 19.357; 23.627
90; 90; 90		8852.9Mochida, Tomoyuki; Ishida, Mai; Tominaga, Takumi; Takahashi, Kazuyuki; Sakurai, Takahiro; Ohta, Hitoshi
Paramagnetic ionic plastic crystals containing the octamethylferrocenium cation: counteranion dependence of phase transitions and crystal structures
Phys. Chem. Chem. Phys., 2017
7228301 CIFC20 H26 Fe N3P 1 21/c 116.36; 7.436; 16.53
90; 114.611; 90		1828Mochida, Tomoyuki; Ishida, Mai; Tominaga, Takumi; Takahashi, Kazuyuki; Sakurai, Takahiro; Ohta, Hitoshi
Paramagnetic ionic plastic crystals containing the octamethylferrocenium cation: counteranion dependence of phase transitions and crystal structures
Phys. Chem. Chem. Phys., 2017
7228302 CIFC18 H26 F2 Fe N O4 S2P c a 2119.713; 12.146; 17.155
90; 90; 90		4107.5Mochida, Tomoyuki; Ishida, Mai; Tominaga, Takumi; Takahashi, Kazuyuki; Sakurai, Takahiro; Ohta, Hitoshi
Paramagnetic ionic plastic crystals containing the octamethylferrocenium cation: counteranion dependence of phase transitions and crystal structures
Phys. Chem. Chem. Phys., 2017
7228303 CIFC20 H26 Fe N3P 1 n 17.3025; 13.588; 9.39
90; 100.099; 90		917.3Mochida, Tomoyuki; Ishida, Mai; Tominaga, Takumi; Takahashi, Kazuyuki; Sakurai, Takahiro; Ohta, Hitoshi
Paramagnetic ionic plastic crystals containing the octamethylferrocenium cation: counteranion dependence of phase transitions and crystal structures
Phys. Chem. Chem. Phys., 2017
7228342 CIFC19 H17 Br2 N4 O SiP -17.0548; 10.8999; 13.8588
73.194; 85.062; 86.312		1015.52Eusterwiemann, Steffen; Doerenkamp, Carsten; Dresselhaus, Thomas; Janka, Oliver; de Oliveira, Jr, Marcos; Daniliuc, Constantin Gabriel; Eckert, Helmut; Neugebauer, Johannes; Poettgen, Rainer; Studer, Armido
Strong Intermolecular Antiferromagnetic Verdazyl-Verdazyl Coupling in the Solid State
Phys. Chem. Chem. Phys., 2017
7228343 CIFC19 H17 Br2 N4 O SiP -17.1372; 10.9703; 13.9865
72.911; 86.154; 86.504		1043.42Eusterwiemann, Steffen; Doerenkamp, Carsten; Dresselhaus, Thomas; Janka, Oliver; de Oliveira, Jr, Marcos; Daniliuc, Constantin Gabriel; Eckert, Helmut; Neugebauer, Johannes; Poettgen, Rainer; Studer, Armido
Strong Intermolecular Antiferromagnetic Verdazyl-Verdazyl Coupling in the Solid State
Phys. Chem. Chem. Phys., 2017
7228344 CIFC19 H17 Br2 N4 O SiP -17.1059; 10.9332; 13.9604
72.976; 85.718; 86.366		1033.19Eusterwiemann, Steffen; Doerenkamp, Carsten; Dresselhaus, Thomas; Janka, Oliver; de Oliveira, Jr, Marcos; Daniliuc, Constantin Gabriel; Eckert, Helmut; Neugebauer, Johannes; Poettgen, Rainer; Studer, Armido
Strong Intermolecular Antiferromagnetic Verdazyl-Verdazyl Coupling in the Solid State
Phys. Chem. Chem. Phys., 2017
7228345 CIFC19 H17 Br2 N4 O SiP -17.0581; 10.8956; 13.8636
73.168; 85.182; 86.352		1016Eusterwiemann, Steffen; Doerenkamp, Carsten; Dresselhaus, Thomas; Janka, Oliver; de Oliveira, Jr, Marcos; Daniliuc, Constantin Gabriel; Eckert, Helmut; Neugebauer, Johannes; Poettgen, Rainer; Studer, Armido
Strong Intermolecular Antiferromagnetic Verdazyl-Verdazyl Coupling in the Solid State
Phys. Chem. Chem. Phys., 2017
7228381 CIFC32 H34 N4 O2P -15.9834; 6.4373; 18.61
89.153; 87.364; 78.992		702.85Jaumann, Eva; Steinwand, Sabrina; Klenik, Szabina; Plackmeyer, Joern; Bats, Jan; Wachtveitl, Josef; Prisner, Thomas F. F
A Combined Optical and EPR Spectroscopy Study: Azobenzene-Based Biradicals as Reversible Molecular Photoswitches
Phys. Chem. Chem. Phys., 2017
7228399 CIFC26 H32 N6 S2R -337.196; 37.196; 5.4457
90; 90; 120		6524.9Tam, Teck Lip Dexter; Lin, Ting Ting; Chua, Ming Hui
Can time-dependent density functional theory predict intersystem crossing in organic chromophores? A case study on benzo(bis)-X-diazole based donor‒acceptor‒donor type molecules
Phys. Chem. Chem. Phys., 2017
7228400 CIFC26 H32 N6 S2P 1 21/n 120.6046; 5.8783; 20.9113
90; 97.134; 90		2513.17Tam, Teck Lip Dexter; Lin, Ting Ting; Chua, Ming Hui
Can time-dependent density functional theory predict intersystem crossing in organic chromophores? A case study on benzo(bis)-X-diazole based donor‒acceptor‒donor type molecules
Phys. Chem. Chem. Phys., 2017
7228401 CIFC26 H32 N6 S2P -19.6442; 13.9072; 19.3218
80.5235; 89.0924; 79.1833		2510.43Tam, Teck Lip Dexter; Lin, Ting Ting; Chua, Ming Hui
Can time-dependent density functional theory predict intersystem crossing in organic chromophores? A case study on benzo(bis)-X-diazole based donor‒acceptor‒donor type molecules
Phys. Chem. Chem. Phys., 2017
7228402 CIFC8 H18 Mg2 N2 O13R 3 :H13.9212; 13.9212; 22.6133
90; 90; 120		3795.32Trzebiatowska, Monika; Zarychta, Bartosz; Pikul, Adam; maczka, miroslaw; Peksa, Paula; Poprawski, Ryszard
Polar metal-formate frameworks templated with 1,2-diaminoethane-water assemblies showing ferromagnetic and ferroelectric properties
Phys. Chem. Chem. Phys., 2017
7228403 CIFC8 H18 N2 Ni2 O13P 63 2 28.0241; 8.0241; 7.3421
90; 90; 120		409.4Trzebiatowska, Monika; Zarychta, Bartosz; Pikul, Adam; maczka, miroslaw; Peksa, Paula; Poprawski, Ryszard
Polar metal-formate frameworks templated with 1,2-diaminoethane-water assemblies showing ferromagnetic and ferroelectric properties
Phys. Chem. Chem. Phys., 2017
7228404 CIFC8 H18 N2 O13 Zn2R 3 :H13.958; 13.958; 22.4646
90; 90; 120		3790.32Trzebiatowska, Monika; Zarychta, Bartosz; Pikul, Adam; maczka, miroslaw; Peksa, Paula; Poprawski, Ryszard
Polar metal-formate frameworks templated with 1,2-diaminoethane-water assemblies showing ferromagnetic and ferroelectric properties
Phys. Chem. Chem. Phys., 2017
7228405 CIFC8 H18 Co2 N2 O13R 3 :R10.9975; 10.9975; 10.9975
78.85; 78.85; 78.85		1263.43Trzebiatowska, Monika; Zarychta, Bartosz; Pikul, Adam; maczka, miroslaw; Peksa, Paula; Poprawski, Ryszard
Polar metal-formate frameworks templated with 1,2-diaminoethane-water assemblies showing ferromagnetic and ferroelectric properties
Phys. Chem. Chem. Phys., 2017
7228419 CIFC18 H34 O4 PbP -14.8937; 7.3246; 28.2872
91.643; 94.767; 90.71		1009.9Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka
Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases
Phys. Chem. Chem. Phys., 2017
7228420 CIFC32 H62 O4 PbP 1 2/c 190.6159; 4.96125; 7.30027
90; 90.463; 90		3281.86Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka
Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases
Phys. Chem. Chem. Phys., 2017
7228421 CIFC20 H38 O4 PbP -14.91; 7.327; 30.806
88.565; 85.855; 89.391		1105Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka
Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases
Phys. Chem. Chem. Phys., 2017
7228422 CIFC20 H38 O4 PbP -14.8865; 7.2966; 30.7267
88.63; 85.856; 89.552		1092.36Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka
Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases
Phys. Chem. Chem. Phys., 2017
7228423 CIFC26 H50 O4 PbP 1 2/c 175.2787; 4.96255; 7.2836
90; 90.581; 90		2720.83Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka
Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases
Phys. Chem. Chem. Phys., 2017
7228424 CIFC18 H34 O4 PbP -14.89365; 7.32459; 28.2414
91.6403; 94.7593; 90.7105		1008.27Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka
Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases
Phys. Chem. Chem. Phys., 2017
7228425 CIFC34 H66 O4 PbP 1 2/c 195.649; 4.9544; 7.2989
90; 90.492; 90		3458.7Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka
Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases
Phys. Chem. Chem. Phys., 2017
7228426 CIFC18 H34 O4 PbP 1 2/c 154.9422; 4.98011; 7.25685
90; 90.5625; 90		1985.51Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka
Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases
Phys. Chem. Chem. Phys., 2017
7228427 CIFC16 H30 O4 PbP -14.788; 7.194; 25.648
87.63; 85.55; 89.31		880Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka
Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases
Phys. Chem. Chem. Phys., 2017
7228428 CIFC16 H30 O4 PbP -14.86902; 7.30619; 25.6951
88.1812; 85.2246; 89.1022		910.367Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka
Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases
Phys. Chem. Chem. Phys., 2017
7228429 CIFC24 H46 O4 PbP 1 2/c 170.263; 4.96672; 7.2705
90; 90.564; 90		2537.11Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka
Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases
Phys. Chem. Chem. Phys., 2017
7228430 CIFC30 H58 O4 PbP 1 2/c 185.4764; 4.96236; 7.2959
90; 90.59; 90		3094.5Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka
Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases
Phys. Chem. Chem. Phys., 2017
7228431 CIFC28 H54 O4 PbP 1 2/c 180.5448; 4.96393; 7.2966
90; 90.514; 90		2917.2Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka
Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases
Phys. Chem. Chem. Phys., 2017
7228432 CIFC20 H38 O4 PbP 1 2/c 160.021; 4.9611; 7.2496
90; 90.272; 90		2158.69Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka
Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases
Phys. Chem. Chem. Phys., 2017
7228433 CIFC22 H42 O4 PbP 1 2/c 165.15169; 4.97107; 7.27081
90; 90.4984; 90		2354.73Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka
Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases
Phys. Chem. Chem. Phys., 2017
7228434 CIFC36 H70 O4 PbP 1 2/c 1100.8473; 4.95888; 7.303
90; 90.488; 90		3652Martinez-Casado, Francisco Javier Javier; Ramos Riesco, Miguel; Cheda, Jose A.; Redondo Yélamos, María Isabel; Garrido, Leoncio; Fernandez-Martinez, Alejandro; García-Barriocanal, Javier; da Silva, Ivan; Duran-Olivencia, Miguel A.; Poulain, Agnieszka
Lead(II) Soaps: Crystal Structures, Polymorphism, Solid and Liquid Mesophases
Phys. Chem. Chem. Phys., 2017
7228452 CIFC225.11 H259.71 Cl8.74 N24 O42.2P 117.77; 18.09; 19.19
112.63; 96.4; 99.29		5516.2Szymański, M. P.; Jędrzejewska, H.; Wierzbicki, M.; Szumna, A.
On the mechanism of mechanochemical molecular encapsulation in peptidic capsules
Phys. Chem. Chem. Phys., 2017
7228499 CIFC48 H98 N2 O23 V6P 1 21/c 110.866; 14.776; 19.636
90; 97.766; 90		3124XU, Xiao; Spasojevic - de Biré, Anne; Ghermani, Nour Eddine; Wei, Yongge; Novakovic, Sladjana B.; Bosnjakovic-Pavlovic, Nada; Wu, Pingfan
Experimental Evidence of Charge Transfer in a Functionalized Hexavanadate. A High Resolution X-ray Diffraction Study
Phys. Chem. Chem. Phys., 2017
7228535 CIFC26 H12 O6P 1 21/c 17.268; 9.35; 13.757
90; 92.71; 90		933.8Kato, Ken; Hagi, Shogo; Hinoshita, Masumi; Shikoh, Eiji; Teki, Yoshio
Photoconductivity and magnetoconductance effects on vacuum vapor deposition films of weak charge-transfer complexes
Phys. Chem. Chem. Phys., 2017
7228536 CIFC28 H18 N2 O4C 1 2/c 112.019; 20.022; 8.703
90; 99.99; 90		2062.6Kato, Ken; Hagi, Shogo; Hinoshita, Masumi; Shikoh, Eiji; Teki, Yoshio
Photoconductivity and magnetoconductance effects on vacuum vapor deposition films of weak charge-transfer complexes
Phys. Chem. Chem. Phys., 2017
7228540 CIFC24 H20 Cl6 P UC 1 2/c 122.6559; 6.7274; 17.4505
90; 97.218; 90		2638.6Gendron, Frédéric; Fleischauer, Valerie E.; Duignan, Thomas J.; Scott, Brian L.; Löble, Matthias W.; Cary, Samantha K.; Kozimor, Stosh A.; Bolvin, Hélène; Neidig, Michael L.; Autschbach, Jochen
Magnetic circular dichroism of UCl6− in the ligand-to-metal charge-transfer spectral region
Phys. Chem. Chem. Phys., 2017
7228553 CIFC24 H22 N4 SP -18.1093; 9.6; 13.0873
89.2148; 84.7426; 86.5008		1012.63Kautny, Paul; Glöcklhofer, Florian; Kader, Thomas; Mewes, Jan-Michael; Stoeger, Berthold; Fröhlich, Johannes; Lumpi, Daniel; Plasser, Felix
Charge transfer states in triazole linked donor-acceptor materials: strong effects of chemical modifications and solvation
Phys. Chem. Chem. Phys., 2017
7228554 CIFC24 H22 N4 SP 1 21/n 18.8456; 23.4528; 10.109
90; 104.403; 90		2031.2Kautny, Paul; Glöcklhofer, Florian; Kader, Thomas; Mewes, Jan-Michael; Stoeger, Berthold; Fröhlich, Johannes; Lumpi, Daniel; Plasser, Felix
Charge transfer states in triazole linked donor-acceptor materials: strong effects of chemical modifications and solvation
Phys. Chem. Chem. Phys., 2017
7228555 CIFC24 H22 N4 SC 1 2/c 120.8317; 9.8784; 20.8194
90; 105.837; 90		4121.7Kautny, Paul; Glöcklhofer, Florian; Kader, Thomas; Mewes, Jan-Michael; Stoeger, Berthold; Fröhlich, Johannes; Lumpi, Daniel; Plasser, Felix
Charge transfer states in triazole linked donor-acceptor materials: strong effects of chemical modifications and solvation
Phys. Chem. Chem. Phys., 2017
7228620 CIFC18 H20 Cl N OP 1 21/c 119.3197; 8.699; 9.8963
90; 92.2801; 90		1661.88Yamamura, Yasuhisa; Murakoshi, Takahito; Iwagaki, Sakiko; Osiecka, Natalia; Galewski, Zbigniew; Saitoh, Hideki; Hishida, Mafumi; Massalska-Arodz, Maria; SAITO, Kazuya
Structure and molecular packing in smectic BCr and Ad phases of Schiff base liquid crystal compounds through analyses of layer spacing, entropy and crystal structure
Phys. Chem. Chem. Phys., 2017
7228621 CIFC18 H20 Cl N OP c a 216.1002; 7.3335; 36.4538
90; 90; 90		1630.79Yamamura, Yasuhisa; Murakoshi, Takahito; Iwagaki, Sakiko; Osiecka, Natalia; Galewski, Zbigniew; Saitoh, Hideki; Hishida, Mafumi; Massalska-Arodz, Maria; SAITO, Kazuya
Structure and molecular packing in smectic BCr and Ad phases of Schiff base liquid crystal compounds through analyses of layer spacing, entropy and crystal structure
Phys. Chem. Chem. Phys., 2017
7228622 CIFC18 H20 Cl N OP -118.4072; 8.61246; 9.9664
93.7782; 90.5052; 95.6436		1568.72Yamamura, Yasuhisa; Murakoshi, Takahito; Iwagaki, Sakiko; Osiecka, Natalia; Galewski, Zbigniew; Saitoh, Hideki; Hishida, Mafumi; Massalska-Arodz, Maria; SAITO, Kazuya
Structure and molecular packing in smectic BCr and Ad phases of Schiff base liquid crystal compounds through analyses of layer spacing, entropy and crystal structure
Phys. Chem. Chem. Phys., 2017
7228634 CIFC43 H80 Mo6 N4 O18P 1 21/n 111.6722; 34.0516; 14.1145
90; 91.962; 90		5606.6El Moll, Hani; Black, Fiona A.; Wood, Christopher J.; Al-Yasari, Ahmed; Marri, Anil Reddy; Sazanovich, Igor V.; Gibson, Elizabeth; Fielden, John
Increasing p-type Dye Sensitised Solar Cell Photovoltages using Polyoxometalates
Phys. Chem. Chem. Phys., 2017
7228639 CIFC12 H18 F12 Mg N2 O12 S4P 18.7021; 9.1183; 9.2356
97.006; 95.727; 100.012		710.77Tsuzuki, Seiji; MANDAI, Toshihiko; Suzuki, Soma; Shinoda, Wataru; Nakamura, Takenobu; Morishita, Tetsuya; Ueno, Kazuhide; Seki, Shiro; Umebayashi, Yasuhiro; Dokko, Kaoru; Watanabe, Masayoshi
Effect of the cation on the stability of cation-glyme complexes and their interactions with the [TFSA]- anion
Phys. Chem. Chem. Phys., 2017
7228640 CIFC46 H38 Cl2 O6P 1 21 110.6304; 10.6493; 16.3294
90; 104.655; 90		1788.45Buffeteau, Thierry; Pitrat, Delphine; Daugey, Nicolas; Calin, Nathalie; Jean, Marion; Vanthuyne, Nicolas; Ducasse, Laurent; Wien, Frank; Brotin, Thierry
Chiroptical properties of cryptophane-111
Phys. Chem. Chem. Phys., 2017
7228641 CIFC50 H41 N O6P 21 21 2110.5518; 10.7827; 32.7161
90; 90; 90		3722.3Buffeteau, Thierry; Pitrat, Delphine; Daugey, Nicolas; Calin, Nathalie; Jean, Marion; Vanthuyne, Nicolas; Ducasse, Laurent; Wien, Frank; Brotin, Thierry
Chiroptical properties of cryptophane-111
Phys. Chem. Chem. Phys., 2017
7228675 CIFC5 H7 Cd0.5 N2P 32 2 18.659; 8.659; 13.705
90; 90; 120		889.91Liu, Zhanning; Liu, Chenxi; Li, Qiang; Chen, Jun; Xing, Xianran
Spring-like Motion Caused Large Anisotropic Thermal Expansion in Nonporous M(eim)2 (M=Zn, Cd)
Phys. Chem. Chem. Phys., 2017
7228676 CIFC5 H7 Cd0.5 N2P 32 2 18.6335; 8.6335; 13.7402
90; 90; 120		886.947Liu, Zhanning; Liu, Chenxi; Li, Qiang; Chen, Jun; Xing, Xianran
Spring-like Motion Caused Large Anisotropic Thermal Expansion in Nonporous M(eim)2 (M=Zn, Cd)
Phys. Chem. Chem. Phys., 2017
7228677 CIFC5 H7 Cd0.5 N2P 32 2 18.7286; 8.7286; 13.6174
90; 90; 120		898.49Liu, Zhanning; Liu, Chenxi; Li, Qiang; Chen, Jun; Xing, Xianran
Spring-like Motion Caused Large Anisotropic Thermal Expansion in Nonporous M(eim)2 (M=Zn, Cd)
Phys. Chem. Chem. Phys., 2017
7228678 CIFC5 H7 Cd0.5 N2P 32 2 18.6948; 8.6948; 13.6675
90; 90; 120		894.83Liu, Zhanning; Liu, Chenxi; Li, Qiang; Chen, Jun; Xing, Xianran
Spring-like Motion Caused Large Anisotropic Thermal Expansion in Nonporous M(eim)2 (M=Zn, Cd)
Phys. Chem. Chem. Phys., 2017
7228816 CIFLa N2 O TaI m m a5.70714; 8.0548; 5.74023
90; 90; 90		263.878Hojamberdiev, Mirabbos; Bekheet, Maged F.; Hart, Judy N.; Vequizo, Junie Jhon M.; Yamakata, Akira; Yubuta, Kunio; Gurlo, Aleksander; Hasegawa, Masashi; Domen, Kazunari; Teshima, Katsuya
Elucidating the Impact of A-Site Cation Change on Photocatalytic H2 and O2 Evolution Activities of Perovskite-Type LnTaON2 (Ln = La and Pr)
Phys. Chem. Chem. Phys., 2017
7228817 CIFN2 O Pr TaP n m a5.6848; 8.0116; 5.6808
90; 90; 90		258.728Hojamberdiev, Mirabbos; Bekheet, Maged F.; Hart, Judy N.; Vequizo, Junie Jhon M.; Yamakata, Akira; Yubuta, Kunio; Gurlo, Aleksander; Hasegawa, Masashi; Domen, Kazunari; Teshima, Katsuya
Elucidating the Impact of A-Site Cation Change on Photocatalytic H2 and O2 Evolution Activities of Perovskite-Type LnTaON2 (Ln = La and Pr)
Phys. Chem. Chem. Phys., 2017
7228828 CIFC20 H14 Cl2 N2P 1 21/n 114.2044; 6.0526; 20.781
90; 106.451; 90		1713.48Lei, Hu; Langlois, Adam; Fortin, Daniel; Karsenti, Paul-Ludovic; Aly, Shawkat M.; Harvey, Pierre D.
Rendering cross-conjugated azophenine derivatives emissive to probe the silent photophysical properties of emeraldine
Phys. Chem. Chem. Phys., 2017
7228829 CIFC52 H64 N4 O2 Si4C 1 2/c 138.446; 5.7728; 26.2153
90; 102.956; 90		5670.1Lei, Hu; Langlois, Adam; Fortin, Daniel; Karsenti, Paul-Ludovic; Aly, Shawkat M.; Harvey, Pierre D.
Rendering cross-conjugated azophenine derivatives emissive to probe the silent photophysical properties of emeraldine
Phys. Chem. Chem. Phys., 2017
7228830 CIFC290 H380 N4 O4P 1 21/c 119.6056; 18.2484; 36.537
90; 104.497; 90		12655.7Lei, Hu; Langlois, Adam; Fortin, Daniel; Karsenti, Paul-Ludovic; Aly, Shawkat M.; Harvey, Pierre D.
Rendering cross-conjugated azophenine derivatives emissive to probe the silent photophysical properties of emeraldine
Phys. Chem. Chem. Phys., 2017
7228846 CIFC28 H21 N3 O0.1P 1 21/c 18.3398; 9.4693; 26.459
90; 96.161; 90		2077.45Zhang, Mengmeng; Yang, Wen; Gong, Tingfeng; Zhou, Weiqun; Xue, Renyu
Tunable AIEE fluorescence constructed from a triphenylamine luminogen containing quinoline ‒ application in a reversible and tunable pH sensor
Phys. Chem. Chem. Phys., 2017
7228862 CIFC28 H22 N2 O6 S2P -18.13783; 11.6634; 13.498
93.4739; 96.731; 103.882		1229.92Takeda, Takashi; Suzuki, Yasutaka; Kawamata, Jun; Noro, Shin-ichiro; Nakamura, Takayoshi; Akutagawa, Tomoyuki
Emergent intramolecular hydrogen bonding effect to electronic structures of organic electron acceptors
Phys. Chem. Chem. Phys., 2017
7228904 CIFC6 H12 Er0.02 N O8 Y0.91 Yb0.07P 1 21 16.657; 8.652; 9.708
90; 102.42; 90		546.1Ptak, Maciej; Pasińska, Katarzyna; Głuchowski, Paweł; Lukowiak, Anna; Ciupa, Aneta
Structural, optical and phonon properties of formate-based MOF phosphors with ethylammonium cation
Phys. Chem. Chem. Phys., 2017
7228905 CIFC6 H12 Er0.2 N O8 Yb0.8P 1 21 16.61; 8.599; 9.656
90; 102.01; 90		536.8Ptak, Maciej; Pasińska, Katarzyna; Głuchowski, Paweł; Lukowiak, Anna; Ciupa, Aneta
Structural, optical and phonon properties of formate-based MOF phosphors with ethylammonium cation
Phys. Chem. Chem. Phys., 2017
7228906 CIFC6 H12 Eu0.08 N O8 Y0.92P 1 21 16.663; 8.658; 9.716
90; 102.45; 90		547.3Ptak, Maciej; Pasińska, Katarzyna; Głuchowski, Paweł; Lukowiak, Anna; Ciupa, Aneta
Structural, optical and phonon properties of formate-based MOF phosphors with ethylammonium cation
Phys. Chem. Chem. Phys., 2017
7229077 CIFC54 H73 Cr6 Cs2 N6 O69.5 Si W12P -113.506; 20.537; 20.565
76.764; 73.713; 73.912		5190Uchida, Sayaka; Hosono, Reina; Eguchi, Ryo; Kawahara, Ryosuke; Osuga, Ryota; Kondo, Junko Nomura; Hibino, Mitsuhiro; Mizuno, Noritaka
Proton Conduction in Alkali Metal Ion-Exchanged Porous Ionic Crystals
Phys. Chem. Chem. Phys., 2017
7229078 CIFC54 H66 Cr6 N6 Na4 O68.5 Si W12P -113.535; 20.577; 20.603
76.6; 73.782; 73.784		5217Uchida, Sayaka; Hosono, Reina; Eguchi, Ryo; Kawahara, Ryosuke; Osuga, Ryota; Kondo, Junko Nomura; Hibino, Mitsuhiro; Mizuno, Noritaka
Proton Conduction in Alkali Metal Ion-Exchanged Porous Ionic Crystals
Phys. Chem. Chem. Phys., 2017
7229205 CIFC2 H7 N O3P 1 21/c 17.3033; 8.6135; 6.8992
90; 99.565; 90		427.97Pereira, Jorge F. B.; Barber, Patrick S.; Kelley, Steven Paul; Berton, Paula; Rogers, Robin D.
Double Salt Ionic Liquids Based on 1-Ethyl-3-Methylimidazolium Acetate and Hydroxyl-Functionalized Ammonium Acetates: Strong Effects of Weak Interactions
Phys. Chem. Chem. Phys., 2017
7229206 CIFC4 H11 N O3P 1 21/n 17.6326; 9.1273; 9.7984
90; 104.806; 90		659.94Pereira, Jorge F. B.; Barber, Patrick S.; Kelley, Steven Paul; Berton, Paula; Rogers, Robin D.
Double Salt Ionic Liquids Based on 1-Ethyl-3-Methylimidazolium Acetate and Hydroxyl-Functionalized Ammonium Acetates: Strong Effects of Weak Interactions
Phys. Chem. Chem. Phys., 2017
7229207 CIFC4 H11 N O2P 326.9335; 6.9335; 10.7367
90; 90; 120		447Pereira, Jorge F. B.; Barber, Patrick S.; Kelley, Steven Paul; Berton, Paula; Rogers, Robin D.
Double Salt Ionic Liquids Based on 1-Ethyl-3-Methylimidazolium Acetate and Hydroxyl-Functionalized Ammonium Acetates: Strong Effects of Weak Interactions
Phys. Chem. Chem. Phys., 2017
7229208 CIFC7 H17 N O3P 1 21 17.7116; 7.1277; 8.4076
90; 102.612; 90		450.98Pereira, Jorge F. B.; Barber, Patrick S.; Kelley, Steven Paul; Berton, Paula; Rogers, Robin D.
Double Salt Ionic Liquids Based on 1-Ethyl-3-Methylimidazolium Acetate and Hydroxyl-Functionalized Ammonium Acetates: Strong Effects of Weak Interactions
Phys. Chem. Chem. Phys., 2017
7229209 CIFC6 H15 N O2P -4 21 c10.9186; 10.9186; 13.3235
90; 90; 90		1588.37Pereira, Jorge F. B.; Barber, Patrick S.; Kelley, Steven Paul; Berton, Paula; Rogers, Robin D.
Double Salt Ionic Liquids Based on 1-Ethyl-3-Methylimidazolium Acetate and Hydroxyl-Functionalized Ammonium Acetates: Strong Effects of Weak Interactions
Phys. Chem. Chem. Phys., 2017
7229210 CIFC24 H48 Cl8 O12 Si8P -110.0885; 10.2199; 12.6232
81.761; 74.572; 79.163		1226.23Kowalewska, Anna; Nowacka, Maria; Włodarska, Magdalena; Zgardzinska, B.; Zaleski, Radosław; Oszajca, Marcin; Krajenta, Justyna; Kazmierski, Slawomir
Solid-state dynamics and single-crystal to single-crystal structural transformations in octakis(3-chloropropyl)octasilsesquioxane and octavinyloctasilsesquioxane.
Phys. Chem. Chem. Phys., 2017
7229211 CIFC24 H48 Cl8 O12 Si8P -110.3481; 10.4361; 12.1092
87.083; 77.106; 81.234		1259.66Kowalewska, Anna; Nowacka, Maria; Włodarska, Magdalena; Zgardzinska, B.; Zaleski, Radosław; Oszajca, Marcin; Krajenta, Justyna; Kazmierski, Slawomir
Solid-state dynamics and single-crystal to single-crystal structural transformations in octakis(3-chloropropyl)octasilsesquioxane and octavinyloctasilsesquioxane.
Phys. Chem. Chem. Phys., 2017
7229227 CIFC24 H31 F17 N3 PP -110.1936; 12.6081; 25.0746
102.184; 97.398; 94.832		3103.1Zhang, Peng; Rauber, Daniel; Huch, Volker; Kraus, Tobias; Hempelmann, Rolf
Lamellar Structures in Fluorinated Phosphonium Ionic Liquids: the Roles of Fluorination and Chain Length
Phys. Chem. Chem. Phys., 2017
7229255 CIFC34 H57 Cl2 I Ni P2P 1 21/c 112.0708; 18.5658; 16.5122
90; 101.264; 90		3629.2Hatakeyama, Makoto; Sakamoto, Yuki; Ogata, Koji; Sumida, Yuto; Sumida, Tomoe; Hosoya, Takamitsu; Nakamura, Shinichiro
A study on an unusual SN2 mechanism in the methylation of benzyne through nickel-complexation
Phys. Chem. Chem. Phys., 2017
7229282 CIFC12 H8 O4P 1 21/n 13.796; 18.3816; 13.3342
90; 90.367; 90		930.4Chen, Yi-Ting; Wu, Pei-Jhen; Peng, Chia-Yu; Shen, Jiun-Yi; Tsai, Cheng-Cheng; Hu, Wei-Ping; Chou, Pi-Tai
A Study of Competitive Multiple Hydrogen Bonding Effect and Its Associated Excited-State Proton Transfer Tautomerism
Phys. Chem. Chem. Phys., 2017
7229395 CIFC23 H26 Al N3 O10P -112.1864; 13.4221; 16.0962
88.6544; 80.3988; 66.631		2380.33Khan, Tuhin; Datta, Anindya
Enhanced fluorescence with nanosecond dynamics in solid state of metal Ion complexes of alkoxy salophens
Phys. Chem. Chem. Phys., 2017
7229396 CIFC24 H24 N2 O4P c a 2121.157; 4.9633; 19.59
90; 90; 90		2057.1Khan, Tuhin; Datta, Anindya
Enhanced fluorescence with nanosecond dynamics in solid state of metal Ion complexes of alkoxy salophens
Phys. Chem. Chem. Phys., 2017
7229397 CIFC26 H34 Al N3 O11P -110.8324; 12.4673; 12.7788
107.399; 107.229; 110.276		1382.1Khan, Tuhin; Datta, Anindya
Enhanced fluorescence with nanosecond dynamics in solid state of metal Ion complexes of alkoxy salophens
Phys. Chem. Chem. Phys., 2017
7229416 CIFCa2 Fe2 O5P n m a5.42489; 14.78357; 5.59289
90; 90; 90		448.546Kagomiya, Isao; Hirota, Yuki; Kakimoto, Ken-ichi; Fujii, Kotaro; Shiraiwa, Masahiro; Yashima, Masatomo; Fuwa, Akio; Nakamura, Shin
Weak ferromagnetic ordering in brownmillerite Ca2Fe2O5 and its effect on electric field gradients
Phys. Chem. Chem. Phys., 2017
7229492 CIFC16 H36 F12 N2 Ni O14 S10P -18.102; 10.826; 12.605
108.151; 91.018; 101.503		1025.7Kawazu, Yutaro; Hoke, Hiroshi; Yamada, Yasunori; Umecky, Tatsuya; Ozutsumi , Kazuhiko; Takamuku, Toshiyuki
Complex Formation of Nickel(II) with Dimethyl Sulfoxide, Methanol, and Acetonitrile in TFSA−‒based Ionic Liquid of [C2mim][TFSA]
Physical Chemistry Chemical Physics, 2017
7229493 CIFC16 H18 F12 N8 Ni O8 S4P 1 21/n 18.866; 15.203; 12.895
90; 105.443; 90		1675.4Kawazu, Yutaro; Hoke, Hiroshi; Yamada, Yasunori; Umecky, Tatsuya; Ozutsumi , Kazuhiko; Takamuku, Toshiyuki
Complex Formation of Nickel(II) with Dimethyl Sulfoxide, Methanol, and Acetonitrile in TFSA−‒based Ionic Liquid of [C2mim][TFSA]
Physical Chemistry Chemical Physics, 2017
7229494 CIFC16 H36 Co F12 N2 O14 S10P -18.351; 11.615; 12.237
111.339; 98.4886; 100.274		1058.2Kawazu, Yutaro; Hoke, Hiroshi; Yamada, Yasunori; Umecky, Tatsuya; Ozutsumi , Kazuhiko; Takamuku, Toshiyuki
Complex Formation of Nickel(II) with Dimethyl Sulfoxide, Methanol, and Acetonitrile in TFSA−‒based Ionic Liquid of [C2mim][TFSA]
Physical Chemistry Chemical Physics, 2017
7229535 CIFC10 H8 N2C 1 2/c 113.842; 9.396; 7.518
90; 119.209; 90		853.5Wang, Wenmin; Sun, Xiaoyang; Qu, Jian; Xie, Xiaoyu; Qi, Zheng-Hang; Hong, Daocheng; Jing, Su; Zheng, Dong; Tian, Yuxi; Ma, Haibo; Yu, Shouyun; Ma, Jing
Aggregation-Induced Visible Light Absorption Makes Reactant 1,2-Diisocyanoarenes Acting as Photosensitizer in Double Radical Isocyanide Insertions
Physical Chemistry Chemical Physics, 2017
7232549 CIFC8 H18 Cr N2 Na O12P 1 21/n 18.0317; 8.7854; 11.9391
90; 90.923; 90		842.33Ptak, Maciej; Dziuk, Błażej; Stefańska, Dagmara; Hermanowicz, Krzysztof
The structural, phonon and optical properties of [CH3NH3]M0.5CrxAl0.5−x(HCOO)3 (M = Na, K; x = 0, 0.025, 0.5) metal‒organic framework perovskites for luminescence thermometry
Physical Chemistry Chemical Physics, 2019
7232550 CIFC8 H18 Cr N2 Na O12P 1 21/n 17.9504; 8.7582; 11.853
90; 90.989; 90		825.22Ptak, Maciej; Dziuk, Błażej; Stefańska, Dagmara; Hermanowicz, Krzysztof
The structural, phonon and optical properties of [CH3NH3]M0.5CrxAl0.5−x(HCOO)3 (M = Na, K; x = 0, 0.025, 0.5) metal‒organic framework perovskites for luminescence thermometry
Physical Chemistry Chemical Physics, 2019
7232551 CIFC8 H18 Al K N2 O12P 1 21/n 18.1644; 9.0972; 12.2715
90; 90.289; 90		911.43Ptak, Maciej; Dziuk, Błażej; Stefańska, Dagmara; Hermanowicz, Krzysztof
The structural, phonon and optical properties of [CH3NH3]M0.5CrxAl0.5−x(HCOO)3 (M = Na, K; x = 0, 0.025, 0.5) metal‒organic framework perovskites for luminescence thermometry
Physical Chemistry Chemical Physics, 2019
7232552 CIFC8 H18 Cr K N2 O12P 1 21/n 18.2054; 9.1089; 12.3423
90; 90.377; 90		922.5Ptak, Maciej; Dziuk, Błażej; Stefańska, Dagmara; Hermanowicz, Krzysztof
The structural, phonon and optical properties of [CH3NH3]M0.5CrxAl0.5−x(HCOO)3 (M = Na, K; x = 0, 0.025, 0.5) metal‒organic framework perovskites for luminescence thermometry
Physical Chemistry Chemical Physics, 2019
7232553 CIFC8 H18 Cr K N2 O12P 1 21/n 18.1907; 9.0549; 12.2909
90; 90.41; 90		911.54Ptak, Maciej; Dziuk, Błażej; Stefańska, Dagmara; Hermanowicz, Krzysztof
The structural, phonon and optical properties of [CH3NH3]M0.5CrxAl0.5−x(HCOO)3 (M = Na, K; x = 0, 0.025, 0.5) metal‒organic framework perovskites for luminescence thermometry
Physical Chemistry Chemical Physics, 2019
7232554 CIFC8 H18 Al K N2 O12P 1 21/n 18.1568; 9.0289; 12.238
90; 90.509; 90		901.26Ptak, Maciej; Dziuk, Błażej; Stefańska, Dagmara; Hermanowicz, Krzysztof
The structural, phonon and optical properties of [CH3NH3]M0.5CrxAl0.5−x(HCOO)3 (M = Na, K; x = 0, 0.025, 0.5) metal‒organic framework perovskites for luminescence thermometry
Physical Chemistry Chemical Physics, 2019
7232631 CIFC16 H36 F12 Mg N2 O14 S10P -18.3553; 11.644; 12.2554
111.29; 98.55; 100.341		1062.74MANDAI, Toshihiko; Tatesaka, Kenji; Soh, Kenya; Masu, Hyuma; Choudhary, Ashu; Tateyama, Yoshitaka; Ise, Ryuta; Imai, Hiroaki; Takeguchi, Tatsuya; Kanamura, Kiyoshi
Modifications in Coordination Structure of Mg[TFSA]2-Based Supporting Salts for High-Voltage Magnesium Rechargeable Batteries
Physical Chemistry Chemical Physics, 2019
7232632 CIFC44 H68 F24 Mg2 N12 O26 S8P -114.2221; 16.156; 20.0391
96.153; 109.15; 109.657		3971.8MANDAI, Toshihiko; Tatesaka, Kenji; Soh, Kenya; Masu, Hyuma; Choudhary, Ashu; Tateyama, Yoshitaka; Ise, Ryuta; Imai, Hiroaki; Takeguchi, Tatsuya; Kanamura, Kiyoshi
Modifications in Coordination Structure of Mg[TFSA]2-Based Supporting Salts for High-Voltage Magnesium Rechargeable Batteries
Physical Chemistry Chemical Physics, 2019
7232633 CIFC34 H48 F12 Mg N14 O8 S4P 1 21/c 111.0919; 11.1816; 20.2849
90; 98.442; 90		2488.6MANDAI, Toshihiko; Tatesaka, Kenji; Soh, Kenya; Masu, Hyuma; Choudhary, Ashu; Tateyama, Yoshitaka; Ise, Ryuta; Imai, Hiroaki; Takeguchi, Tatsuya; Kanamura, Kiyoshi
Modifications in Coordination Structure of Mg[TFSA]2-Based Supporting Salts for High-Voltage Magnesium Rechargeable Batteries
Physical Chemistry Chemical Physics, 2019
7232634 CIFC26 H50 F12 Mg N2 O17 S6P 1 21/n 116.5803; 16.0637; 18.4302
90; 107.544; 90		4680.4MANDAI, Toshihiko; Tatesaka, Kenji; Soh, Kenya; Masu, Hyuma; Choudhary, Ashu; Tateyama, Yoshitaka; Ise, Ryuta; Imai, Hiroaki; Takeguchi, Tatsuya; Kanamura, Kiyoshi
Modifications in Coordination Structure of Mg[TFSA]2-Based Supporting Salts for High-Voltage Magnesium Rechargeable Batteries
Physical Chemistry Chemical Physics, 2019
7232701 CIFC49 H21 Cl3 F20 N5 O4I 1 2/m 118.9313; 16.3839; 17.3825
90; 91.048; 90		5390.6Yao, Yuhang; Rao, Yu; Liu, Yi-Wei; Jiang, Liang; Xiong, Jin; Fan, Ying-Jie; Shen, Zhen; Sessler, Jonathan L.; Zhang, Jun-Long
Aromaticity versus Regioisomeric Effect of β-Substituents in Porphyrinoids
Physical Chemistry Chemical Physics, 2019
7232702 CIFC46 H10 Cl3 F20 N5 O4P 1 21/n 119.2843; 8.2608; 28.316
90; 103.985; 90		4377.1Yao, Yuhang; Rao, Yu; Liu, Yi-Wei; Jiang, Liang; Xiong, Jin; Fan, Ying-Jie; Shen, Zhen; Sessler, Jonathan L.; Zhang, Jun-Long
Aromaticity versus Regioisomeric Effect of β-Substituents in Porphyrinoids
Physical Chemistry Chemical Physics, 2019
7232703 CIFC46 H10 Cl3 F20 N5 O4P 1 21 114.5721; 9.2987; 15.8007
90; 90.331; 90		2141Yao, Yuhang; Rao, Yu; Liu, Yi-Wei; Jiang, Liang; Xiong, Jin; Fan, Ying-Jie; Shen, Zhen; Sessler, Jonathan L.; Zhang, Jun-Long
Aromaticity versus Regioisomeric Effect of β-Substituents in Porphyrinoids
Physical Chemistry Chemical Physics, 2019
7232704 CIFC45 H7 F20 N5 O6P -118.2714; 18.3261; 35.2109
95.797; 97.429; 90.023		11630.3Yao, Yuhang; Rao, Yu; Liu, Yi-Wei; Jiang, Liang; Xiong, Jin; Fan, Ying-Jie; Shen, Zhen; Sessler, Jonathan L.; Zhang, Jun-Long
Aromaticity versus Regioisomeric Effect of β-Substituents in Porphyrinoids
Physical Chemistry Chemical Physics, 2019
7232705 CIFC45 H7 F20 N5 O6P 1 21 133.9547; 8.7071; 58.8064
90; 93.851; 90		17346.7Yao, Yuhang; Rao, Yu; Liu, Yi-Wei; Jiang, Liang; Xiong, Jin; Fan, Ying-Jie; Shen, Zhen; Sessler, Jonathan L.; Zhang, Jun-Long
Aromaticity versus Regioisomeric Effect of β-Substituents in Porphyrinoids
Physical Chemistry Chemical Physics, 2019
7232706 CIFC45 H11 F20 N5 O4C 1 2/m 125.788; 16.3752; 12.6133
90; 90.592; 90		5326.11Yao, Yuhang; Rao, Yu; Liu, Yi-Wei; Jiang, Liang; Xiong, Jin; Fan, Ying-Jie; Shen, Zhen; Sessler, Jonathan L.; Zhang, Jun-Long
Aromaticity versus Regioisomeric Effect of β-Substituents in Porphyrinoids
Physical Chemistry Chemical Physics, 2019
7232811 CIFC32 H24 O6C 1 2/c 111.5969; 13.4458; 15.9778
90; 107.103; 90		2381.2Hirao, Yasukazu; Hamamoto, Yosuke; Nagamachi, Nobuhiro; Kubo, Takashi
Solvent Viscosity-Dependent Isomerization Equilibrium of Tetramethoxy-Substituted Bianthrone
Physical Chemistry Chemical Physics, 2019
7232812 CIFC32 H26 O6C 1 2/c 125.4848; 7.819; 13.9952
90; 92.559; 90		2786Hirao, Yasukazu; Hamamoto, Yosuke; Nagamachi, Nobuhiro; Kubo, Takashi
Solvent Viscosity-Dependent Isomerization Equilibrium of Tetramethoxy-Substituted Bianthrone
Physical Chemistry Chemical Physics, 2019
7232840 CIFC7 H18 B F4 N3F m -310.877; 10.877; 10.877
90; 90; 90		1287Yunis, Ruhamah; Hollenkamp, Anthony F.; Forsyth, Craig; Doherty, Cara M.; Al-Masri, Danah; Pringle, Jennifer M.
Organic salts utilising the hexamethylguanidinium cation: the influence of the anion on the structural, physical and thermal properties
Physical Chemistry Chemical Physics, 2019
7232841 CIFC9 H18 F6 N4 O4 S2P -17.9127; 8.1869; 8.5091
88.249; 63.336; 73.529		469.37Yunis, Ruhamah; Hollenkamp, Anthony F.; Forsyth, Craig; Doherty, Cara M.; Al-Masri, Danah; Pringle, Jennifer M.
Organic salts utilising the hexamethylguanidinium cation: the influence of the anion on the structural, physical and thermal properties
Physical Chemistry Chemical Physics, 2019
7232842 CIFC7 H18 F6 N3 PP a -310.9739; 10.9739; 10.9739
90; 90; 90		1321.55Yunis, Ruhamah; Hollenkamp, Anthony F.; Forsyth, Craig; Doherty, Cara M.; Al-Masri, Danah; Pringle, Jennifer M.
Organic salts utilising the hexamethylguanidinium cation: the influence of the anion on the structural, physical and thermal properties
Physical Chemistry Chemical Physics, 2019
7232843 CIFC9 H18 F6 N4 O4 S2P 1 21/n 113.715; 8.6718; 15.6538
90; 102.306; 90		1818.99Yunis, Ruhamah; Hollenkamp, Anthony F.; Forsyth, Craig; Doherty, Cara M.; Al-Masri, Danah; Pringle, Jennifer M.
Organic salts utilising the hexamethylguanidinium cation: the influence of the anion on the structural, physical and thermal properties
Physical Chemistry Chemical Physics, 2019
7232911 CIFC26 H16 S2C 1 2/c 116.8912; 11.897; 19.6308
90; 104.361; 90		3821.6Shen, Yue; Liu, Haichao; Cao, Jungang; Zhang, Shitong; Li, Weijun; Yang, Bing
Unusual Temperature-Sensitive Excimer Fluorescence from Discrete π-π Dimer Stacking of Anthracene in a Crystal
Physical Chemistry Chemical Physics, 2019
7232988 CIFC62.71 H57.43 Br2 Cl3.43 N4 OP 1 21/n 112.3578; 19.6171; 24.1612
90; 93.8074; 90		5844.3Schreck, Maximilian Hubert; Breitschwerdt, Lena; Marciniak, Henning; Holzapfel, Marco; Schmidt, David; Wuerthner, Frank; Lambert, Christoph
fs-ps Exciton dynamics in a stretched tetraphenylsquaraine polymer
Physical Chemistry Chemical Physics, 2019
7233041 CIFC4 H9 Cl Cu SP 1 21/n 18.9309; 6.7591; 10.8963
90; 109.028; 90		621.81Schlachter, Adrien Camille; Bonnot, Antoine; Fortin, Daniel; Karsenti, Paul-Ludovic; Knorr, Michael; Harvey, Pierre D.
Unusual Triplet-Triplet Annihilation in a 3D Copper Chloride Coordination Polymer
Physical Chemistry Chemical Physics, 2019
7233042 CIFC4 H9 Cl Cu SP 1 21/n 18.9363; 6.7653; 10.9019
90; 109.053; 90		622.99Schlachter, Adrien Camille; Bonnot, Antoine; Fortin, Daniel; Karsenti, Paul-Ludovic; Knorr, Michael; Harvey, Pierre D.
Unusual Triplet-Triplet Annihilation in a 3D Copper Chloride Coordination Polymer
Physical Chemistry Chemical Physics, 2019
7233043 CIFC4 H9 Cl Cu SP 1 21/n 18.9459; 6.788; 10.9215
90; 108.982; 90		627.14Schlachter, Adrien Camille; Bonnot, Antoine; Fortin, Daniel; Karsenti, Paul-Ludovic; Knorr, Michael; Harvey, Pierre D.
Unusual Triplet-Triplet Annihilation in a 3D Copper Chloride Coordination Polymer
Physical Chemistry Chemical Physics, 2019
7233044 CIFC4 H9 Cl Cu SP 1 21/n 18.9415; 6.7764; 10.9128
90; 109.007; 90		625.17Schlachter, Adrien Camille; Bonnot, Antoine; Fortin, Daniel; Karsenti, Paul-Ludovic; Knorr, Michael; Harvey, Pierre D.
Unusual Triplet-Triplet Annihilation in a 3D Copper Chloride Coordination Polymer
Physical Chemistry Chemical Physics, 2019
7233045 CIFC4 H9 Cl Cu SP 1 21/n 18.9401; 6.778; 10.9123
90; 108.995; 90		625.24Schlachter, Adrien Camille; Bonnot, Antoine; Fortin, Daniel; Karsenti, Paul-Ludovic; Knorr, Michael; Harvey, Pierre D.
Unusual Triplet-Triplet Annihilation in a 3D Copper Chloride Coordination Polymer
Physical Chemistry Chemical Physics, 2019
7233046 CIFC4 H9 Cl Cu SP 1 21/n 18.936; 6.7693; 10.9057
90; 109.008; 90		623.72Schlachter, Adrien Camille; Bonnot, Antoine; Fortin, Daniel; Karsenti, Paul-Ludovic; Knorr, Michael; Harvey, Pierre D.
Unusual Triplet-Triplet Annihilation in a 3D Copper Chloride Coordination Polymer
Physical Chemistry Chemical Physics, 2019
7233047 CIFC4 H9 Cl Cu SP 1 21/n 18.9479; 6.7968; 10.9255
90; 108.967; 90		628.38Schlachter, Adrien Camille; Bonnot, Antoine; Fortin, Daniel; Karsenti, Paul-Ludovic; Knorr, Michael; Harvey, Pierre D.
Unusual Triplet-Triplet Annihilation in a 3D Copper Chloride Coordination Polymer
Physical Chemistry Chemical Physics, 2019
7233048 CIFC4 H9 Cl Cu SP 1 21/n 18.9566; 6.8133; 10.9391
90; 108.913; 90		631.51Schlachter, Adrien Camille; Bonnot, Antoine; Fortin, Daniel; Karsenti, Paul-Ludovic; Knorr, Michael; Harvey, Pierre D.
Unusual Triplet-Triplet Annihilation in a 3D Copper Chloride Coordination Polymer
Physical Chemistry Chemical Physics, 2019
7233049 CIFC4 H9 Cl Cu SP 1 21/n 18.9369; 6.7675; 10.9024
90; 109.052; 90		623.26Schlachter, Adrien Camille; Bonnot, Antoine; Fortin, Daniel; Karsenti, Paul-Ludovic; Knorr, Michael; Harvey, Pierre D.
Unusual Triplet-Triplet Annihilation in a 3D Copper Chloride Coordination Polymer
Physical Chemistry Chemical Physics, 2019
7233072 CIFC20 H24 N2 O4P -18.6578; 10.0035; 11.6371
78.764; 75.978; 67.163		895.44Paul, Mathias; Peckelsen, Katrin; Thomulka, Thomas; Neudoerfl, Joerg; Martens, Jonathan; Berden, Giel; Oomens, Jos; Berkessel, Albrecht; Meijer, Anthony J. H. M.; Schäfer, Mathias
Hydrogen Tunneling Avoided: Enol-Formation From a Charge-tagged Phenyl Pyruvic Acid Derivative Evidenced by Tandem-MS, IR Ion Spectroscopy and Theory
Physical Chemistry Chemical Physics, 2019
7233073 CIFC26 H37 I2 N3 O7P -110.2439; 11.9323; 14.7966
72.918; 83.311; 65.747		1576.24Paul, Mathias; Peckelsen, Katrin; Thomulka, Thomas; Neudoerfl, Joerg; Martens, Jonathan; Berden, Giel; Oomens, Jos; Berkessel, Albrecht; Meijer, Anthony J. H. M.; Schäfer, Mathias
Hydrogen Tunneling Avoided: Enol-Formation From a Charge-tagged Phenyl Pyruvic Acid Derivative Evidenced by Tandem-MS, IR Ion Spectroscopy and Theory
Physical Chemistry Chemical Physics, 2019
7233098 CIFC10 H10 N2 O3P b c a11.0905; 10.9922; 16.1833
90; 90; 90		1972.89Zięba, Sylwia; Dubis, Alina Teresa; Gzella, Andrzej K.; Ławniczak, Paweł; Pogorzelec-Glaser, Katarzyna; Lapinski, Andrzej
Toward a new type of proton conductors based on imidazole and aromatic acids
Physical Chemistry Chemical Physics, 2019
7233099 CIFC10 H10 N2 O2P 1 21/n 18.7106; 12.3618; 9.2744
90; 111.594; 90		928.56Zięba, Sylwia; Dubis, Alina Teresa; Gzella, Andrzej K.; Ławniczak, Paweł; Pogorzelec-Glaser, Katarzyna; Lapinski, Andrzej
Toward a new type of proton conductors based on imidazole and aromatic acids
Physical Chemistry Chemical Physics, 2019
7233189 CIFC19 H18 N2 O3P c c n17.361; 25.237; 7.5371
90; 90; 90		3302.3Yu, Binhong; Wang, Yi; Wang, Lingrui; Tan, Xiao; Zhang, Yumo; Wang, Kai; Li, Minjie; Zou, Bo; Zhang, Sean Xiao-An
Spontaneous proton transfer in a series of amphoteric molecules under hydrostatic pressure
Physical Chemistry Chemical Physics, 2019
7233235 CIFC96 H108 Ni6 S12P 1 21/n 111.244; 12.415; 32.461
90; 92.071; 90		4528Pembere, Anthony M.; Cui, Chaonan; Anumula, Rajini; Wu, Huiming; An, Pan; Liang, Tongling; Luo, Zhixun
A Hexagonal Ni6 Cluster Protected by 2-Phenylethanethiol for Catalytic Conversion of Toluene to Benzaldehyde
Physical Chemistry Chemical Physics, 2019
7233312 CIFC39 H30 Cl N3 O Os P2P 1 21/n 112.956; 21.353; 13.256
90; 110.133; 90		3443Kamecka, Anna; Suwińska, Kinga; Kapturkiewicz, Andrzej
Heteroleptic [Os(Cl)(CO)(P^P)(pbi)] complexes bearing bidentate phosphine and 2-(2-pyridyl)benzimidazolate ligands: impact of isomerism on their luminescence properties
Physical Chemistry Chemical Physics, 2019
7233313 CIFC40.5 H36 Cl N3 O1.5 Os P2I 4123.138; 23.138; 26.906
90; 90; 90		14405Kamecka, Anna; Suwińska, Kinga; Kapturkiewicz, Andrzej
Heteroleptic [Os(Cl)(CO)(P^P)(pbi)] complexes bearing bidentate phosphine and 2-(2-pyridyl)benzimidazolate ligands: impact of isomerism on their luminescence properties
Physical Chemistry Chemical Physics, 2019
7233314 CIFC39 H34 Cl N3 O2 Os P2P 1 21/c 118.17; 11.651; 16.431
90; 101.198; 90		3412.2Kamecka, Anna; Suwińska, Kinga; Kapturkiewicz, Andrzej
Heteroleptic [Os(Cl)(CO)(P^P)(pbi)] complexes bearing bidentate phosphine and 2-(2-pyridyl)benzimidazolate ligands: impact of isomerism on their luminescence properties
Physical Chemistry Chemical Physics, 2019
7233369 CIFC35 H55 Cl N4 O4P b c a16.6055; 19.9177; 21.7032
90; 90; 90		7178.2Cheisson, Thibault; Jian, Jiwen; Su, Jing; Eaton, Teresa M.; Gau, Michael; Carroll, Patrick; Batista, Enrique R.; Yang, Ping; Gibson, John K.; Schelter, Eric J.
Halide Anion Discrimination by a Tripodal Hydroxylamine Ligand in Gas and Condensed Phases
Physical Chemistry Chemical Physics, 2019
7233370 CIFC33 H49 Cl N4 O3C 1 2/c 124.8659; 15.3224; 20.1555
90; 119.374; 90		6692.1Cheisson, Thibault; Jian, Jiwen; Su, Jing; Eaton, Teresa M.; Gau, Michael; Carroll, Patrick; Batista, Enrique R.; Yang, Ping; Gibson, John K.; Schelter, Eric J.
Halide Anion Discrimination by a Tripodal Hydroxylamine Ligand in Gas and Condensed Phases
Physical Chemistry Chemical Physics, 2019
7233371 CIFC36 H52 Br N4 O3C 1 2/c 129.018; 15.6456; 19.7456
90; 129.451; 90		6922.2Cheisson, Thibault; Jian, Jiwen; Su, Jing; Eaton, Teresa M.; Gau, Michael; Carroll, Patrick; Batista, Enrique R.; Yang, Ping; Gibson, John K.; Schelter, Eric J.
Halide Anion Discrimination by a Tripodal Hydroxylamine Ligand in Gas and Condensed Phases
Physical Chemistry Chemical Physics, 2019
7233372 CIFC35 H51 Br Cl6 N4 O3P 1 21/c 121.169; 12.0506; 16.8977
90; 97.492; 90		4273.8Cheisson, Thibault; Jian, Jiwen; Su, Jing; Eaton, Teresa M.; Gau, Michael; Carroll, Patrick; Batista, Enrique R.; Yang, Ping; Gibson, John K.; Schelter, Eric J.
Halide Anion Discrimination by a Tripodal Hydroxylamine Ligand in Gas and Condensed Phases
Physical Chemistry Chemical Physics, 2019
7233373 CIFC35 H55 Br N4 O4P b c a16.9397; 19.8774; 21.6754
90; 90; 90		7298.5Cheisson, Thibault; Jian, Jiwen; Su, Jing; Eaton, Teresa M.; Gau, Michael; Carroll, Patrick; Batista, Enrique R.; Yang, Ping; Gibson, John K.; Schelter, Eric J.
Halide Anion Discrimination by a Tripodal Hydroxylamine Ligand in Gas and Condensed Phases
Physical Chemistry Chemical Physics, 2019
7233374 CIFC68 H104 I2 N8 O7P 1 21/c 19.8928; 34.9965; 20.5965
90; 90.45; 90		7130.6Cheisson, Thibault; Jian, Jiwen; Su, Jing; Eaton, Teresa M.; Gau, Michael; Carroll, Patrick; Batista, Enrique R.; Yang, Ping; Gibson, John K.; Schelter, Eric J.
Halide Anion Discrimination by a Tripodal Hydroxylamine Ligand in Gas and Condensed Phases
Physical Chemistry Chemical Physics, 2019
7233533 CIFC11 H16 N O4P -15.8474; 8.9093; 11.586
99.477; 93.462; 107.504		563.89Dash, Sibananda G.; Thakur, Tejender S.
Cation∙∙∙Cation Hydrogen Bonds in Synephrine Salts: A Typical Interaction in an Unusual Environment.
Physical Chemistry Chemical Physics, 2019
7233534 CIFC11 H15 N O4P 1 21/c 113.045; 5.6577; 16.169
90; 107.412; 90		1138.7Dash, Sibananda G.; Thakur, Tejender S.
Cation∙∙∙Cation Hydrogen Bonds in Synephrine Salts: A Typical Interaction in an Unusual Environment.
Physical Chemistry Chemical Physics, 2019
7233535 CIFC23 H34 N2 O8C 1 2/c 117.704; 6.2; 21.99
90; 98.751; 90		2385.6Dash, Sibananda G.; Thakur, Tejender S.
Cation∙∙∙Cation Hydrogen Bonds in Synephrine Salts: A Typical Interaction in an Unusual Environment.
Physical Chemistry Chemical Physics, 2019
7233536 CIFC12 H20 N O5C 1 2/c 128.0334; 5.4264; 18.2828
90; 99.968; 90		2739.2Dash, Sibananda G.; Thakur, Tejender S.
Cation∙∙∙Cation Hydrogen Bonds in Synephrine Salts: A Typical Interaction in an Unusual Environment.
Physical Chemistry Chemical Physics, 2019
7233537 CIFC10 H14 N O4P 1 21/c 112.997; 7.236; 12.376
90; 116.81; 90		1038.8Dash, Sibananda G.; Thakur, Tejender S.
Cation∙∙∙Cation Hydrogen Bonds in Synephrine Salts: A Typical Interaction in an Unusual Environment.
Physical Chemistry Chemical Physics, 2019
7233538 CIFC9 H13 N O2P 1 21/n 18.869; 12.103; 9.009
90; 113.4; 90		887.5Dash, Sibananda G.; Thakur, Tejender S.
Cation∙∙∙Cation Hydrogen Bonds in Synephrine Salts: A Typical Interaction in an Unusual Environment.
Physical Chemistry Chemical Physics, 2019
7233539 CIFC12 H20 N O5C 1 2/c 128.333; 5.241; 18.325
90; 100.435; 90		2676.1Dash, Sibananda G.; Thakur, Tejender S.
Cation∙∙∙Cation Hydrogen Bonds in Synephrine Salts: A Typical Interaction in an Unusual Environment.
Physical Chemistry Chemical Physics, 2019
7233540 CIFC11 H15.5 N O4.5P -15.7487; 8.9795; 11.6493
100.209; 90.688; 106.188		567.16Dash, Sibananda G.; Thakur, Tejender S.
Cation∙∙∙Cation Hydrogen Bonds in Synephrine Salts: A Typical Interaction in an Unusual Environment.
Physical Chemistry Chemical Physics, 2019
7233541 CIFC22 H32 N2 O10P -19.5357; 11.1714; 11.4964
89.067; 70.401; 79.552		1133.28Dash, Sibananda G.; Thakur, Tejender S.
Cation∙∙∙Cation Hydrogen Bonds in Synephrine Salts: A Typical Interaction in an Unusual Environment.
Physical Chemistry Chemical Physics, 2019
7233542 CIFC22 H32 N2 O10P 15.6127; 9.3029; 11.6456
101.243; 91.903; 105.888		571.19Dash, Sibananda G.; Thakur, Tejender S.
Cation∙∙∙Cation Hydrogen Bonds in Synephrine Salts: A Typical Interaction in an Unusual Environment.
Physical Chemistry Chemical Physics, 2019
7233543 CIFC13 H18 N O5I 1 2/a 115.4695; 11.6758; 15.9648
90; 112.858; 90		2657.1Dash, Sibananda G.; Thakur, Tejender S.
Cation∙∙∙Cation Hydrogen Bonds in Synephrine Salts: A Typical Interaction in an Unusual Environment.
Physical Chemistry Chemical Physics, 2019
7234232 CIFC22 H16 N4 S6P -13.8415; 7.627; 18.9474
90.79; 90.292; 93.35		554.13Kiyota, Yasuhiro; Jeon, Ie-Rang; Jeannin, olivier; Beau, Maxime; Kawamoto, Tadashi; Alemany, Pere; Canadell, Enric; Mori, Takehiko; Fourmigue, Marc
Electronic engineering of a tetrathiafulvalene charge-transfer salt via reduced symmetry induced by combined substituents
Physical Chemistry Chemical Physics, 2019
7242073 CIFC17 H23 Cl3 N2 O5P -110.0026; 10.14; 10.8176
108.089; 96.421; 92.493		1032.86Connolly, Sean; Tiwari, Rahul; Holder, Simon J.; Shepherd, Helena Jane
A simple strategy to overcome concentration dependence of photoswitching properties in donor-acceptor Stenhouse adducts
Physical Chemistry Chemical Physics, 2021
7242074 CIFC30 H44 N4 O13.5I 1 2/a 118.9606; 14.2438; 25.8792
90; 90.02; 90		6989.22Connolly, Sean; Tiwari, Rahul; Holder, Simon J.; Shepherd, Helena Jane
A simple strategy to overcome concentration dependence of photoswitching properties in donor-acceptor Stenhouse adducts
Physical Chemistry Chemical Physics, 2021
7242075 CIFC16 H30 N2 O9P 1 21/n 114.92326; 8.57252; 15.64663
90; 94.0935; 90		1996.57Connolly, Sean; Tiwari, Rahul; Holder, Simon J.; Shepherd, Helena Jane
A simple strategy to overcome concentration dependence of photoswitching properties in donor-acceptor Stenhouse adducts
Physical Chemistry Chemical Physics, 2021
7242076 CIFC15 H19 N O5P 1 21/n 17.9743; 17.9548; 10.8807
90; 108.121; 90		1480.6Connolly, Sean; Tiwari, Rahul; Holder, Simon J.; Shepherd, Helena Jane
A simple strategy to overcome concentration dependence of photoswitching properties in donor-acceptor Stenhouse adducts
Physical Chemistry Chemical Physics, 2021
7242165 CIFC58 H55 Cl2 Cu2 N9 O4P -112.1101; 15.0255; 15.7251
75.136; 67.643; 87.203		2553.9Velasco, Lucia; Llanos, Leonel; Levin, Pedro; Vega, Andres; Yu, Jin; Zhang, Xiaoyi; Lemus, Luis A.; Aravena, Daniel; Moonshiram, Dooshaye
Structure and Excited-State Dynamics of Dimeric Copper(I) photosensitizers Investigated by Time-resolved X-ray and Optical Transient Absorption Spectroscopy
Physical Chemistry Chemical Physics, 2021
7242258 CIFC27 H39 N3 O9P 1 21/c 113.6976; 15.5866; 28.4803
90; 91.167; 90		6079.25Raynal, Matthieu; Li, Yan; Troufflard, Claire; Przybylski, Cédric; Gontard, Geoffrey; Maistriaux, Thomas; Idé, Julien; Lazzaroni, Roberto; Bouteiller, Laurent; Brocorens, Patrick
Experimental and computational diagnosis of the fluxional nature of a benzene-1,3,5-tricarboxamide-based hydrogen-bonded dimer
Physical Chemistry Chemical Physics, 2021
7242259 CIFC27 H39 N3 O9P a -318.2873; 18.2873; 18.2873
90; 90; 90		6115.74Raynal, Matthieu; Li, Yan; Troufflard, Claire; Przybylski, Cédric; Gontard, Geoffrey; Maistriaux, Thomas; Idé, Julien; Lazzaroni, Roberto; Bouteiller, Laurent; Brocorens, Patrick
Experimental and computational diagnosis of the fluxional nature of a benzene-1,3,5-tricarboxamide-based hydrogen-bonded dimer
Physical Chemistry Chemical Physics, 2021
7242260 CIFC21 H16 N2 O5 SP 1 21/c 114.0149; 7.6562; 18.38
90; 101.242; 90		1934.3Custodio, Jean; d'Oliveira, Giulio Demetrius Creazo; Gotardo, Fernando; Cocca, Leandro; Boni, Leonardo De; Perez, Caridad; Napolitano, Hamilton; Osório, Francisco; Valverde, Clodoaldo
Second-order nonlinear optical properties of two chalcone derivatives: insights from sum-over-states
Physical Chemistry Chemical Physics, 2021
7242414 CIFC34 H42 O8 S2P 1 21/c 122.969; 8.1561; 8.6458
90; 100.575; 90		1592.17Guilbert, Anne A. Y.; Parr, Zachary S.; Kreouzis, Theo; Woods, Duncan J.; Sprick, Reiner Sebastian; Abrahams, I.; Nielsen, Christian; Zbiri, Mohamed
Effect of substituting non-polar chains with polar chains on the structural dynamics of small organic molecule and polymer semiconductors
Physical Chemistry Chemical Physics, 2021
7242513 CIFC12 H10 F3 N3 O4P -17.5763; 8.5961; 10.7211
100.721; 99.964; 91.329		674.59Surov, Artem Olegovich; Voronin, Alexander P.; Drozd, Ksenia V.; Gruzdev, Matvey Sergeevich; Prashanth, Jupally; Balasubramanian, Sridhar; Perlovich, German L.
Polymorphic forms of antiandrogenic drug nilutamide: structural and thermodynamic aspects
Physical Chemistry Chemical Physics, 2021
7242514 CIFC12 H10 F3 N3 O4C 1 2/c 111.1754; 10.0868; 23.6466
90; 101.827; 90		2608.95Surov, Artem Olegovich; Voronin, Alexander P.; Drozd, Ksenia V.; Gruzdev, Matvey Sergeevich; Prashanth, Jupally; Balasubramanian, Sridhar; Perlovich, German L.
Polymorphic forms of antiandrogenic drug nilutamide: structural and thermodynamic aspects
Physical Chemistry Chemical Physics, 2021
7242535 CIFC93 H93 Cl26 Mn6 N15 O28P -3 1 c16.7906; 16.7906; 24.3807
90; 90; 120		5952.6Christou, George; Wernsdorfer, Wolfgang; Ghosh, Tuhin; Abboud, Khalil A.; Marbey, Jonathan; Hill, Stephen
Exchange-biased Quantum Tunnelling of Magnetization in a [Mn3]2 Dimer of Single-Molecule Magnets with Rare Ferromagnetic Inter-Mn3 Coupling
Physical Chemistry Chemical Physics, 2021
7242619 CIFC22 H20 O2 SP 1 21/c 118.7765; 5.7331; 17.6642
90; 107.791; 90		1810.6Yakali, Gul
Examination of Aggregation Induced Enhanced Emission in a Propeller Shaped Chiral- Nonconjugated Blue Emitter from Restricted Intramolecular Rotation and J Type π⋯π Stacking Interactions
Physical Chemistry Chemical Physics, 2021
7242715 CIFC52 H36 N2I b a 218.0128; 27.5447; 7.2185
90; 90; 90		3581.5Sukegawa, Yoshihito; Sato, Kaito; Fujiwara, Wataru; Katagiri, Hiroshi; Yokoyama, Daisuke
Effect of the conformer distribution on the properties of amorphous organic semiconductor films for organic light-emitting diodes
Physical Chemistry Chemical Physics, 2021
7242746 CIFC47 H41 N3 O2C 1 c 131.5211; 14.7867; 33.4555
90; 112.551; 90		14401.1Imrie, Corrie T.; Strachan, Grant James; Harrison, William T.; Storey, John M. D.
Understanding the remarkable difference in liquid crystal behaviour between secondary and tertiary amides: the synthesis and characterisation of new benzanilide-based liquid crystal dimers.
Physical Chemistry Chemical Physics, 2021
7242747 CIFC51 H49 N3 O2P 1 n 121.61054; 13.8187; 28.98487
90; 110.27; 90		8119.7Imrie, Corrie T.; Strachan, Grant James; Harrison, William T.; Storey, John M. D.
Understanding the remarkable difference in liquid crystal behaviour between secondary and tertiary amides: the synthesis and characterisation of new benzanilide-based liquid crystal dimers.
Physical Chemistry Chemical Physics, 2021
7242790 CIFC74 H154 Mo12 N8 O36P -111.5075; 12.0506; 19.3113
76.208; 84.833; 85.902		2586.7Al-Yasari, Ahmed; El Moll, Hani; Purdy, Ryan; Vincent, Kevin B.; Spence, Philip; Malval, Jean-Pierre; Fielden, John
Optical, Third Order Non-Linear Optical and Electrochemical Properties of Dipolar, Centrosymmetric and C2v Organoimido Polyoxometalate Derivatives
Physical Chemistry Chemical Physics, 2021
7242805 CIFC40 H34 Cl8 N4 O6P -18.083; 9.0956; 15.0054
82.8035; 80.0928; 71.2636		1026.25Drozd, Ksenia V.; Manin, Alex N.; Voronin, Alexander P.; Boycov, Denis; Andrei, Churakov; Perlovich, German L.
A combined experimental and theoretical study of miconazole salts and cocrystals: crystal structures, DFT computations, formation thermodynamics and solubility improvement
Physical Chemistry Chemical Physics, 2021
7242806 CIFC22 H18 Cl4 N2 O5P -18.8026; 8.8626; 29.7363
83.6323; 85.5987; 89.666		2298.73Drozd, Ksenia V.; Manin, Alex N.; Voronin, Alexander P.; Boycov, Denis; Andrei, Churakov; Perlovich, German L.
A combined experimental and theoretical study of miconazole salts and cocrystals: crystal structures, DFT computations, formation thermodynamics and solubility improvement
Physical Chemistry Chemical Physics, 2021
7242807 CIFC40 H32 Cl8 N4 O6P -18.1544; 8.9059; 14.8899
81.5113; 81.5921; 70.0821		1000.15Drozd, Ksenia V.; Manin, Alex N.; Voronin, Alexander P.; Boycov, Denis; Andrei, Churakov; Perlovich, German L.
A combined experimental and theoretical study of miconazole salts and cocrystals: crystal structures, DFT computations, formation thermodynamics and solubility improvement
Physical Chemistry Chemical Physics, 2021
7242808 CIFC42 H38 Cl8 N4 O6P -112.6233; 13.3497; 16.0081
103.462; 100.435; 113.091		2298.7Drozd, Ksenia V.; Manin, Alex N.; Voronin, Alexander P.; Boycov, Denis; Andrei, Churakov; Perlovich, German L.
A combined experimental and theoretical study of miconazole salts and cocrystals: crystal structures, DFT computations, formation thermodynamics and solubility improvement
Physical Chemistry Chemical Physics, 2021
7242809 CIFC36 H30 Cl8 N4 O3P 1 21/n 17.9812; 32.6965; 14.5964
90; 91.2751; 90		3808.1Drozd, Ksenia V.; Manin, Alex N.; Voronin, Alexander P.; Boycov, Denis; Andrei, Churakov; Perlovich, German L.
A combined experimental and theoretical study of miconazole salts and cocrystals: crystal structures, DFT computations, formation thermodynamics and solubility improvement
Physical Chemistry Chemical Physics, 2021
7242952 CIFC86 H86 N36 O20P 1 21/c 114.3621; 24.1237; 27.1906
90; 98.023; 90		9328.4Higginbotham, Heather; Maniam, Subashani; Hsia, Tina; Isaacs, Lyle D.; Langford, Steven J.; Bell, Toby D. M.
Self-assembled, optically-active {naphthalene diimide}U{cucurbit[8]uril} ensembles in an aqueous environment
Physical Chemistry Chemical Physics, 2021
7243264 CIFC30 H26 N4 O4P -19.4525; 11.1197; 14.5433
97.639; 108.409; 106.008		1352.99Witte, Felix; Rietsch, Philipp; Nirmalananthan-Budau, Nithiya; Weigert, Florian; Götze, Jan Phillip; Resch-Genger, Ute; Eigler, Siegfried; Paulus, Beate
Aggregation-induced emission leading to two distinct emissive species in the solid-state structure of high-dipole organic chromophores
Physical Chemistry Chemical Physics, 2021
7243365 CIFC60 H56 N8 O12 Zn4I 1 2/a 123.5031; 14.9393; 33.0899
90; 106.97; 90		11112.6Dasgupta, Souradip; Banerjee, Shrobona; Das, Sharmistha; Datta, Anindya
From fluorogen to fluorophore by elucidation and suppression of ultrafast excited state processes of a Schiff base
Physical Chemistry Chemical Physics, 2021
7243366 CIFC54 H56 Cl2 N7 O17 Zn2C 1 2/c 127.9433; 13.2179; 31.7637
90; 107.063; 90		11215.6Dasgupta, Souradip; Banerjee, Shrobona; Das, Sharmistha; Datta, Anindya
From fluorogen to fluorophore by elucidation and suppression of ultrafast excited state processes of a Schiff base
Physical Chemistry Chemical Physics, 2021
7243370 CIFC9 H10 B F2 N O3P 1 21/c 16.5253; 11.9; 13.029
90; 100.248; 90		995.6Wang, Huayi; Schrage, Briana; Takematsu, Kana; Ziegler, Christopher
Photophysical properties of a boron analogue of coumarin
Physical Chemistry Chemical Physics, 2021
7243395 CIFC43 H80 Cr K2 N6 O17P 110.9523; 11.63; 12.6749
63.886; 66.66; 86.853		1316.98Pei, Gerui; Shu, Cong-Cong; Li, Mengyang; Sun, Zhong-Ming; Yang, Tao
Electronic structures and properties of dianionic pentacarbonyls [TM(CO)5]2− (TM = Cr, Mo, W)
Physical Chemistry Chemical Physics, 2021
7243396 CIFC41 H72 K2 Mo N4 O17P 110.884; 11.6242; 12.7269
64.679; 68.734; 88.596		1339.97Pei, Gerui; Shu, Cong-Cong; Li, Mengyang; Sun, Zhong-Ming; Yang, Tao
Electronic structures and properties of dianionic pentacarbonyls [TM(CO)5]2− (TM = Cr, Mo, W)
Physical Chemistry Chemical Physics, 2021
7243496 CIFC16 H11 N O2C 1 c 152.556; 3.8744; 24.2104
90; 103.315; 90		4797.3Ikeda, Kazuho; Yoo, Dongho; Nishikawa, Ryu; Kawamoto, Tadashi; Mori, Takehiko
Charge injected proton transfer in indigo derivatives
Physical Chemistry Chemical Physics, 2021
7243523 CIFC84 H54 N16 O6 S3R -3 :H21.023; 21.023; 30.595
90; 90; 120		11710.4Ripoche, Nicolas; Betou, Marie; Philippe, Clotilde; Trolez, Yann; Mongin, Olivier; Dudek, Marta; Pokladek, Ziemowit; Matczyszyn, Katarzyna; Samoc, Marek; Sahnoune, Hiba; Halet, Jean-François; Roisnel, Thierry; Toupet, Loic; Cordier, Marie; Moxey, Graeme; Humphrey, Mark G.; Paul, Frédéric
Two-Photon Absorption Properties of Multipolar Triarylamino/ Tosylamido 1,1,4,4-Tetracyanobutadienes
Physical Chemistry Chemical Physics, 2021
7243524 CIFC34 H15 N9P 1 2/a 110.7358; 9.7979; 13.1395
90; 93.928; 90		1378.87Ripoche, Nicolas; Betou, Marie; Philippe, Clotilde; Trolez, Yann; Mongin, Olivier; Dudek, Marta; Pokladek, Ziemowit; Matczyszyn, Katarzyna; Samoc, Marek; Sahnoune, Hiba; Halet, Jean-François; Roisnel, Thierry; Toupet, Loic; Cordier, Marie; Moxey, Graeme; Humphrey, Mark G.; Paul, Frédéric
Two-Photon Absorption Properties of Multipolar Triarylamino/ Tosylamido 1,1,4,4-Tetracyanobutadienes
Physical Chemistry Chemical Physics, 2021
7243525 CIFC77 H76 N10 O4 S2P -112.2334; 16.0882; 18.7919
107.984; 97.849; 90.566		3479.5Ripoche, Nicolas; Betou, Marie; Philippe, Clotilde; Trolez, Yann; Mongin, Olivier; Dudek, Marta; Pokladek, Ziemowit; Matczyszyn, Katarzyna; Samoc, Marek; Sahnoune, Hiba; Halet, Jean-François; Roisnel, Thierry; Toupet, Loic; Cordier, Marie; Moxey, Graeme; Humphrey, Mark G.; Paul, Frédéric
Two-Photon Absorption Properties of Multipolar Triarylamino/ Tosylamido 1,1,4,4-Tetracyanobutadienes
Physical Chemistry Chemical Physics, 2021
7243527 CIFC17 H33 F6 Mo N4 O3 PP b c a17.1434; 14.9459; 18.1606
90; 90; 90		4653.2Gessner, Niklas; Bäck, Anna Karina; Knorr, Johannes; Nagel, Christoph; Marquetand, Philipp; Schatzschneider, Ulrich; González, Leticia; Nuernberger, Patrick
Ultrafast Photochemistry of a Molybdenum Carbonyl-Nitrosyl Complex with a Triazacyclononane Coligand
Physical Chemistry Chemical Physics, 2021
7243614 CIFC30 H19 P S6 SeP -18.8726; 12.5498; 25.9772
92.616; 97.874; 100.725		2807.7Yang, Zi; Zhang, Zhikai; Xue, CeCe; Yang, Kai; Gao, Rong; Yu, Na; Ren, Yi
Excited-State Engineering of Oligothiophenes via Phosphorus Chemistry towards Strong Fluorescent Materials
Physical Chemistry Chemical Physics, 2021
7243726 CIFC45 H38 Br2 N7 O2 S0.5P 1 21/c 115.8195; 4.6302; 26.812
90; 100.182; 90		1933Islam, Md Faizul; Sindt, Ammon J.; Hossain, Muhammad Saddam; Ayare, Pooja J.; Smith, Mark D.; Vannucci, Aaron K.; Garashchuk, Sophya; Shimizu, Linda S.
Assembled triphenylamine bis-urea macrocycles: Exploring photodriven electron transfer from host to guests.
Physical Chemistry Chemical Physics, 2021
7243727 CIFC43.88 H36.62 Br2 Cl0.62 N6 O2.62P 1 21/c 115.782; 4.6143; 26.78
90; 100.354; 90		1918.4Islam, Md Faizul; Sindt, Ammon J.; Hossain, Muhammad Saddam; Ayare, Pooja J.; Smith, Mark D.; Vannucci, Aaron K.; Garashchuk, Sophya; Shimizu, Linda S.
Assembled triphenylamine bis-urea macrocycles: Exploring photodriven electron transfer from host to guests.
Physical Chemistry Chemical Physics, 2021
7243728 CIFC42 H36 Br2 I0.69 N6 O2P 1 21/c 115.871; 4.6048; 26.839
90; 100.177; 90		1930.6Islam, Md Faizul; Sindt, Ammon J.; Hossain, Muhammad Saddam; Ayare, Pooja J.; Smith, Mark D.; Vannucci, Aaron K.; Garashchuk, Sophya; Shimizu, Linda S.
Assembled triphenylamine bis-urea macrocycles: Exploring photodriven electron transfer from host to guests.
Physical Chemistry Chemical Physics, 2021
7243742 CIFC54 H62 Cl6 F6 Ir N6 O4 PC 1 2/c 119.554; 22.055; 15.394
90; 117.07; 90		5912Martínez-Vollbert, Emiliano; Philouze, Christian; Gautier-Luneau, Isabelle; Moreau, Yohann; Lanoë, Pierre-Henri; Loiseau, Frederique
Study of a phosphorescent cationic iridium(III) complex displaying blue shift in crystals
Physical Chemistry Chemical Physics, 2021
7243834 CIFC30 H49 N5 O4P 17.1986; 7.591; 28.718
84.702; 89.324; 80.32		1540.3Polacchi, Luca; Brosseau, Arnaud; Guillot, Régis; Métivier, Rémi; Allain, Clémence
Enhanced mechano-responsive fluorescence in polydiacetylene thin films through functionalization with tetrazine dyes: photopolymerization, energy transfer and AFM coupled to fluorescence microscopy studies
Physical Chemistry Chemical Physics, 2021
7243845 CIFC32 H63 N O3P c a 218.7755; 4.8774; 72.679
90; 90; 90		3110.8Reddy, Soudherpally Thirupathi; Sivaramakrishna, Dokku; Mamatha, Keerthi; Sharma, Manju; Swamy, Musti J.
Packing polymorphism, odd–even alternation and thermotropic phase transitions in N-,O-diacylethanolamines with varying N-acyl chains. A combined experimental and computational study
Physical Chemistry Chemical Physics, 2021
7243846 CIFC29 H55 N O3C 1 2/c 1135.24; 4.8798; 8.7392
90; 91.27; 90		5766Reddy, Soudherpally Thirupathi; Sivaramakrishna, Dokku; Mamatha, Keerthi; Sharma, Manju; Swamy, Musti J.
Packing polymorphism, odd–even alternation and thermotropic phase transitions in N-,O-diacylethanolamines with varying N-acyl chains. A combined experimental and computational study
Physical Chemistry Chemical Physics, 2021
7243847 CIFC31 H61 N O3C 1 2/c 1144.31; 4.888; 8.748
90; 91.444; 90		6169Reddy, Soudherpally Thirupathi; Sivaramakrishna, Dokku; Mamatha, Keerthi; Sharma, Manju; Swamy, Musti J.
Packing polymorphism, odd–even alternation and thermotropic phase transitions in N-,O-diacylethanolamines with varying N-acyl chains. A combined experimental and computational study
Physical Chemistry Chemical Physics, 2021
7243848 CIFC2 H3.93 N0.07 O0.2P 1 21/c 168.97; 4.852; 8.906
90; 92.787; 90		2977Reddy, Soudherpally Thirupathi; Sivaramakrishna, Dokku; Mamatha, Keerthi; Sharma, Manju; Swamy, Musti J.
Packing polymorphism, odd–even alternation and thermotropic phase transitions in N-,O-diacylethanolamines with varying N-acyl chains. A combined experimental and computational study
Physical Chemistry Chemical Physics, 2021
7243849 CIFC31 H60 N O3C 1 2/c 1143.4; 4.8764; 8.7342
90; 91.137; 90		6106.4Reddy, Soudherpally Thirupathi; Sivaramakrishna, Dokku; Mamatha, Keerthi; Sharma, Manju; Swamy, Musti J.
Packing polymorphism, odd–even alternation and thermotropic phase transitions in N-,O-diacylethanolamines with varying N-acyl chains. A combined experimental and computational study
Physical Chemistry Chemical Physics, 2021

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