Crystallography Open Database

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Searching journal of publication like 'The Journal of Physical Chemistry C' volume of publication is 119

COD ID: 1518454
CIF file Formula: - C11 H18 N8 O3 -
Comments: Gryl, Marlena; Cenedese, Simone; Stadnicka, Katarzyna Crystal Engineering and Charge Density Study of Pharmaceutical Nonlinear Optical Material: Melamine-Barbital Co-Crystal The Journal of Physical Chemistry C 119(1) (2015) 590
Space group: P m n 21
Cell volume: 753.12
Cell parameters: 9.5289; 9.1191; 8.667; 90; 90; 90;  

COD ID: 1518776
CIF file Formula: - C12 H18 F12 N3 Na O9 S4 -
Comments: Giffin, Guinevere A.; Tannert, Jens; Jeong, Sangsik; Uhl, Werner; Passerini, Stefano Crystalline Complexes of Pyr12O1TFSI-Based Ionic Liquid Electrolytes The Journal of Physical Chemistry C 119(11) (2015) 5878
Space group: P 1 21/n 1
Cell volume: 2608
Cell parameters: 11.703; 10.8732; 20.5169; 90; 92.636; 90;  

COD ID: 1518777
CIF file Formula: - C28 H36 F36 Mg2 N8 O26 S12 -
Comments: Giffin, Guinevere A.; Tannert, Jens; Jeong, Sangsik; Uhl, Werner; Passerini, Stefano Crystalline Complexes of Pyr12O1TFSI-Based Ionic Liquid Electrolytes The Journal of Physical Chemistry C 119(11) (2015) 5878
Space group: P 1
Cell volume: 1765.86
Cell parameters: 11.4359; 12.0538; 13.8956; 69.152; 82.96; 81.651;  

COD ID: 1518890
CIF file Formula: - Mo7.62 O29.23 V2.38 -
Comments: Ishikawa, Satoshi; Kobayashi, Daichi; Konya, Takeshi; Ohmura, Shunpei; Murayama, Toru; Yasuda, Nobuhiro; Sadakane, Masahiro; Ueda, Wataru Redox Treatment of Orthorhombic Mo29V11O112and Relationships between Crystal Structure, Microporosity and Catalytic Performance for Selective Oxidation of Ethane The Journal of Physical Chemistry C 119(13) (2015) 7195
Space group: P b a 2
Cell volume: 2209.46
Cell parameters: 20.9864; 26.4023; 3.98755; 90; 90; 90;  

COD ID: 1519661
CIF file Formula: - Li0.9 S2 Ti -
Comments: Wiedemann, Dennis; Islam, Mazharul M.; Nakhal, Suliman; Senyshyn, Anatoliy; Bredow, Thomas; Lerch, Martin Lithium Diffusion Pathways in 3R-LixTiS2: A Combined Neutron Diffraction and Computational Study The Journal of Physical Chemistry C 119(21) (2015) 11370
Space group: R -3 m :H
Cell volume: 200.967
Cell parameters: 3.53131; 3.53131; 18.609; 90; 90; 120;  

COD ID: 1519662
CIF file Formula: - Li0.7 S2 Ti -
Comments: Wiedemann, Dennis; Islam, Mazharul M.; Nakhal, Suliman; Senyshyn, Anatoliy; Bredow, Thomas; Lerch, Martin Lithium Diffusion Pathways in 3R-LixTiS2: A Combined Neutron Diffraction and Computational Study The Journal of Physical Chemistry C 119(21) (2015) 11370
Space group: R -3 m :H
Cell volume: 197.741
Cell parameters: 3.49902; 3.49902; 18.6498; 90; 90; 120;  

COD ID: 1519663
CIF file Formula: - Li0.9 S2 Ti -
Comments: Wiedemann, Dennis; Islam, Mazharul M.; Nakhal, Suliman; Senyshyn, Anatoliy; Bredow, Thomas; Lerch, Martin Lithium Diffusion Pathways in 3R-LixTiS2: A Combined Neutron Diffraction and Computational Study The Journal of Physical Chemistry C 119(21) (2015) 11370
Space group: R -3 m :H
Cell volume: 199.3
Cell parameters: 3.52138; 3.52138; 18.5588; 90; 90; 120;  

COD ID: 1519664
CIF file Formula: - Li0.7 S2 Ti -
Comments: Wiedemann, Dennis; Islam, Mazharul M.; Nakhal, Suliman; Senyshyn, Anatoliy; Bredow, Thomas; Lerch, Martin Lithium Diffusion Pathways in 3R-LixTiS2: A Combined Neutron Diffraction and Computational Study The Journal of Physical Chemistry C 119(21) (2015) 11370
Space group: R -3 m :H
Cell volume: 197.499
Cell parameters: 3.49658; 3.49658; 18.6529; 90; 90; 120;  

COD ID: 1520063
CIF file Formula: - C4 H2 N10 O6 -
Comments: Zhang, Jiaheng; Shreeve, Jean’ne M. Nitroaminofurazans with Azo and Azoxy Linkages: A Comparative Study of Structural, Electronic, Physicochemical, and Energetic Properties The Journal of Physical Chemistry C 119(23) (2015) 12887
Space group: P 1 21/c 1
Cell volume: 485.52
Cell parameters: 5.6265; 9.1195; 9.5532; 90; 97.913; 90;  

COD ID: 1520064
CIF file Formula: - C4 H2 N10 O7 -
Comments: Zhang, Jiaheng; Shreeve, Jean’ne M. Nitroaminofurazans with Azo and Azoxy Linkages: A Comparative Study of Structural, Electronic, Physicochemical, and Energetic Properties The Journal of Physical Chemistry C 119(23) (2015) 12887
Space group: P 1 n 1
Cell volume: 496.9
Cell parameters: 7.8; 8.2; 8.6; 90; 115.4; 90;  

COD ID: 1520296
CIF file Formula: - B0.6 La10 N1.4 O24.6 Si5.4 -
Comments: Xia, Zhiguo; Molokeev, Maxim S.; Im, Won Bin; Unithrattil, Sanjith; Liu, Quanlin Crystal Structure and Photoluminescence Evolution of La5(Si2+xB1‒x)(O13‒xNx):Ce3+Solid Solution Phosphors The Journal of Physical Chemistry C 119(17) (2015) 9488
Space group: P 63/m
Cell volume: 581.75
Cell parameters: 9.66584; 9.66584; 7.19; 90; 90; 120;  

COD ID: 1529074
CIF file Formula: - C18 H18 F2 N O4 V -
Comments: Choing, Stephanie N.; Francis, Aaron J.; Clendenning, Graham; Schuurman, Michael S.; Sommer, Roger D.; Tamblyn, Isaac; Weare, Walter W.; Cuk, Tanja Long-Lived LMCT in a d0Vanadium(V) Complex by Internal Conversion to a State of 3dxyCharacter The Journal of Physical Chemistry C 119(30) (2015) 17029
Space group: P 1 21/n 1
Cell volume: 3437.67
Cell parameters: 17.7691; 7.9596; 25.4492; 90; 107.241; 90;  

COD ID: 1529460
CIF file Formula: - Ba3 O8 P2 -
Comments: Haipeng Ji; Zhaohui Huang; Zhiguo Xia; Maxim S. Molokeev; Victor V. Atuchin; Minghao Fang; Yangai Liu Discovery of New Solid Solution Phosphors via Cation Substitution-Dependent Phase Transition in M3(PO4)2:Eu2+ (M = Ca/Sr/Ba) Quasi-Binary Sets The Journal of Physical Chemistry C 119 (2015) 2038-2045
Space group: R -3 m :H
Cell volume: 570.39
Cell parameters: 5.6019; 5.6019; 20.9878; 90; 90; 120;  

COD ID: 1529461
CIF file Formula: - Ba0.81 O4 P Sr0.69 -
Comments: Haipeng Ji; Zhaohui Huang; Zhiguo Xia; Maxim S. Molokeev; Victor V. Atuchin; Minghao Fang; Yangai Liu Discovery of New Solid Solution Phosphors via Cation Substitution-Dependent Phase Transition in M3(PO4)2:Eu2+ (M = Ca/Sr/Ba) Quasi-Binary Sets The Journal of Physical Chemistry C 119 (2015) 2038-2045
Space group: R -3 m :H
Cell volume: 549.09
Cell parameters: 5.54011; 5.54011; 20.6573; 90; 90; 120;  

COD ID: 1529462
CIF file Formula: - Ba1.16 O12 P3 Sr3.34 -
Comments: Haipeng Ji; Zhaohui Huang; Zhiguo Xia; Maxim S. Molokeev; Victor V. Atuchin; Minghao Fang; Yangai Liu Discovery of New Solid Solution Phosphors via Cation Substitution-Dependent Phase Transition in M3(PO4)2:Eu2+ (M = Ca/Sr/Ba) Quasi-Binary Sets The Journal of Physical Chemistry C 119 (2015) 2038-2045
Space group: R -3 m :H
Cell volume: 523.023
Cell parameters: 5.46471; 5.46471; 20.22347; 90; 90; 120;  

COD ID: 1529463
CIF file

HKL data

 Formula: - O8 P2 Sr3 -
Comments: Haipeng Ji; Zhaohui Huang; Zhiguo Xia; Maxim S. Molokeev; Victor V. Atuchin; Minghao Fang; Yangai Liu Discovery of New Solid Solution Phosphors via Cation Substitution-Dependent Phase Transition in M3(PO4)2:Eu2+ (M = Ca/Sr/Ba) Quasi-Binary Sets The Journal of Physical Chemistry C 119 (2015) 2038-2045
Space group: R -3 m :H
Cell volume: 497.443
Cell parameters: 5.387993; 5.387993; 19.78604; 90; 90; 120;  

COD ID: 1529464
CIF file

HKL data

 Formula: - Ca0.5 O4 P Sr1.05 -
Comments: Haipeng Ji; Zhaohui Huang; Zhiguo Xia; Maxim S. Molokeev; Victor V. Atuchin; Minghao Fang; Yangai Liu Discovery of New Solid Solution Phosphors via Cation Substitution-Dependent Phase Transition in M3(PO4)2:Eu2+ (M = Ca/Sr/Ba) Quasi-Binary Sets The Journal of Physical Chemistry C 119 (2015) 2038-2045
Space group: R 3 c :H
Cell volume: 3842.54
Cell parameters: 10.66855; 10.66855; 38.9832; 90; 90; 120;  

COD ID: 1529465
CIF file

HKL data

 Formula: - Ca O4 P Sr0.43 -
Comments: Haipeng Ji; Zhaohui Huang; Zhiguo Xia; Maxim S. Molokeev; Victor V. Atuchin; Minghao Fang; Yangai Liu Discovery of New Solid Solution Phosphors via Cation Substitution-Dependent Phase Transition in M3(PO4)2:Eu2+ (M = Ca/Sr/Ba) Quasi-Binary Sets The Journal of Physical Chemistry C 119 (2015) 2038-2045
Space group: R 3 c :H
Cell volume: 3678.1
Cell parameters: 10.56198; 10.56198; 38.0712; 90; 90; 120;  

COD ID: 1529466
CIF file

HKL data

 Formula: - Ca11 O28 P7 -
Comments: Haipeng Ji; Zhaohui Huang; Zhiguo Xia; Maxim S. Molokeev; Victor V. Atuchin; Minghao Fang; Yangai Liu Discovery of New Solid Solution Phosphors via Cation Substitution-Dependent Phase Transition in M3(PO4)2:Eu2+ (M = Ca/Sr/Ba) Quasi-Binary Sets The Journal of Physical Chemistry C 119 (2015) 2038-2045
Space group: R 3 c :H
Cell volume: 3533.14
Cell parameters: 10.4414; 10.4414; 37.4208; 90; 90; 120;  

COD ID: 1529489
CIF file

HKL data

 Formula: - B La5 O13 Si2 -
Comments: Zhiguo Xia; Maxim S. Molokeev; Won Bin Im; Sanjith Unithrattil; Quanlin Liu Crystal Structure and Photoluminescence Evolution of La5(Si2+xB1-x)(O13-xNx):Ce3+ Solid Solution Phosphors The Journal of Physical Chemistry C 119(17) (2015) 9488-9495
Space group: P 63/m
Cell volume: 570.17
Cell parameters: 9.55299; 9.55299; 7.21426; 90; 90; 120;  

COD ID: 1529490
CIF file

HKL data

 Formula: - La5 N O12 Si3 -
Comments: Zhiguo Xia; Maxim S. Molokeev; Won Bin Im; Sanjith Unithrattil; Quanlin Liu Crystal Structure and Photoluminescence Evolution of La5(Si2+xB1-x)(O13-xNx):Ce3+ Solid Solution Phosphors The Journal of Physical Chemistry C 119(17) (2015) 9488-9495
Space group: P 63/m
Cell volume: 587.29
Cell parameters: 9.71207; 9.71207; 7.18946; 90; 90; 120;  

COD ID: 1554053
CIF file Formula: - C20 H17 N O2 -
Comments: Hariharan, P. S.; Venkataramanan, N. S.; Moon, Dohyun; Anthony, Savarimuthu Philip Self-Reversible Mechanochromism and Thermochromism of a Triphenylamine-Based Molecule: Tunable Fluorescence and Nanofabrication Studies The Journal of Physical Chemistry C 119(17) (2015) 9460
Space group: P 1 21/c 1
Cell volume: 1585.5
Cell parameters: 10.194; 11.472; 13.683; 90; 97.76; 90;  

COD ID: 1554054
CIF file Formula: - C8 H18 F6 Li O4 P -
Comments: Han, Sang-Don; Yun, Sung-Hyun; Borodin, Oleg; Seo, Daniel M.; Sommer, Roger D.; Young, Victor G.; Henderson, Wesley A. Solvate Structures and Computational/Spectroscopic Characterization of LiPF6 Electrolytes The Journal of Physical Chemistry C 119(16) (2015) 8492
Space group: P 1 21/n 1
Cell volume: 1406.8
Cell parameters: 6.1967; 12.558; 18.169; 90; 95.745; 90;  

COD ID: 1554055
CIF file Formula: - C5 H10 F3 Li0.5 O3 P0.5 -
Comments: Han, Sang-Don; Yun, Sung-Hyun; Borodin, Oleg; Seo, Daniel M.; Sommer, Roger D.; Young, Victor G.; Henderson, Wesley A. Solvate Structures and Computational/Spectroscopic Characterization of LiPF6 Electrolytes The Journal of Physical Chemistry C 119(16) (2015) 8492
Space group: P n m a
Cell volume: 1789.5
Cell parameters: 9.5125; 21.8997; 8.5903; 90; 90; 90;  

COD ID: 1554056
CIF file Formula: - C60 H80 N2 O4 -
Comments: Kotwica, Kamil; Bujak, Piotr; Wamil, Damian; Pieczonka, Adam; Wiosna-Salyga, Gabriela; Gunka, Piotr A.; Jaroch, Tomasz; Nowakowski, Robert; Luszczynska, Beata; Witkowska, Ewelina; Glowacki, Ireneusz; Ulanski, Jacek; Zagorska, Malgorzata; Pron, Adam Structural, Spectroscopic, Electrochemical, and Electroluminescent Properties of Tetraalkoxydinaphthophenazines: New Solution-Processable Nonlinear Azaacenes The Journal of Physical Chemistry C 119(19) (2015) 10700
Space group: P -1
Cell volume: 2513.57
Cell parameters: 9.93781; 15.1528; 17.8125; 69.7564; 88.9555; 87.1772;  

COD ID: 1554057
CIF file Formula: - C68 H96 N2 O4 -
Comments: Kotwica, Kamil; Bujak, Piotr; Wamil, Damian; Pieczonka, Adam; Wiosna-Salyga, Gabriela; Gunka, Piotr A.; Jaroch, Tomasz; Nowakowski, Robert; Luszczynska, Beata; Witkowska, Ewelina; Glowacki, Ireneusz; Ulanski, Jacek; Zagorska, Malgorzata; Pron, Adam Structural, Spectroscopic, Electrochemical, and Electroluminescent Properties of Tetraalkoxydinaphthophenazines: New Solution-Processable Nonlinear Azaacenes The Journal of Physical Chemistry C 119(19) (2015) 10700
Space group: P -1
Cell volume: 2874.1
Cell parameters: 9.8574; 17.6322; 17.7861; 68.547; 87.477; 89.776;  

COD ID: 1554058
CIF file Formula: - C12 H18 N4 O -
Comments: Jeeva, Mani; Prabhu, G. Venkatesa; Boobalan, Maria susai; Rajesh, Chinnaiyan Mahalingam Interactions and Inhibition Effect of Urea-Derived Mannich Bases on a Mild Steel Surface in HCl The Journal of Physical Chemistry C 119(38) (2015) 22025
Space group: F d d 2
Cell volume: 5180.8
Cell parameters: 12.663; 33.528; 12.2027; 90; 90; 90;  

COD ID: 1554059
CIF file Formula: - C11 H16 N4 O2 -
Comments: Jeeva, Mani; Prabhu, G. Venkatesa; Boobalan, Maria susai; Rajesh, Chinnaiyan Mahalingam Interactions and Inhibition Effect of Urea-Derived Mannich Bases on a Mild Steel Surface in HCl The Journal of Physical Chemistry C 119(38) (2015) 22025
Space group: F d d 2
Cell volume: 4972.4
Cell parameters: 12.2079; 34.449; 11.8236; 90; 90; 90;  

COD ID: 1554060
CIF file Formula: - C25 H13 F6 I6 O P -
Comments: Xu, Yijue; Viger-Gravel, Jasmine; Korobkov, Ilia; Bryce, David L. Mechanochemical Production of Halogen-Bonded Solids Featuring P═O···I‒C Motifs and Characterization via X-ray Diffraction, Solid-State Multinuclear Magnetic Resonance, and Density Functional Theory The Journal of Physical Chemistry C 119(48) (2015) 27104
Space group: P 1 21/n 1
Cell volume: 3135.15
Cell parameters: 8.4758; 44.7106; 9.2023; 90; 115.97; 90;  

COD ID: 1554061
CIF file Formula: - C30 H15 F8 I4 O P -
Comments: Xu, Yijue; Viger-Gravel, Jasmine; Korobkov, Ilia; Bryce, David L. Mechanochemical Production of Halogen-Bonded Solids Featuring P═O···I‒C Motifs and Characterization via X-ray Diffraction, Solid-State Multinuclear Magnetic Resonance, and Density Functional Theory The Journal of Physical Chemistry C 119(48) (2015) 27104
Space group: P -1
Cell volume: 1606.12
Cell parameters: 8.6823; 12.8395; 15.127; 90.4885; 97.5416; 105.886;  

COD ID: 1554062
CIF file Formula: - C24 H15 F3 I3 O P -
Comments: Xu, Yijue; Viger-Gravel, Jasmine; Korobkov, Ilia; Bryce, David L. Mechanochemical Production of Halogen-Bonded Solids Featuring P═O···I‒C Motifs and Characterization via X-ray Diffraction, Solid-State Multinuclear Magnetic Resonance, and Density Functional Theory The Journal of Physical Chemistry C 119(48) (2015) 27104
Space group: P -1
Cell volume: 1198.74
Cell parameters: 9.7436; 10.7585; 13.5453; 113.174; 96.9048; 107.42;  

COD ID: 1554063
CIF file Formula: - C21 H16 F4 I2 N O P -
Comments: Xu, Yijue; Viger-Gravel, Jasmine; Korobkov, Ilia; Bryce, David L. Mechanochemical Production of Halogen-Bonded Solids Featuring P═O···I‒C Motifs and Characterization via X-ray Diffraction, Solid-State Multinuclear Magnetic Resonance, and Density Functional Theory The Journal of Physical Chemistry C 119(48) (2015) 27104
Space group: P n m a
Cell volume: 2307.3
Cell parameters: 21.9816; 18.0739; 5.8075; 90; 90; 90;  

COD ID: 1554064
CIF file Formula: - C30 H15 F8 I4 O P -
Comments: Xu, Yijue; Viger-Gravel, Jasmine; Korobkov, Ilia; Bryce, David L. Mechanochemical Production of Halogen-Bonded Solids Featuring P═O···I‒C Motifs and Characterization via X-ray Diffraction, Solid-State Multinuclear Magnetic Resonance, and Density Functional Theory The Journal of Physical Chemistry C 119(48) (2015) 27104
Space group: P 1 21/c 1
Cell volume: 3175.1
Cell parameters: 9.319; 25.4268; 13.8063; 90; 103.942; 90;  


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