Crystallography Open Database
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Searching journal of publication like 'The journal of physical chemistry. A'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
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1501669 | CIF | C97 H69 Cl5 N4 O4 Sn | P 1 21/n 1 | 25.106; 16.854; 37.347 90; 92.653; 90 | 15786 | Yokoyama, Atsutoshi; Kojima, Takahiko; Ohkubo, Kei; Shiro, Motoo; Fukuzumi, Shunichi Formation of a hybrid compound composed of a saddle-distorted Tin(IV)-porphyrin and a Keggin-type heteropolyoxometalate to undergo intramolecular photoinduced electron transfer. The journal of physical chemistry. A, 2011, 115, 986-997 |
1501670 | CIF | C100 H80 N4 O8 Sn | P -1 | 11.4345; 12.6971; 14.1793 103.943; 101.911; 93.6347 | 1941.03 | Yokoyama, Atsutoshi; Kojima, Takahiko; Ohkubo, Kei; Shiro, Motoo; Fukuzumi, Shunichi Formation of a hybrid compound composed of a saddle-distorted Tin(IV)-porphyrin and a Keggin-type heteropolyoxometalate to undergo intramolecular photoinduced electron transfer. The journal of physical chemistry. A, 2011, 115, 986-997 |
1501699 | CIF | C36 H42 N O4 Sb | P 1 21/n 1 | 13.5746; 15.9506; 15.0855 90; 97.841; 90 | 3235.8 | Fukin, Georgy K.; Baranov, Evgenii V.; Jelsch, Christian; Guillot, Benoît; Poddel'sky, Andrey I.; Cherkasov, Vladimir K.; Abakumov, Gleb A. Experimental and theoretical investigation of topological and energetic characteristics of Sb complexes reversibly binding molecular oxygen. The journal of physical chemistry. A, 2011, 115, 8271-8281 |
1501700 | CIF | C37 H45 N2 O3 Sb | P -1 | 10.0526; 11.8361; 14.5638 88.56; 82.17; 68.61 | 1597.88 | Fukin, Georgy K.; Baranov, Evgenii V.; Jelsch, Christian; Guillot, Benoît; Poddel'sky, Andrey I.; Cherkasov, Vladimir K.; Abakumov, Gleb A. Experimental and theoretical investigation of topological and energetic characteristics of Sb complexes reversibly binding molecular oxygen. The journal of physical chemistry. A, 2011, 115, 8271-8281 |
1501701 | CIF | C46 H58 N8 O6 Si7 | P 1 21/n 1 | 9.3149; 26.6012; 11.3777 90; 111.083; 90 | 2630.5 | Yang, Yang; Samas, Brian; Kennedy, Vance O.; Macikenas, Dainius; Chaloux, Brian L.; Miller, Jacob A.; Speer, Jr, Richard L; Protasiewicz, John; Pinkerton, A. Alan; Kenney, Malcolm E. Long, directional interactions in cofacial silicon phthalocyanine oligomers. The journal of physical chemistry. A, 2011, 115, 12474-12485 |
1501702 | CIF | C78 H74 N16 O7 Si8 | P 1 21/n 1 | 13.1488; 22.8889; 27.0083 90; 99.438; 90 | 8018.4 | Yang, Yang; Samas, Brian; Kennedy, Vance O.; Macikenas, Dainius; Chaloux, Brian L.; Miller, Jacob A.; Speer, Jr, Richard L; Protasiewicz, John; Pinkerton, A. Alan; Kenney, Malcolm E. Long, directional interactions in cofacial silicon phthalocyanine oligomers. The journal of physical chemistry. A, 2011, 115, 12474-12485 |
1501703 | CIF | C110 H90 N24 O8 Si9 | P -1 | 13.421; 14.371; 14.662 85.17; 68.66; 83.53 | 2614 | Yang, Yang; Samas, Brian; Kennedy, Vance O.; Macikenas, Dainius; Chaloux, Brian L.; Miller, Jacob A.; Speer, Jr, Richard L; Protasiewicz, John; Pinkerton, A. Alan; Kenney, Malcolm E. Long, directional interactions in cofacial silicon phthalocyanine oligomers. The journal of physical chemistry. A, 2011, 115, 12474-12485 |
1501704 | CIF | C149 H114 N32 O9 Si10 | P 1 21/n 1 | 13.6979; 26.0454; 36.932 90; 94.737; 90 | 13131.1 | Yang, Yang; Samas, Brian; Kennedy, Vance O.; Macikenas, Dainius; Chaloux, Brian L.; Miller, Jacob A.; Speer, Jr, Richard L; Protasiewicz, John; Pinkerton, A. Alan; Kenney, Malcolm E. Long, directional interactions in cofacial silicon phthalocyanine oligomers. The journal of physical chemistry. A, 2011, 115, 12474-12485 |
1501705 | CIF | C50 H42 N4 O4 | P 1 21/c 1 | 14.214; 20.356; 13.807 90; 106.48; 90 | 3830.8 | Mutoh, Katsuya; Abe, Jiro Comprehensive understanding of structure- photosensitivity relationships of photochromic [2.2]paracyclophane-bridged imidazole dimers. The journal of physical chemistry. A, 2011, 115, 4650-4656 |
1501706 | CIF | C52 H44 Cl6 N4 O4 | P -1 | 12.8243; 13.389; 15.859 79.107; 75.49; 63.12 | 2342.3 | Mutoh, Katsuya; Abe, Jiro Comprehensive understanding of structure- photosensitivity relationships of photochromic [2.2]paracyclophane-bridged imidazole dimers. The journal of physical chemistry. A, 2011, 115, 4650-4656 |
1501708 | CIF | C10 H13 N3 O2 S | P b c a | 11.0859; 13.0805; 15.8132 90; 90; 90 | 2293.06 | Farrugia, Louis J.; Khalaji, Aliakbar Dehno Evidence for side-chain π-delocalization in a planar substituted benzene: an experimental and theoretical charge density study on 2,5-dimethoxybenzaldehyde thiosemicarbazone. The journal of physical chemistry. A, 2011, 115, 12512-12522 |
1501709 | CIF | C16 H18 Cl2 N4 O11 | P 1 21/c 1 | 16.8233; 6.6778; 18.9912 90; 101.312; 90 | 2092.07 | Hao, Erhong; Meng, Ting; Zhang, Min; Pang, Weidong; Zhou, Yunyou; Jiao, Lijuan Solvent dependent fluorescent properties of a 1,2,3-triazole linked 8-hydroxyquinoline chemosensor: tunable detection from zinc(II) to iron(III) in the CH3CN/H2O system. The journal of physical chemistry. A, 2011, 115, 8234-8241 |
1501719 | CIF | C42 H23 B F24 N2 | P 1 21/n 1 | 13.1238; 18.615; 18.123 90; 100.884; 90 | 4347.8 | Kong, S.; Borissova, A. O.; Lesnichin, S. B.; Hartl, M.; Daemen, L. L.; Eckert, J.; Antipin, M. Yu; Shenderovich, I. G. Geometry and spectral properties of the protonated homodimer of pyridine in the liquid and solid states. A combined NMR, X-ray diffraction and inelastic neutron scattering study. The journal of physical chemistry. A, 2011, 115, 8041-8048 |
1501720 | CIF | C28 H23 N O2 | P 1 21/c 1 | 11.7245; 11.2382; 32.084 90; 100.429; 90 | 4157.6 | Chudomel, J. Matthew; Yang, Boqian; Barnes, Michael D.; Achermann, Marc; Mague, Joel T.; Lahti, Paul M. Highly twisted triarylamines for photoinduced intramolecular charge transfer. The journal of physical chemistry. A, 2011, 115, 8361-8368 |
1501721 | CIF | C5 H10 N2 S2 | C 1 2/c 1 | 10.3212; 8.8807; 7.5565 90; 93.299; 90 | 691.48 | Bushmarinov, I. S.; Fedyanin, I. V.; Lyssenko, K. A.; Lapteva, V. L.; Pisarev, S. A.; Palyulin, V. A.; Zefirov, N. S.; Antipin, M. Yu The "hockey sticks" effect revisited: the conformational and electronic properties of 3,7-dithia-1,5-diazabicyclo[3.3.1]nonane from the QTAIM perspective. The journal of physical chemistry. A, 2011, 115, 12738-12745 |
1501722 | CIF | C9 H10 Cl N O | P 1 21/c 1 | 6.858; 7.636; 18.221 90; 92.605; 90 | 953.2 | Naumov, Panče; Topcu, Yildiray; Eckert-Maksić, Mirjana; Glasovac, Zoran; Pavošević, Fabijan; Kochunnoonny, Manoj; Hara, Hideyuki Photoinduced rearrangement of aromatic N-chloroamides to chloroaromatic amides in the solid state: inverted Π(N)-Σ(N) occupational stability of amidyl radicals. The journal of physical chemistry. A, 2011, 115, 7834-7848 |
1501723 | CIF | C9 H10 Cl N O | P 1 21/c 1 | 7.705; 7.146; 17.57 90; 100.15; 90 | 952 | Naumov, Panče; Topcu, Yildiray; Eckert-Maksić, Mirjana; Glasovac, Zoran; Pavošević, Fabijan; Kochunnoonny, Manoj; Hara, Hideyuki Photoinduced rearrangement of aromatic N-chloroamides to chloroaromatic amides in the solid state: inverted Π(N)-Σ(N) occupational stability of amidyl radicals. The journal of physical chemistry. A, 2011, 115, 7834-7848 |
1501724 | CIF | C9 H10 Cl N O | P n m a | 13.383; 6.769; 10.267 90; 90; 90 | 930.1 | Naumov, Panče; Topcu, Yildiray; Eckert-Maksić, Mirjana; Glasovac, Zoran; Pavošević, Fabijan; Kochunnoonny, Manoj; Hara, Hideyuki Photoinduced rearrangement of aromatic N-chloroamides to chloroaromatic amides in the solid state: inverted Π(N)-Σ(N) occupational stability of amidyl radicals. The journal of physical chemistry. A, 2011, 115, 7834-7848 |
1501725 | CIF | C13 H10 Cl N O | P 21 21 21 | 6.0806; 12.2086; 15.577 90; 90; 90 | 1156.37 | Naumov, Panče; Topcu, Yildiray; Eckert-Maksić, Mirjana; Glasovac, Zoran; Pavošević, Fabijan; Kochunnoonny, Manoj; Hara, Hideyuki Photoinduced rearrangement of aromatic N-chloroamides to chloroaromatic amides in the solid state: inverted Π(N)-Σ(N) occupational stability of amidyl radicals. The journal of physical chemistry. A, 2011, 115, 7834-7848 |
1501726 | CIF | C13 H10 Cl N O | P 1 21/c 1 | 11.754; 5.765; 16.944 90; 94.743; 90 | 1144.2 | Naumov, Panče; Topcu, Yildiray; Eckert-Maksić, Mirjana; Glasovac, Zoran; Pavošević, Fabijan; Kochunnoonny, Manoj; Hara, Hideyuki Photoinduced rearrangement of aromatic N-chloroamides to chloroaromatic amides in the solid state: inverted Π(N)-Σ(N) occupational stability of amidyl radicals. The journal of physical chemistry. A, 2011, 115, 7834-7848 |
1501727 | CIF | C13 H10 Cl N O | P -1 | 5.3862; 7.8721; 13.6512 106.554; 98.414; 90.624 | 548.013 | Naumov, Panče; Topcu, Yildiray; Eckert-Maksić, Mirjana; Glasovac, Zoran; Pavošević, Fabijan; Kochunnoonny, Manoj; Hara, Hideyuki Photoinduced rearrangement of aromatic N-chloroamides to chloroaromatic amides in the solid state: inverted Π(N)-Σ(N) occupational stability of amidyl radicals. The journal of physical chemistry. A, 2011, 115, 7834-7848 |
1501728 | CIF | C20 H32 Cl N O | P 1 21/n 1 | 6.1089; 9.7134; 34.042 90; 91.716; 90 | 2019.1 | Naumov, Panče; Topcu, Yildiray; Eckert-Maksić, Mirjana; Glasovac, Zoran; Pavošević, Fabijan; Kochunnoonny, Manoj; Hara, Hideyuki Photoinduced rearrangement of aromatic N-chloroamides to chloroaromatic amides in the solid state: inverted Π(N)-Σ(N) occupational stability of amidyl radicals. The journal of physical chemistry. A, 2011, 115, 7834-7848 |
1501729 | CIF | C9 H9 Cl2 N O | P -1 | 7.034; 7.673; 10.57 83.42; 70.6; 82.082 | 532 | Naumov, Panče; Topcu, Yildiray; Eckert-Maksić, Mirjana; Glasovac, Zoran; Pavošević, Fabijan; Kochunnoonny, Manoj; Hara, Hideyuki Photoinduced rearrangement of aromatic N-chloroamides to chloroaromatic amides in the solid state: inverted Π(N)-Σ(N) occupational stability of amidyl radicals. The journal of physical chemistry. A, 2011, 115, 7834-7848 |
1501730 | CIF | C5 H17 B5 N2 O10 | P 1 21/c 1 | 9.5031; 14.1216; 10.4957 90; 90.586; 90 | 1408.44 | Hathwar, Venkatesha R.; Paul, Avijit Kumar; Natarajan, Srinivasan; Row, Tayur N Guru Charge density analysis of a pentaborate ion in an ammonium borate: toward the understanding of topological features in borate minerals. The journal of physical chemistry. A, 2011, 115, 12818-12825 |
1501731 | CIF | C22 H12 O2 S | P 1 21/n 1 | 9.3541; 7.8376; 21.571 90; 93.994; 90 | 1577.6 | Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A, 2011, 115, 8563-8570 |
1501732 | CIF | C22 H12 O2 S | P 1 21/n 1 | 9.4963; 8.0181; 21.3804 90; 94.107; 90 | 1623.77 | Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A, 2011, 115, 8563-8570 |
1501733 | CIF | C22 H12 O2 S | P 1 21/n 1 | 9.4963; 8.0181; 21.3804 90; 94.107; 90 | 1623.77 | Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A, 2011, 115, 8563-8570 |
1501734 | CIF | C22 H12 O2 S | P 1 21/n 1 | 9.5862; 8.1401; 21.2445 90; 94.236; 90 | 1653.24 | Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A, 2011, 115, 8563-8570 |
1501735 | CIF | C22 H12 O2 S | P 1 21/n 1 | 9.6404; 8.2037; 21.187 90; 94.384; 90 | 1670.7 | Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A, 2011, 115, 8563-8570 |
1501736 | CIF | C22 H12 O2 S | P 1 21/n 1 | 9.6444; 8.216; 21.172 90; 94.206; 90 | 1673.1 | Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A, 2011, 115, 8563-8570 |
1501737 | CIF | C22 H12 O2 S | P 1 21/n 1 | 9.656; 8.247; 21.156 90; 94.6; 90 | 1679.3 | Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A, 2011, 115, 8563-8570 |
1501738 | CIF | C28 H16 O2 | P 1 21/n 1 | 10.1199; 8.2949; 11.6257 90; 109.455; 90 | 920.2 | Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A, 2011, 115, 8563-8570 |
1501739 | CIF | C28 H16 O2 | P 1 21/n 1 | 10.1822; 8.4359; 11.6494 90; 109.537; 90 | 943.03 | Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A, 2011, 115, 8563-8570 |
1501740 | CIF | C28 H16 O2 | P 1 21/n 1 | 10.2391; 8.5602; 11.6621 90; 109.646; 90 | 962.67 | Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A, 2011, 115, 8563-8570 |
1501741 | CIF | C28 H16 O2 | P 1 21/n 1 | 10.2759; 8.6249; 11.6667 90; 109.729; 90 | 973.31 | Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A, 2011, 115, 8563-8570 |
1501742 | CIF | C28 H16 O2 | P 1 21/n 1 | 10.2832; 8.6313; 11.6644 90; 109.758; 90 | 974.35 | Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A, 2011, 115, 8563-8570 |
1501744 | CIF | C56 H38 N4 | P -1 | 12.15; 13.307; 14.206 64.599; 71.92; 74.904 | 1950.5 | Yamashita, Hiroaki; Abe, Jiro Photochromic properties of [2.2]paracyclophane-bridged imidazole dimer with increased photosensitivity by introducing pyrenyl moiety. The journal of physical chemistry. A, 2011, 115, 13332-13337 |
1501745 | CIF | C11 H8 N4 S | C 1 2/c 1 | 10.97; 8.986; 20.881 90; 103.66; 90 | 2000.2 | Nakanishi, Waro; Hayashi, Satoko; Pitak, Mateusz B.; Hursthouse, Michael B.; Coles, Simon J. Dynamic and static behaviors of N-Z-N σ(3c-4e) (Z = S, Se, and Te) interactions: atoms-in-molecules dual functional analysis with high-resolution X-ray diffraction determination of electron densities for 2-(2-pyridylimino)-2H-1,2,4-thiadiazolo[2,3-a]pyridine. The journal of physical chemistry. A, 2011, 115, 11775-11787 |
1501750 | CIF | C13 H18 N2 | C 1 2/c 1 | 16.649; 14.441; 20.354 90; 92.7; 90 | 4888.2 | Galievsky, Victor A.; Druzhinin, Sergey I.; Demeter, Attila; Kovalenko, Sergey A.; Senyushkina, Tamara; Mayer, Peter; Zachariasse, Klaas A. Presence and absence of excited state intramolecular charge transfer with the six isomers of dicyano-N,N-dimethylaniline and dicyano-(N-methyl-N-isopropyl)aniline. The journal of physical chemistry. A, 2011, 115, 10823-10845 |
1501751 | CIF | C11 H9 N3 | P -1 | 7.947; 8.13; 8.153 85.9; 76.26; 64.85 | 462.9 | Galievsky, Victor A.; Druzhinin, Sergey I.; Demeter, Attila; Kovalenko, Sergey A.; Senyushkina, Tamara; Mayer, Peter; Zachariasse, Klaas A. Presence and absence of excited state intramolecular charge transfer with the six isomers of dicyano-N,N-dimethylaniline and dicyano-(N-methyl-N-isopropyl)aniline. The journal of physical chemistry. A, 2011, 115, 10823-10845 |
1501752 | CIF | C12 H13 N3 | P 1 21/c 1 | 7.462; 10.6319; 14.242 90; 102.453; 90 | 1103.31 | Galievsky, Victor A.; Druzhinin, Sergey I.; Demeter, Attila; Kovalenko, Sergey A.; Senyushkina, Tamara; Mayer, Peter; Zachariasse, Klaas A. Presence and absence of excited state intramolecular charge transfer with the six isomers of dicyano-N,N-dimethylaniline and dicyano-(N-methyl-N-isopropyl)aniline. The journal of physical chemistry. A, 2011, 115, 10823-10845 |
1501753 | CIF | C12 H13 N3 | P 1 21/c 1 | 10.2495; 6.8618; 15.9772 90; 101.686; 90 | 1100.39 | Galievsky, Victor A.; Druzhinin, Sergey I.; Demeter, Attila; Kovalenko, Sergey A.; Senyushkina, Tamara; Mayer, Peter; Zachariasse, Klaas A. Presence and absence of excited state intramolecular charge transfer with the six isomers of dicyano-N,N-dimethylaniline and dicyano-(N-methyl-N-isopropyl)aniline. The journal of physical chemistry. A, 2011, 115, 10823-10845 |
1501754 | CIF | C12 H13 N3 | P 1 21/n 1 | 8.9832; 12.6212; 9.6863 90; 92.414; 90 | 1097.25 | Galievsky, Victor A.; Druzhinin, Sergey I.; Demeter, Attila; Kovalenko, Sergey A.; Senyushkina, Tamara; Mayer, Peter; Zachariasse, Klaas A. Presence and absence of excited state intramolecular charge transfer with the six isomers of dicyano-N,N-dimethylaniline and dicyano-(N-methyl-N-isopropyl)aniline. The journal of physical chemistry. A, 2011, 115, 10823-10845 |
1501755 | CIF | C10 H9 N3 | P -1 | 8.0083; 8.1614; 8.1965 85.25; 62.613; 74.373 | 457.56 | Galievsky, Victor A.; Druzhinin, Sergey I.; Demeter, Attila; Kovalenko, Sergey A.; Senyushkina, Tamara; Mayer, Peter; Zachariasse, Klaas A. Presence and absence of excited state intramolecular charge transfer with the six isomers of dicyano-N,N-dimethylaniline and dicyano-(N-methyl-N-isopropyl)aniline. The journal of physical chemistry. A, 2011, 115, 10823-10845 |
1501756 | CIF | Cl4 Cs2 O2 U | C 1 2/m 1 | 11.7882; 7.6411; 5.7686 90; 100.438; 90 | 511.01 | Zhurov, Vladimir V.; Zhurova, Elizabeth A.; Stash, Adam I.; Pinkerton, A. Alan Characterization of bonding in cesium uranyl chloride: topological analysis of the experimental charge density. The journal of physical chemistry. A, 2011, 115, 13016-13023 |
1501759 | CIF | C10 H16 N6 O4 | P b c a | 16.138; 7.0036; 22.75 90; 90; 90 | 2571.3 | Lee, Jong Hoon; Naumov, Pance; Chung, Ihn Hee; Lee, Sang Cheol Solid-state thermochromism and phase transitions of charge transfer 1,3-diamino-4,6-dinitrobenzene dyes. The journal of physical chemistry. A, 2011, 115, 10087-10096 |
1501760 | CIF | C18 H14 N4 O4 | P 1 21/c 1 | 10.9187; 10.9859; 14.7065 90; 109.838; 90 | 1659.38 | Lee, Jong Hoon; Naumov, Pance; Chung, Ihn Hee; Lee, Sang Cheol Solid-state thermochromism and phase transitions of charge transfer 1,3-diamino-4,6-dinitrobenzene dyes. The journal of physical chemistry. A, 2011, 115, 10087-10096 |
1501761 | CIF | C18 H14 N4 O4 | P 1 21/n 1 | 9.2057; 9.0165; 21.1691 90; 102.445; 90 | 1715.82 | Lee, Jong Hoon; Naumov, Pance; Chung, Ihn Hee; Lee, Sang Cheol Solid-state thermochromism and phase transitions of charge transfer 1,3-diamino-4,6-dinitrobenzene dyes. The journal of physical chemistry. A, 2011, 115, 10087-10096 |
1501762 | CIF | C18 H14 N4 O4 | P -1 | 7.865; 9.6359; 23.304 89.901; 88.777; 70.877 | 1668.26 | Lee, Jong Hoon; Naumov, Pance; Chung, Ihn Hee; Lee, Sang Cheol Solid-state thermochromism and phase transitions of charge transfer 1,3-diamino-4,6-dinitrobenzene dyes. The journal of physical chemistry. A, 2011, 115, 10087-10096 |
1501763 | CIF | C20 H18 N4 O4 | P -1 | 9.6792; 10.0246; 10.2564 108.14; 97.415; 104.581 | 891.7 | Lee, Jong Hoon; Naumov, Pance; Chung, Ihn Hee; Lee, Sang Cheol Solid-state thermochromism and phase transitions of charge transfer 1,3-diamino-4,6-dinitrobenzene dyes. The journal of physical chemistry. A, 2011, 115, 10087-10096 |
1501764 | CIF | C20 H30 N4 O4 | P n m a | 11.6274; 6.7904; 26.582 90; 90; 90 | 2098.8 | Lee, Jong Hoon; Naumov, Pance; Chung, Ihn Hee; Lee, Sang Cheol Solid-state thermochromism and phase transitions of charge transfer 1,3-diamino-4,6-dinitrobenzene dyes. The journal of physical chemistry. A, 2011, 115, 10087-10096 |
1501765 | CIF | C12 H18 N4 O4 | P 1 21/c 1 | 8.3647; 21.533; 7.79 90; 92.707; 90 | 1401.5 | Lee, Jong Hoon; Naumov, Pance; Chung, Ihn Hee; Lee, Sang Cheol Solid-state thermochromism and phase transitions of charge transfer 1,3-diamino-4,6-dinitrobenzene dyes. The journal of physical chemistry. A, 2011, 115, 10087-10096 |
1501766 | CIF | C14 H24 N6 O4 | P 1 21/c 1 | 12.7313; 15.6701; 9.4477 90; 110.843; 90 | 1761.48 | Lee, Jong Hoon; Naumov, Pance; Chung, Ihn Hee; Lee, Sang Cheol Solid-state thermochromism and phase transitions of charge transfer 1,3-diamino-4,6-dinitrobenzene dyes. The journal of physical chemistry. A, 2011, 115, 10087-10096 |
1501767 | CIF | C10 H12 Cl2 N4 O6 | P 1 21/n 1 | 10.3054; 4.4342; 32.6413 90; 97.77; 90 | 1477.89 | Lee, Jong Hoon; Naumov, Pance; Chung, Ihn Hee; Lee, Sang Cheol Solid-state thermochromism and phase transitions of charge transfer 1,3-diamino-4,6-dinitrobenzene dyes. The journal of physical chemistry. A, 2011, 115, 10087-10096 |
1501771 | CIF | C463.98 H239.98 N32 O313.66 Zn52 | F m -3 m | 26.4461; 26.4461; 26.4461 90; 90; 90 | 18496.3 | Larsen, Randy W.; Miksovska, Jaroslava; Musselman, Ronald L.; Wojtas, Lukasz Ground- and excited-state properties of Zn(II) tetrakis(4-tetramethylpyridyl) pophyrin specifically encapsulated within a Zn(II) HKUST metal-organic framework. The journal of physical chemistry. A, 2011, 115, 11519-11524 |
1501774 | CIF | C29 H25 F4 N8 S2 | P -1 | 7.6537; 12.4352; 16.3279 73.674; 85.27; 76.176 | 1447.96 | von Eschwege, Karel G.; Conradie, Jeanet; Kuhn, Annemarie Dithizone and Its oxidation products: a DFT, spectroscopic, and X-ray structural study. The journal of physical chemistry. A, 2011, 115, 14637-14646 |
1502675 | CIF | B F3 H3 N | P b c a | 8.0067; 7.9511; 9.2216 90; 90; 90 | 587.07 | Mebs, Stefan; Grabowsky, Simon; Förster, Diana; Kickbusch, Rainer; Hartl, Monika; Daemen, Luke L.; Morgenroth, Wolfgang; Luger, Peter; Paulus, Beate; Lentz, Dieter Charge transfer via the dative N-B bond and dihydrogen contacts. Experimental and theoretical electron density studies of small Lewis acid-base adducts. The journal of physical chemistry. A, 2010, 114, 10185-10196 |
1502676 | CIF | B H7 N2 | P b c n | 12.974; 5.0702; 9.5069 90; 90; 90 | 625.37 | Mebs, Stefan; Grabowsky, Simon; Förster, Diana; Kickbusch, Rainer; Hartl, Monika; Daemen, Luke L.; Morgenroth, Wolfgang; Luger, Peter; Paulus, Beate; Lentz, Dieter Charge transfer via the dative N-B bond and dihydrogen contacts. Experimental and theoretical electron density studies of small Lewis acid-base adducts. The journal of physical chemistry. A, 2010, 114, 10185-10196 |
1502678 | CIF | C44 H40 N2 O4 | P -1 | 8.4011; 10.7176; 11.4368 67.813; 83.709; 67.757 | 881.89 | Cao, Deng-Ke; Sreevidya, Thekku Veedu; Botoshansky, Mark; Golden, Gilad; Benedict, Jason Brown; Kaftory, Menahem Kinetics of solid state photodimerization of 1,4-dimethyl-2-pyridinone in its molecular compound. The journal of physical chemistry. A, 2010, 114, 7377-7381 |
1502679 | CIF | C44 H40 N2 O4 | P -1 | 8.4065; 10.7888; 11.3346 66.999; 86.542; 67.967 | 872.67 | Cao, Deng-Ke; Sreevidya, Thekku Veedu; Botoshansky, Mark; Golden, Gilad; Benedict, Jason Brown; Kaftory, Menahem Kinetics of solid state photodimerization of 1,4-dimethyl-2-pyridinone in its molecular compound. The journal of physical chemistry. A, 2010, 114, 7377-7381 |
1502680 | CIF | C44 H40 N2 O4 | P -1 | 8.4124; 10.7275; 11.4652 67.875; 84.032; 67.981 | 887.73 | Cao, Deng-Ke; Sreevidya, Thekku Veedu; Botoshansky, Mark; Golden, Gilad; Benedict, Jason Brown; Kaftory, Menahem Kinetics of solid state photodimerization of 1,4-dimethyl-2-pyridinone in its molecular compound. The journal of physical chemistry. A, 2010, 114, 7377-7381 |
1502681 | CIF | C44 H40 N2 O4 | P -1 | 8.4248; 10.8144; 11.364 66.894; 86.649; 68.06 | 878.61 | Cao, Deng-Ke; Sreevidya, Thekku Veedu; Botoshansky, Mark; Golden, Gilad; Benedict, Jason Brown; Kaftory, Menahem Kinetics of solid state photodimerization of 1,4-dimethyl-2-pyridinone in its molecular compound. The journal of physical chemistry. A, 2010, 114, 7377-7381 |
1502682 | CIF | C44 H40 N2 O4 | P -1 | 8.4113; 10.8816; 11.4046 65.404; 86.157; 66.822 | 866.65 | Cao, Deng-Ke; Sreevidya, Thekku Veedu; Botoshansky, Mark; Golden, Gilad; Benedict, Jason Brown; Kaftory, Menahem Kinetics of solid state photodimerization of 1,4-dimethyl-2-pyridinone in its molecular compound. The journal of physical chemistry. A, 2010, 114, 7377-7381 |
1502683 | CIF | C44 H40 N2 O4 | P -1 | 8.3944; 10.8552; 11.3656 65.502; 86.065; 66.745 | 860.25 | Cao, Deng-Ke; Sreevidya, Thekku Veedu; Botoshansky, Mark; Golden, Gilad; Benedict, Jason Brown; Kaftory, Menahem Kinetics of solid state photodimerization of 1,4-dimethyl-2-pyridinone in its molecular compound. The journal of physical chemistry. A, 2010, 114, 7377-7381 |
1502703 | CIF | F N3 O2 S | C 1 c 1 | 7.0017; 13.5124; 5.017 90; 121.37; 90 | 405.27 | Zeng, Xiaoqing; Gerken, Michael; Beckers, Helmut; Willner, Helge Anomeric effects in sulfonyl compounds: an experimental and computational study of fluorosulfonyl azide, FSO(2)N(3), and trifluoromethylsulfonyl azide, CF(3)SO(2)N(3). The journal of physical chemistry. A, 2010, 114, 7624-7630 |
1502704 | CIF | C F3 N3 O2 S | P 1 21/c 1 | 5.0666; 17.0136; 7.0041 90; 106.13; 90 | 579.99 | Zeng, Xiaoqing; Gerken, Michael; Beckers, Helmut; Willner, Helge Anomeric effects in sulfonyl compounds: an experimental and computational study of fluorosulfonyl azide, FSO(2)N(3), and trifluoromethylsulfonyl azide, CF(3)SO(2)N(3). The journal of physical chemistry. A, 2010, 114, 7624-7630 |
1502705 | CIF | C23 H28 N2 | P 1 21/n 1 | 10.296; 11.5493; 17.6364 90; 100.126; 90 | 2064.5 | Cruz, A. J.; Siam, K.; Moore, C.; Islam, M.; Rillema, D. P. Dicyano and pyridine derivatives of retinal: synthesis and vibronic, electronic, and photophysical properties. The journal of physical chemistry. A, 2010, 114, 6766-6775 |
1502706 | CIF | C27 H32 N2 | P -1 | 6.8351; 7.4409; 24.397 89.25; 85.685; 69.736 | 1160.61 | Cruz, A. J.; Siam, K.; Moore, C.; Islam, M.; Rillema, D. P. Dicyano and pyridine derivatives of retinal: synthesis and vibronic, electronic, and photophysical properties. The journal of physical chemistry. A, 2010, 114, 6766-6775 |
1502714 | CIF | C12 O12 Ru3 | P 1 21/n 1 | 7.9959; 14.6373; 14.3746 90; 100.578; 90 | 1653.79 | Gervasio, Giuliana; Marabello, Domenica; Bianchi, Riccardo; Forni, Alessandra Detection of weak intramolecular interactions in Ru(3)(CO)(12) by topological analysis of charge density distributions. The journal of physical chemistry. A, 2010, 114, 9368-9373 |
1502721 | CIF | C4 H9 Li2 Mo N O9 | C 1 2/m 1 | 13.0031; 14.4347; 5.1506 90; 96.347; 90 | 960.82 | Deb, Dibakar; Giri, Santanab; Chattaraj, Pratim K.; Bhattacharjee, Manish Synthesis and structure of a 3D porous network containing aromatic 1D chains of Li(6) rings: experimental and computational studies. The journal of physical chemistry. A, 2010, 114, 10871-10877 |
1502722 | CIF | C7 H8 N2 O | C 1 2/c 1 | 19.7305; 7.5421; 19.521 90; 108.659; 90 | 2752.22 | Ośmiałowski, Borys; Kolehmainen, Erkki; Dobosz, Robert; Gawinecki, Ryszard; Kauppinen, Reijo; Valkonen, Arto; Koivukorpi, Juha; Rissanen, Kari Self-organization of 2-acylaminopyridines in the solid state and in solution. The journal of physical chemistry. A, 2010, 114, 10421-10426 |
1502723 | CIF | C8 H10 N2 O | P -1 | 7.76; 8.5323; 12.8473 86.484; 86.143; 70.363 | 798.66 | Ośmiałowski, Borys; Kolehmainen, Erkki; Dobosz, Robert; Gawinecki, Ryszard; Kauppinen, Reijo; Valkonen, Arto; Koivukorpi, Juha; Rissanen, Kari Self-organization of 2-acylaminopyridines in the solid state and in solution. The journal of physical chemistry. A, 2010, 114, 10421-10426 |
1502724 | CIF | C8 H10 N2 O | P c c n | 12.7255; 15.1322; 8.1552 90; 90; 90 | 1570.4 | Ośmiałowski, Borys; Kolehmainen, Erkki; Dobosz, Robert; Gawinecki, Ryszard; Kauppinen, Reijo; Valkonen, Arto; Koivukorpi, Juha; Rissanen, Kari Self-organization of 2-acylaminopyridines in the solid state and in solution. The journal of physical chemistry. A, 2010, 114, 10421-10426 |
1502725 | CIF | C9 H12 N2 O | P 1 21/c 1 | 16.3623; 9.5058; 12.8922 90; 112.879; 90 | 1847.46 | Ośmiałowski, Borys; Kolehmainen, Erkki; Dobosz, Robert; Gawinecki, Ryszard; Kauppinen, Reijo; Valkonen, Arto; Koivukorpi, Juha; Rissanen, Kari Self-organization of 2-acylaminopyridines in the solid state and in solution. The journal of physical chemistry. A, 2010, 114, 10421-10426 |
1502726 | CIF | C9 H12 N2 O | C 1 2/c 1 | 15.0714; 9.4669; 12.7208 90; 90.861; 90 | 1814.8 | Ośmiałowski, Borys; Kolehmainen, Erkki; Dobosz, Robert; Gawinecki, Ryszard; Kauppinen, Reijo; Valkonen, Arto; Koivukorpi, Juha; Rissanen, Kari Self-organization of 2-acylaminopyridines in the solid state and in solution. The journal of physical chemistry. A, 2010, 114, 10421-10426 |
1502727 | CIF | C10 H14 N2 O | R 3 c :H | 23.5657; 23.5657; 9.5946 90; 90; 120 | 4614.43 | Ośmiałowski, Borys; Kolehmainen, Erkki; Dobosz, Robert; Gawinecki, Ryszard; Kauppinen, Reijo; Valkonen, Arto; Koivukorpi, Juha; Rissanen, Kari Self-organization of 2-acylaminopyridines in the solid state and in solution. The journal of physical chemistry. A, 2010, 114, 10421-10426 |
1502728 | CIF | C10 H14 N2 O | P 1 21/n 1 | 9.8731; 10.0067; 30.9126 90; 95.154; 90 | 3041.73 | Ośmiałowski, Borys; Kolehmainen, Erkki; Dobosz, Robert; Gawinecki, Ryszard; Kauppinen, Reijo; Valkonen, Arto; Koivukorpi, Juha; Rissanen, Kari Self-organization of 2-acylaminopyridines in the solid state and in solution. The journal of physical chemistry. A, 2010, 114, 10421-10426 |
1502729 | CIF | C11 H16 N2 O | P b c a | 11.0135; 10.1491; 19.8528 90; 90; 90 | 2219.09 | Ośmiałowski, Borys; Kolehmainen, Erkki; Dobosz, Robert; Gawinecki, Ryszard; Kauppinen, Reijo; Valkonen, Arto; Koivukorpi, Juha; Rissanen, Kari Self-organization of 2-acylaminopyridines in the solid state and in solution. The journal of physical chemistry. A, 2010, 114, 10421-10426 |
1502730 | CIF | C16 H20 N2 O | P c c n | 9.8846; 27.5538; 9.9296 90; 90; 90 | 2704.41 | Ośmiałowski, Borys; Kolehmainen, Erkki; Dobosz, Robert; Gawinecki, Ryszard; Kauppinen, Reijo; Valkonen, Arto; Koivukorpi, Juha; Rissanen, Kari Self-organization of 2-acylaminopyridines in the solid state and in solution. The journal of physical chemistry. A, 2010, 114, 10421-10426 |
1502732 | CIF | C21 H17 N O | P 1 21/c 1 | 8.966; 18.422; 10.4846 90; 116.327; 90 | 1552.1 | Coe, Benjamin J.; Fielden, John; Foxon, Simon P.; Helliwell, Madeleine; Brunschwig, Bruce S.; Asselberghs, Inge; Clays, Koen; Olesiak, Joanna; Matczyszyn, Katarzyna; Samoc, Marek Quadratic and cubic nonlinear optical properties of salts of diquat-based chromophores with diphenylamino substituents. The journal of physical chemistry. A, 2010, 114, 12028-12041 |
1502733 | CIF | C38.5 H38.75 F12 N3.25 O0.5 P2 | P -1 | 8.0652; 13.81; 20.684 106.539; 99.424; 96.092 | 2150.1 | Coe, Benjamin J.; Fielden, John; Foxon, Simon P.; Helliwell, Madeleine; Brunschwig, Bruce S.; Asselberghs, Inge; Clays, Koen; Olesiak, Joanna; Matczyszyn, Katarzyna; Samoc, Marek Quadratic and cubic nonlinear optical properties of salts of diquat-based chromophores with diphenylamino substituents. The journal of physical chemistry. A, 2010, 114, 12028-12041 |
1502736 | CIF | C24 H25 N O2 | P 21 21 21 | 6.1987; 16.054; 20.033 90; 90; 90 | 1993.6 | Jaworska, Magdalena; Hrynczyszyn, Paweł B; Wełniak, Mirosław; Wojtczak, Andrzej; Nowicka, Katarzyna; Krasiński, Grzegorz; Kassassir, Hassan; Ciesielski, Włodzimierz; Potrzebowski, Marek J. Solid state NMR spectroscopy as a precise tool for assigning the tautomeric form and proton position in the intramolecular bridges of o-hydroxy Schiff bases. The journal of physical chemistry. A, 2010, 114, 12522-12530 |
1502737 | CIF | C24 H25 N O3 | P 1 21 1 | 11.414; 8.499; 11.529 90; 115.28; 90 | 1011.3 | Jaworska, Magdalena; Hrynczyszyn, Paweł B; Wełniak, Mirosław; Wojtczak, Andrzej; Nowicka, Katarzyna; Krasiński, Grzegorz; Kassassir, Hassan; Ciesielski, Włodzimierz; Potrzebowski, Marek J. Solid state NMR spectroscopy as a precise tool for assigning the tautomeric form and proton position in the intramolecular bridges of o-hydroxy Schiff bases. The journal of physical chemistry. A, 2010, 114, 12522-12530 |
1502739 | CIF | C12 H4 Fe3 O11 | P 1 21/c 1 | 7.4672; 16.4731; 13.7414 90; 103.927; 90 | 1640.61 | Farrugia, Louis J.; Senn, Hans Martin Metal-metal and metal-ligand bonding at a QTAIM catastrophe: a combined experimental and theoretical charge density study on the alkylidyne cluster Fe3(μ-H)(μ-COMe)(CO)10. The journal of physical chemistry. A, 2010, 114, 13418-13433 |
1502740 | CIF | C12 H4 Fe3 O11 | P 1 21/c 1 | 7.4672; 16.4731; 13.7414 90; 103.927; 90 | 1640.61 | Farrugia, Louis J.; Senn, Hans Martin Metal-metal and metal-ligand bonding at a QTAIM catastrophe: a combined experimental and theoretical charge density study on the alkylidyne cluster Fe3(μ-H)(μ-COMe)(CO)10. The journal of physical chemistry. A, 2010, 114, 13418-13433 |
1502741 | CIF | C10 H8 Cl N O | P -1 | 7.088; 7.22; 9.14 92.55; 106.95; 110.32 | 414 | Hathwar, Venkatesha R.; Guru Row, Tayur N. Nature of Cl···Cl intermolecular interactions via experimental and theoretical charge density analysis: correlation of polar flattening effects with geometry. The journal of physical chemistry. A, 2010, 114, 13434-13441 |
1502742 | CIF | C5 H4 Cl N O | F d d 2 | 23.1021; 25.1758; 3.7363 90; 90; 90 | 2173.08 | Hathwar, Venkatesha R.; Guru Row, Tayur N. Nature of Cl···Cl intermolecular interactions via experimental and theoretical charge density analysis: correlation of polar flattening effects with geometry. The journal of physical chemistry. A, 2010, 114, 13434-13441 |
1502743 | CIF | C11 H9 Cl2 N | P 1 21/c 1 | 14.98; 4.5662; 14.858 90; 94.87; 90 | 1012.6 | Hathwar, Venkatesha R.; Guru Row, Tayur N. Nature of Cl···Cl intermolecular interactions via experimental and theoretical charge density analysis: correlation of polar flattening effects with geometry. The journal of physical chemistry. A, 2010, 114, 13434-13441 |
1502744 | CIF | C20 H14 O | P 1 2/c 1 | 12.8954; 5.5486; 20.0322 90; 106.472; 90 | 1374.51 | Schwerin, Andrew F.; Johnson, Justin C.; Smith, Millicent B.; Sreearunothai, Paiboon; Popović, Duska; Cerný, Jirí; Havlas, Zdenek; Paci, Irina; Akdag, Akin; MacLeod, Matthew K.; Chen, Xudong; David, Donald E.; Ratner, Mark A.; Miller, John R.; Nozik, Arthur J.; Michl, Josef Toward designed singlet fission: electronic states and photophysics of 1,3-diphenylisobenzofuran. The journal of physical chemistry. A, 2010, 114, 1457-1473 |
1502745 | CIF | C18 H14 N2 O4 | P 1 21/n 1 | 19.3408; 3.8902; 20.212 90; 90.594; 90 | 1520.7 | Sonoda, Yoriko; Tsuzuki, Seiji; Goto, Midori; Tohnai, Norimitsu; Yoshida, Masaru Fluorescence spectroscopic properties of nitro-substituted diphenylpolyenes: effects of intramolecular planarization and intermolecular interactions in crystals. The journal of physical chemistry. A, 2010, 114, 172-182 |
1502746 | CIF | C18 H14 N2 O4 | P -1 | 6.3063; 10.8492; 12.374 107.847; 98.976; 103.827 | 758.1 | Sonoda, Yoriko; Tsuzuki, Seiji; Goto, Midori; Tohnai, Norimitsu; Yoshida, Masaru Fluorescence spectroscopic properties of nitro-substituted diphenylpolyenes: effects of intramolecular planarization and intermolecular interactions in crystals. The journal of physical chemistry. A, 2010, 114, 172-182 |
1502760 | CIF | C47 H49 N3 | P b c a | 11.408; 25.189; 28.093 90; 90; 90 | 8073 | Suwa, Kazuya; Otsuki, Joe; Goto, Kei Photoisomerization and thermal isomerization of shuttlecock- and bowl-equipped (phenylazo)pyridines. The journal of physical chemistry. A, 2010, 114, 884-890 |
1502761 | CIF | C61 H61 N3 | P -1 | 11.4828; 12.8037; 17.557 103.938; 103.837; 98.1698 | 2377.3 | Suwa, Kazuya; Otsuki, Joe; Goto, Kei Photoisomerization and thermal isomerization of shuttlecock- and bowl-equipped (phenylazo)pyridines. The journal of physical chemistry. A, 2010, 114, 884-890 |
1502762 | CIF | C61 H61 N3 O | P -1 | 13.967; 17.661; 20.091 95.541; 99.166; 96.727 | 4825 | Suwa, Kazuya; Otsuki, Joe; Goto, Kei Photoisomerization and thermal isomerization of shuttlecock- and bowl-equipped (phenylazo)pyridines. The journal of physical chemistry. A, 2010, 114, 884-890 |
1504353 | CIF | C32 H16 F18 N3 O6 Sm | P -1 | 11.5889; 17.5357; 18.8203 79.3974; 84.1179; 88.0187 | 3739.08 | Hasegawa, Yasuchika; Tsuruoka, Shin-ichi; Yoshida, Takahiko; Kawai, Hideki; Kawai, Tsuyoshi Enhanced deep-red luminescence of tris(hexafluoroacetylacetonato)samarium(III) complex with phenanthroline in solution by control of ligand coordination. The journal of physical chemistry. A, 2008, 112, 803-807 |
1504354 | CIF | C41 H22 F18 N5 O6 Sm | P 1 21/n 1 | 11.69; 19.656; 20.63 90; 93.412; 90 | 4731.9 | Hasegawa, Yasuchika; Tsuruoka, Shin-ichi; Yoshida, Takahiko; Kawai, Hideki; Kawai, Tsuyoshi Enhanced deep-red luminescence of tris(hexafluoroacetylacetonato)samarium(III) complex with phenanthroline in solution by control of ligand coordination. The journal of physical chemistry. A, 2008, 112, 803-807 |
1504356 | CIF | C15 H22 N2 | P 1 21 1 | 7.815; 22.2685; 8.2607 90; 102.73; 90 | 1402.26 | Druzhinin, Sergey I.; Dubbaka, Srinivas Reddy; Knochel, Paul; Kovalenko, Sergey A.; Mayer, Peter; Senyushkina, Tamara; Zachariasse, Klaas A. Ultrafast intramolecular charge transfer with strongly twisted aminobenzonitriles: 4-(di-tert-butylamino)benzonitrile and 3-(di-tert-butylamino)benzonitrile. The journal of physical chemistry. A, 2008, 112, 2749-2761 |
1504358 | CIF | C8 H18 F6 O6 P2 S2 | R -3 m :H | 9.1795; 9.1795; 17.7956 90; 90; 120 | 1298.62 | Wolstenholme, David J.; Weigand, Jan J.; Davidson, Reagan J.; Pearson, Jason K.; Cameron, T. Stanley Understanding the electronic structure, reactivity, and hydrogen bonding for a 1,2-diphosphonium dication. The journal of physical chemistry. A, 2008, 112, 3424-3431 |
1504359 | CIF | C28 H24 Cl2 N2 Pt | P 1 21/c 1 | 16.2361; 9.511; 17.9203 90; 114.692; 90 | 2514.26 | Shao, Pin; Li, Yunjing; Sun, Wenfang Cyclometalated platinum(II) complex with strong and broadband nonlinear optical response. The journal of physical chemistry. A, 2008, 112, 1172-1179 |
1504360 | CIF | C11 H10 Fe O | P 21 21 21 | 7.639; 10.518; 11.3 90; 90; 90 | 907.9 | Lousada, Claudio M.; Pinto, Susana S.; Lopes, José N Canongia; da Piedade, M. Fatima Minas; Diogo, Hermínio P; da Piedade, Manuel E Minas Experimental and molecular dynamics simulation study of the sublimation and vaporization energetics of iron metalocenes. crystal structures of Fe(eta5-C5H4CH3)2 and Fe[(eta5-(C5H5)(eta5-C5H4CHO)]. The journal of physical chemistry. A, 2008, 112, 2977-2987 |
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