Crystallography Open Database

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7203053 CIFC42 H84 N6 Ni O12P -112.1915; 12.3098; 16.4178
90.374; 96.009; 95.849
2437.24Falvello, Larry R.; Ferrer, Daniel; Piedrafita, María; Soler, Tatiana; Tomás, Milagros
Using the crystal to engineer the molecule: cis-trans-isomer selection in anionic bis(orotate) complexes
CrystEngComm, 2007, 9, 852
7203054 CIFC H5 N3 O4P 1 21/c 17.9761; 8.2004; 7.3668
90; 103.414; 90
468.697Nelyubina, Yulia V.; Lyssenko, Konstantin A.; Golovanov, Denis G.; Antipin, Mikhail Yu.
NO3–⋯NO3– and NO3–⋯π interactions in the crystal of urea nitrate
CrystEngComm, 2007, 9, 991
7203056 CIFC9 H8 O SP b c a14.745; 5.7176; 20.659
90; 90; 90
1741.7Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.
Impact of sulfur substituents on the C–H⋯O interaction of terminal alkynes in crystal engineering
CrystEngComm, 2007, 9, 1041
7203057 CIFC9 H8 O SP 21 21 215.9369; 10.9023; 13.2907
90; 90; 90
860.25Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.
Impact of sulfur substituents on the C–H⋯O interaction of terminal alkynes in crystal engineering
CrystEngComm, 2007, 9, 1041
7203058 CIFC9 H8 O2 SP c a 2122.1885; 5.6567; 14.0833
90; 90; 90
1767.6Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.
Impact of sulfur substituents on the C–H⋯O interaction of terminal alkynes in crystal engineering
CrystEngComm, 2007, 9, 1041
7203059 CIFC9 H8 O2 SP 1 21 16.0507; 9.6244; 7.9662
90; 109.273; 90
437.91Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.
Impact of sulfur substituents on the C–H⋯O interaction of terminal alkynes in crystal engineering
CrystEngComm, 2007, 9, 1041
7203060 CIFC10 H10 O SP -16.7881; 7.9542; 8.7386
94.048; 92.037; 95.872
467.75Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.
Impact of sulfur substituents on the C–H⋯O interaction of terminal alkynes in crystal engineering
CrystEngComm, 2007, 9, 1041
7203061 CIFC10 H10 O2 SP 1 21/n 110.5942; 7.9196; 11.5721
90; 98.59; 90
960.03Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.
Impact of sulfur substituents on the C–H⋯O interaction of terminal alkynes in crystal engineering
CrystEngComm, 2007, 9, 1041
7203062 CIFC10 H10 O3 SP 21 21 217.9083; 8.889; 14.4521
90; 90; 90
1015.94Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.
Impact of sulfur substituents on the C–H⋯O interaction of terminal alkynes in crystal engineering
CrystEngComm, 2007, 9, 1041
7203063 CIFC9 H7 F O2 SP -17.389; 8.134; 8.474
109.23; 98.6; 106.01
445.7Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.
Impact of sulfur substituents on the C–H⋯O interaction of terminal alkynes in crystal engineering
CrystEngComm, 2007, 9, 1041
7203064 CIFC11 H12 O3 SP 21 21 216.586; 10.1867; 16.9358
90; 90; 90
1136.22Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.
Impact of sulfur substituents on the C–H⋯O interaction of terminal alkynes in crystal engineering
CrystEngComm, 2007, 9, 1041
7203066 CIFC20 H13 N O2 SP 21 21 215.8976; 16.381; 16.464
90; 90; 90
1590.6Lennartson, Anders; Wiklund, Tove; Håkansson, Mikael
Concomitant formation of chiral and racemic crystals of a diaryl sulfide
CrystEngComm, 2007, 9, 856
7203067 CIFC20 H13 N O2 SP 1 21/c 18.6557; 12.706; 14.439
90; 94.42; 90
1583.3Lennartson, Anders; Wiklund, Tove; Håkansson, Mikael
Concomitant formation of chiral and racemic crystals of a diaryl sulfide
CrystEngComm, 2007, 9, 856
7203068 CIFC13 H9 Cu2 N3 O4P 1 c 110.864; 5.116; 12.282
90; 104.53; 90
660.8Amo-Ochoa, Pilar; Miguel, Pablo J. Sanz; Castillo, Oscar; Zamora, Félix
An unusual triple parallel interpenetrated 2D Cu-polymer, with a 3D triple interpenetration via H-bonding
CrystEngComm, 2007, 9, 987
7203069 CIFC54 H46 Fe N O13 S32P -19.5456; 11.1348; 37.703
82.05; 86.294; 66.254
3632.7Lee Martin; Peter Day; Hiroki Akutsu; Jun-ichi Yamada; Shin'ichi Nakatsuji; William Clegg; Ross W. Harrington; Peter N. Horton; Michael B. Hursthouse; Paul McMillan; Steven Firth
Metallic molecular crystals containing chiral or racemic guest molecules
CrystEngComm, 2007, 9, 865
7203070 CIFC54 H46 Fe N O13 S32P 19.5293; 11.168; 37.6039
81.788; 86.147; 66.364
3628.4Lee Martin; Peter Day; Hiroki Akutsu; Jun-ichi Yamada; Shin'ichi Nakatsuji; William Clegg; Ross W. Harrington; Peter N. Horton; Michael B. Hursthouse; Paul McMillan; Steven Firth
Metallic molecular crystals containing chiral or racemic guest molecules
CrystEngComm, 2007, 9, 865
7203071 CIFC20 H24 N2 O2P -17.802; 8.471; 8.709
114.3; 96.46; 114.38
449.3Piotrkowska, Barbara; Gdaniec, Maria; Milewska, Maria J.; Połoński, Tadeusz
Aryl‒perfluoroaryl stacking interactions, hydrogen bonding and steric effects in controlling the structure of supramolecular assemblies of N,N′-diaryloxalamides
CrystEngComm, 2007, 9, 868
7203072 CIFC18 H20 N2 O2P 1 21/c 110.875; 4.72; 15.978
90; 107.312; 90
783Piotrkowska, Barbara; Gdaniec, Maria; Milewska, Maria J.; Połoński, Tadeusz
Aryl‒perfluoroaryl stacking interactions, hydrogen bonding and steric effects in controlling the structure of supramolecular assemblies of N,N′-diaryloxalamides
CrystEngComm, 2007, 9, 868
7203073 CIFC26 H14 F10 N2 O4P 1 21/c 19.9263; 5.6969; 21.257
90; 94.431; 90
1198.47Piotrkowska, Barbara; Gdaniec, Maria; Milewska, Maria J.; Połoński, Tadeusz
Aryl–perfluoroaryl stacking interactions, hydrogen bonding and steric effects in controlling the structure of supramolecular assemblies of N,N′-diaryloxalamides
CrystEngComm, 2007, 9, 868
7203074 CIFC16 H13 F5 N O2P -16.9797; 8.1338; 15.0081
78.383; 80.223; 67.53
767.15Piotrkowska, Barbara; Gdaniec, Maria; Milewska, Maria J.; Połoński, Tadeusz
Aryl–perfluoroaryl stacking interactions, hydrogen bonding and steric effects in controlling the structure of supramolecular assemblies of N,N′-diaryloxalamides
CrystEngComm, 2007, 9, 868

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