Information card for entry 4001042
| Formula |
C24 H28 Cu F12 N4 P2 |
| Calculated formula |
C24 H28 Cu F12 N4 P2 |
| SMILES |
[Cu]([F][P](F)(F)(F)(F)F)([F][P](F)(F)(F)(F)F)([n]1ccc(cc1)C)([n]1ccc(cc1)C)([n]1ccc(cc1)C)[n]1ccc(cc1)C |
| Title of publication |
Selective Gas Adsorption in One-Dimensional, Flexible Cu^II^ Coordination Polymers with Polar Units |
| Authors of publication |
Noro, Shin-ichiro; Tanaka, Daisuke; Sakamoto, Hirotoshi; Shimomura, Satoru; Kitagawa, Susumu; Takeda, Sadamu; Uemura, Kazuhiro; Kita, Hidetoshi; Akutagawa, Tomoyuki; Nakamura, Takayoshi |
| Journal of publication |
Chemistry of Materials |
| Year of publication |
2009 |
| Journal volume |
21 |
| Journal issue |
14 |
| Pages of publication |
3346 - 3355 |
| a |
10.9807 ± 0.0006 Å |
| b |
16.9871 ± 0.0007 Å |
| c |
17.3239 ± 0.0007 Å |
| α |
81.0128 ± 0.0014° |
| β |
82.301 ± 0.002° |
| γ |
75.0575 ± 0.0016° |
| Cell volume |
3068.9 ± 0.2 Å3 |
| Cell temperature |
173.1 K |
| Number of distinct elements |
6 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for significantly intense reflections |
0.0353 |
| Weighted residual factors for all reflections included in the refinement |
0.0591 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.064 |
| Diffraction radiation wavelength |
0.71075 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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