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Information card for entry 7110593
Preview
| Coordinates | 7110593.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C60 H36 Ag4 Cl4 O16 |
|---|---|
| Calculated formula | C60 H33 Ag4 Cl4 O16 |
| Title of publication | A novel double-strand helical motif in a two-dimensional polymeric complex of silver(I) perchlorate with benzo[e]acephenanthrylene |
| Authors of publication | Munakata, Megumu; Suenaga, Yusaku; Sugimoto, Kunihisa; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Ning, Gui Ling |
| Journal of publication | Chemical Communications |
| Year of publication | 1999 |
| Journal issue | 16 |
| Pages of publication | 1545 |
| a | 14.114 ± 0.001 Å |
| b | 18.067 ± 0.0007 Å |
| c | 20.8589 ± 0.0004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 5319 ± 0.4 Å3 |
| Cell temperature | 273.2 K |
| Ambient diffraction temperature | 273.2 K |
| Number of distinct elements | 5 |
| Space group number | 60 |
| Hermann-Mauguin space group symbol | P b c n |
| Hall space group symbol | -P 2n 2ab |
| Residual factor for all reflections | 0.1156 |
| Residual factor for significantly intense reflections | 0.06 |
| Weighted residual factors for significantly intense reflections | 0.1374 |
| Weighted residual factors for all reflections included in the refinement | 0.1583 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.469 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176453 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7110593.cif |
| 134283 | 2015-03-24 | cif/ (antanas@echidna.ibt.lt) Replaced '_reflns_observed_expression', '_atom_type_scat_imag' and '_atom_site_calc_flags' tags with their correct tag counterparts ('_reflns_threshold_expression', '_atom_type_scat_dispersion_imag', '_atom_site_calc_flag'). The following command was used on the CIFs containing the tags: xargs -n1 -I{} sh -c 'cif_correct_tags --r cod-tools/trunk/perl-scripts/inputs/replacement_tags.lst {} | cif_filter -h {} | sponge {}' A total of 124 files were changed. |
7110593.cif |
| 95465 | 2014-01-28 | cif/ Adding structures of 7110593 via cif-deposit CGI script. |
7110593.cif |
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Users of the data should acknowledge the original authors of the
structural data.