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Information card for entry 4123001
Preview
| Coordinates | 4123001.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Nickel Telurium Trimethylphosphine C60 complex |
|---|---|
| Formula | C84 H72 Ni9 P8 Te6 |
| Calculated formula | C84 H72 Ni9 P8 Te6 |
| SMILES | C[P]([Ni]123456[Ni]789%10%11%12[Ni]%13%14%15%161([P](C)(C)C)[Te]12[Ni]2%17%1838([P](C)(C)C)[Ni]38%19%20%10([P](C)(C)C)[Ni]%10%21%22%237([P](C)(C)C)[Ni]7%24%11%13([P](C)(C)C)([Ni]493([P](C)(C)C)([Te]5%178)([Te]6%157)[Te]%19%21%24)[Te]%16%22[Ni]%12%1412%10([P](C)(C)C)[Te]%18%20%23)(C)C.c12c3c4c5c1c1c6c7c8c1c1c2c2c9c3c3c%10c9c9c%11c2c1c1c8c2c8c%12c%13c%14c%15c%16c%12c(c78)c7c8c%16c%12c%15c%15c%16c%14c%14c%13c2c1c%11c%14c9c%16c%10c%15c1c3c4c(c%121)c8c5c67 |
| Title of publication | Ferromagnetic Ordering in Superatomic Solids. |
| Authors of publication | Lee, Chul-Ho; Liu, Lian; Bejger, Christopher; Turkiewicz, Ari; Goko, Tatsuo; Arguello, Carlos J.; Frandsen, Benjamin A.; Cheung, Sky C.; Medina, Teresa; Munsie, Timothy J. S.; D'Ortenzio, Robert; Luke, Graeme M.; Besara, Tiglet; Lalancette, Roger A.; Siegrist, Theo; Stephens, Peter W.; Crowther, Andrew C.; Brus, Louis E.; Matsuo, Yutaka; Nakamura, Eiichi; Uemura, Yasutomo J.; Kim, Philip; Nuckolls, Colin; Steigerwald, Michael L.; Roy, Xavier |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2014 |
| Pages of publication | 141120142959006 |
| a | 14.75719 ± 0.00028 Å |
| b | 14.75719 ± 0.00028 Å |
| c | 31.8543 ± 0.00089 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 6007.7 ± 0.2 Å3 |
| Cell temperature | 295 K |
| Ambient diffraction temperature | 295 K |
| Number of distinct elements | 5 |
| Space group number | 148 |
| Hermann-Mauguin space group symbol | R -3 :H |
| Hall space group symbol | -R 3 |
| Residual factor R(I) for significantly intense reflections | 0.009 |
| Goodness-of-fit parameter for all reflections | 2.544 |
| Method of determination | powder diffraction |
| Diffraction radiation wavelength | 0.69991 Å |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 264242 (current) | 2021-04-16 | cif/4 Fixing some Z values and formulae |
4123001.cif |
| 179032 | 2016-03-22 | cif/4/12/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/12/30. |
4123001.cif |
| 127700 | 2014-11-21 | cif/ Adding structures of 4123001 via cif-deposit CGI script. |
4123001.cif |
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Users of the data should acknowledge the original authors of the
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