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Information card for entry 4063943
Preview
| Coordinates | 4063943.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C75 H60 Cl2 Fe N2 O2 P2 Pt2 |
|---|---|
| Calculated formula | C75 H60 Cl2 Fe N2 O2 P2 Pt2 |
| SMILES | c1[n]2c3c(cc1)ccc1c3c([Pt]2([P](c2ccccc2)(c2ccccc2)[c]23[cH]4[cH]5[cH]6[cH]2[Fe]27893456[c]3([P](c4ccccc4)(c4ccccc4)[Pt]4(c5c6c%10c(ccc[n]4%10)ccc6ccc5)c4ccc(OC)cc4)[cH]2[cH]7[cH]8[cH]93)c2ccc(OC)cc2)ccc1.C(Cl)Cl |
| Title of publication | Assembly of Cyclometalated Platinum(II) Complexes via 1,1′-Bis(diphenylphosphino)ferrocene Ligand: Kinetics and Mechanisms |
| Authors of publication | Nabavizadeh, S. Masoud; Amini, Hashem; Shahsavari, Hamid R.; Namdar, Masoud; Rashidi, Mehdi; Kia, Reza; Hemmateenejad, Bahram; Nekoeinia, Mohsen; Ariafard, Alireza; Hosseini, Fatemeh Niroomand; Gharavi, Alireza; Khalafi-Nezhad, Ali; Sharbati, Mohammad Taghi; Panahi, Farhad |
| Journal of publication | Organometallics |
| Year of publication | 2011 |
| Journal volume | 30 |
| Journal issue | 6 |
| Pages of publication | 1466 |
| a | 12.54 ± 0.003 Å |
| b | 14.801 ± 0.003 Å |
| c | 32.631 ± 0.007 Å |
| α | 90° |
| β | 95.88 ± 0.03° |
| γ | 90° |
| Cell volume | 6025 ± 2 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0855 |
| Residual factor for significantly intense reflections | 0.059 |
| Weighted residual factors for significantly intense reflections | 0.1369 |
| Weighted residual factors for all reflections included in the refinement | 0.1529 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178534 (current) | 2016-03-21 | cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/39. |
4063943.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4063943.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4063943.cif |
| 32733 | 2012-02-10 | ../uploads/cif-deposit/cod/cif Adding structures of 4063943 via cif-deposit CGI script. |
4063943.cif |
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Users of the data should acknowledge the original authors of the
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