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Information card for entry 4319139
Preview
| Coordinates | 4319139.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C4 H12 Cl4 N2 Pb |
|---|---|
| Calculated formula | C4 H12 Cl4 N2 Pb |
| SMILES | [Pb](Cl)(Cl)(Cl)(Cl)([Cl-])[Cl-].[NH2+]1CC[NH2+]CC1 |
| Title of publication | An Additional Structural and Electrical Study of Polymeric Haloplumbates(II) with Heterocyclic Diprotonated Amines |
| Authors of publication | Anna Bonamartini Corradi; Anna Maria Ferrari; Lara Righi; Paolo Sgarabotto |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2001 |
| Journal volume | 40 |
| Pages of publication | 218 - 223 |
| a | 5.778 ± 0.002 Å |
| b | 22.61 ± 0.03 Å |
| c | 9.061 ± 0.004 Å |
| α | 90 ± 0° |
| β | 95.37 ± 0.06° |
| γ | 90 ± 0° |
| Cell volume | 1178.5 ± 1.7 Å3 |
| Cell temperature | 298 K |
| Ambient diffraction temperature | 298 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for significantly intense reflections | 0.052 |
| Weighted residual factors for all reflections included in the refinement | 0.054 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | X |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 192276 (current) | 2017-02-19 | cif/4/ (antanas@echidna.ibt.lt) Changing the _atom_site_occupancy data item value from '.' to '1' for all fully occupied atom sites in entries 4020333, 4022067, 4024209, 4024679, 4024681, 4024682, 4025244, 4100722, 4101910, 4303140, 4303141, 4303739, 4305417, 4305418, 4308230, 4308235, 4312548, 4313400, 4313401, 4313402, 4317545, 4317905, 4319035, 4319139, 4319140, 4319141, 4319142, 4321031, 4321032, 4321034, 4321035, 4321036, 4321037, 4321038, 4321902, 4322606, 4322699, 4324063, 4324064, 4324065. |
4319139.cif |
| 192225 | 2017-02-17 | cif/4/31/91/ (antanas@echidna.ibt.lt) Removing atoms 'Cl31' and 'Cl41' since they are symmetrical equivalents of atoms 'Cl3' and 'Cl4' respectively in entry 4319139. All occurrences of these atoms in the _geom_angle and the _geom_bond loop were marked as being the 3_555 symmetry equivalents of atoms their corresponding atoms. |
4319139.cif |
| 192164 | 2017-02-15 | cif/4/31/91/ (antanas@echidna.ibt.lt) Marking attached hydrogen atoms in entry 4319139. |
4319139.cif |
| 176467 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4319139.cif |
| 120093 | 2014-07-12 | Adding DOIs to range 4/31 structures. | 4319139.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4319139.cif |
| 15871 | 2011-03-19 | ../uploads/cif-deposit/cod/cif Adding structures of 4319139 via cif-deposit CGI script. |
4319139.cif |
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