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Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology |
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| Description | Value | Connectivity | Reference | Comment | |||
|---|---|---|---|---|---|---|---|
| Atom 1 | Atom 2 | Atom 3 | Atom 4 | ||||
| rSbCl | 2.338 | 1 | 2 | 1982Iva/Ish:144-147 | axial re | ||
| rSbCl | 2.277 | 1 | 3 | 1982Iva/Ish:144-147 | equatorial re | ||
| aClSbCl | 90 | 2 | 1 | 3 | by symmetry | ||
| aClSbCl | 120 | 3 | 1 | 4 | by symmetry | ||
| Bond Type | Count |
|---|---|
| Cl-Sb | 5 |
| Atom | x (Å) | y (Å) | z (Å) |
|---|---|---|---|
| Sb1 | 0.0000 | 0.0000 | 0.0000 |
| Cl2 | 0.0000 | 0.0000 | 2.3380 |
| Cl3 | 0.0000 | 2.2770 | 0.0000 |
| Cl4 | 1.9719 | -1.1385 | 0.0000 |
| Cl5 | -1.9719 | -1.1385 | 0.0000 |
| Cl6 | 0.0000 | 0.0000 | -2.3380 |
| Sb1 | Cl2 | Cl3 | Cl4 | Cl5 | Cl6 | |
|---|---|---|---|---|---|---|
| Sb1 | 2.3380 | 2.2770 | 2.2770 | 2.2770 | 2.3380 | |
| Cl2 | 2.3380 | 3.2636 | 3.2636 | 3.2636 | 4.6760 | |
| Cl3 | 2.2770 | 3.2636 | 3.9439 | 3.9439 | 3.2636 | |
| Cl4 | 2.2770 | 3.2636 | 3.9439 | 3.9439 | 3.2636 | |
| Cl5 | 2.2770 | 3.2636 | 3.9439 | 3.9439 | 3.2636 | |
| Cl6 | 2.3380 | 4.6760 | 3.2636 | 3.2636 | 3.2636 |
| squib | reference | DOI |
|---|---|---|
| 1982Iva/Ish:144-147 | LS Ivashkevich, AA Ishchenko, VP Spiridonov, TG Strand, AA Ivanov, AN Nikolaev "Electron diffraction study of the structure and pseudorotation of antimony pentachloride in the gas phase" Zhurnal Strukturnoi Khimii 1982, 23(2), 144-147 |
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