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Information card for entry 2101952
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Coordinates | 2101952.cif |
---|---|
Original IUCr paper | HTML |
Common name | Chloro-bis(trichlorophosphazeno)methyl hexachlorophosphate |
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Chemical name | [N-(chloroformimidoyl)phosphorimidic trichloridato]trichlorophosphorus hexachlorophosphate |
Formula | C Cl13 N2 P3 |
Calculated formula | C Cl13 N2 P3 |
SMILES | ClC(=N[P+](Cl)(Cl)Cl)N=P(Cl)(Cl)Cl.P(Cl)(Cl)(Cl)(Cl)(Cl)[Cl-] |
Title of publication | Structures of the Phosphazenes [ClC(NPCl~3~)~2~]^+^PCl~6~^{-^} and [CH~3~C(NPCl~3~)~2~]^+^SbCl~6~^{-^} at 90 K |
Authors of publication | Belaj, F. |
Journal of publication | Acta Crystallographica Section B |
Year of publication | 1997 |
Journal volume | 53 |
Journal issue | 6 |
Pages of publication | 953 - 960 |
a | 9.958 ± 0.002 Å |
b | 11.546 ± 0.002 Å |
c | 15.726 ± 0.002 Å |
α | 90° |
β | 96.9 ± 0.01° |
γ | 90° |
Cell volume | 1795 ± 0.5 Å3 |
Cell temperature | 90 ± 2 K |
Ambient diffraction temperature | 90 ± 2 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0433 |
Residual factor for significantly intense reflections | 0.0313 |
Weighted residual factors for all reflections | 0.0854 |
Weighted residual factors for significantly intense reflections | 0.0748 |
Goodness-of-fit parameter for all reflections | 1.063 |
Goodness-of-fit parameter for significantly intense reflections | 1.052 |
Diffraction radiation wavelength | 0.71069 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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