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Information card for entry 2018395
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Coordinates | 2018395.cif |
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Structure factors | 2018395.hkl |
Original IUCr paper | HTML |
Common name | guanylurea (hydrogen fluorophosphonate)~0.76~ (hydrogen phosphite)~0.24~ |
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Chemical name | 2-carbamoylguanidinium‒hydrogen fluorophosphonate‒hydrogen phosphite (1/0.76/0.24) |
Formula | C2 H8.24 F0.76 N4 O4 P |
Calculated formula | C2 H8.24 F0.76 N4 O4 P |
Title of publication | Mixed crystals of 2-carbamoylguanidinium with hydrogen fluorophosphonate and hydrogen phosphite in the ratios 1:0, 0.76(2):0.24(2) and 0.115(7):0.885(7) |
Authors of publication | Fábry, Jan; Fridrichová, Michaela; Dušek, Michal; Fejfarová, Karla; Krupková, Radmila |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 2012 |
Journal volume | 68 |
Journal issue | 2 |
Pages of publication | o76 - o83 |
a | 6.6648 ± 0.0002 Å |
b | 6.9435 ± 0.0002 Å |
c | 16.2924 ± 0.0004 Å |
α | 90° |
β | 97.185 ± 0.003° |
γ | 90° |
Cell volume | 748.04 ± 0.04 Å3 |
Cell temperature | 120 ± 0.14 K |
Ambient diffraction temperature | 120 ± 14 K |
Number of distinct elements | 6 |
Space group number | 9 |
Hermann-Mauguin space group symbol | C 1 c 1 |
Hall space group symbol | C -2yc |
Residual factor for all reflections | 0.0508 |
Residual factor for significantly intense reflections | 0.0503 |
Weighted residual factors for significantly intense reflections | 0.1137 |
Weighted residual factors for all reflections included in the refinement | 0.1139 |
Goodness-of-fit parameter for all reflections included in the refinement | 2.96 |
Diffraction radiation wavelength | 1.5418 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
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The link is: https://www.crystallography.net/2018395.html
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