Crystallography Open Database

Information card for entry 7124724

Preview

Coordinates	7124724.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C84 H93.9 Br2 F24 N19.05 O0.47 P2 Sb4
Calculated formula	C84 H93.896 Br2 F24 N19.052 O0.474 P2 Sb4
Title of publication	Bis(carbodicarbene)phosphenium trication: the case against hypervalency.
Authors of publication	Đorđević, Nemanja; Ganguly, Rakesh; Petković, Milena; Vidović, Dragoslav
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2016
Journal volume	52
Journal issue	63
Pages of publication	9789 - 9792
a	12.1048 ± 0.0003 Å
b	13.7318 ± 0.0004 Å
c	16.1379 ± 0.0005 Å
α	108.884 ± 0.0016°
β	98.2298 ± 0.0014°
γ	102.753 ± 0.0014°
Cell volume	2407.61 ± 0.12 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.117
Residual factor for significantly intense reflections	0.0532
Weighted residual factors for significantly intense reflections	0.0988
Weighted residual factors for all reflections included in the refinement	0.1178
Goodness-of-fit parameter for all reflections included in the refinement	1.021
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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