Crystallography Open Database

Information card for entry 7129321

Preview

Coordinates	7129321.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H40 Au2 Cl2 N2 O4 P2 S2
Calculated formula	C28 H40 Au2 Cl2 N2 O4 P2 S2
Title of publication	Au(I)-Mediated N2-Elimination from Triazaphospholes: A One-Pot Synthesis of Novel N2P2-Heterocycles
Authors of publication	Yue, Erlin; Dettling, Lea; Sklorz, Julian; Kaiser, Selina; Weber, Manuela; Muller, Christian
Journal of publication	Chemical Communications
Year of publication	2021
a	9.6463 ± 0.0002 Å
b	17.8725 ± 0.0004 Å
c	10.9159 ± 0.0002 Å
α	90°
β	114.088 ± 0.0007°
γ	90°
Cell volume	1718.06 ± 0.06 Å³
Cell temperature	102 ± 2 K
Ambient diffraction temperature	102 ± 2 K
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0296
Residual factor for significantly intense reflections	0.0233
Weighted residual factors for significantly intense reflections	0.0451
Weighted residual factors for all reflections included in the refinement	0.0465
Goodness-of-fit parameter for all reflections included in the refinement	1.133
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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