Crystallography Open Database

Information card for entry 7123884

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Coordinates	7123884.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C96 H108 Cr3 N6 P3
Calculated formula	C96 H108 Cr3 N6 P3
Title of publication	Synthesis and reactivity of asymmetric Cr(I) dinitrogen complexes supported by cyclopentadienyl-phosphine ligands
Authors of publication	Li, Jiapeng; Yin, Jianhao; Wang, Gao-Xiang; Yin, Zhu-Bao; Zhang, Wen-Xiong; Xi, Zhenfeng
Journal of publication	Chemical Communications
Year of publication	2019
a	26.5505 ± 0.0005 Å
b	17.7159 ± 0.0002 Å
c	41.6344 ± 0.0005 Å
α	90°
β	92.826 ± 0.002°
γ	90°
Cell volume	19559.6 ± 0.5 Å³
Cell temperature	179.99 ± 0.1 K
Ambient diffraction temperature	179.99 ± 0.1 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	I 1 2/a 1
Hall space group symbol	-I 2ya
Residual factor for all reflections	0.093
Residual factor for significantly intense reflections	0.0664
Weighted residual factors for significantly intense reflections	0.1904
Weighted residual factors for all reflections included in the refinement	0.209
Goodness-of-fit parameter for all reflections included in the refinement	1.043
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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