Crystallography Open Database

Information card for entry 7708679

Preview

Coordinates	7708679.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H47 Fe N2 P3 Si
Calculated formula	C30 H47 Fe N2 P3 Si
Title of publication	Synthesis of Silyl Iron Dinitrogen Complexes for Activation of Dihydrogen and Catalytic Silylation of Dinitrogen
Authors of publication	Chang, Guoliang; Zhang, Peng; Yang, Wenjing; Dong, Yanhong; Xie, Shangqing; Sun, Hongjian; Li, Xiaoyan; Fuhr, Olaf; Fenske, Dieter
Journal of publication	Dalton Transactions
Year of publication	2021
a	16.2215 ± 0.0006 Å
b	16.2215 ± 0.0006 Å
c	24.4132 ± 0.0011 Å
α	90°
β	90°
γ	90°
Cell volume	6424 ± 0.4 Å³
Cell temperature	173 ± 0.5 K
Ambient diffraction temperature	173 ± 0.5 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0775
Residual factor for significantly intense reflections	0.067
Weighted residual factors for significantly intense reflections	0.1705
Weighted residual factors for all reflections included in the refinement	0.1829
Goodness-of-fit parameter for all reflections included in the refinement	1.087
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
270219 (current)	2021-11-03	cif/ Adding structures of 7708672, 7708673, 7708674, 7708675, 7708676, 7708677, 7708678, 7708679 via cif-deposit CGI script.	7708679.cif