Crystallography Open Database

Information card for entry 4087541

Preview

Coordinates	4087541.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	triclinic
Formula	C74 H67 B2 Cl2 F8 O4 Os P3
Calculated formula	C74 H67 B2 Cl2 F8 O4 Os P3
Title of publication	Reactions of Osmium Hydrido Alkenylcarbyne with Allenoates: Insertion and [3 + 2] Annulation
Authors of publication	Zhou, Xiaoxi; He, Xiehua; Lin, Jianfeng; Zhuo, Qingde; Chen, Zhixin; Zhang, Hong; Wang, Jianbo; Xia, Haiping
Journal of publication	Organometallics
Year of publication	2015
Journal volume	34
Journal issue	9
Pages of publication	1742
a	13.0016 ± 0.0004 Å
b	13.3826 ± 0.0009 Å
c	22.8476 ± 0.0006 Å
α	78.566 ± 0.001°
β	80.866 ± 0.001°
γ	61.919 ± 0.001°
Cell volume	3427.9 ± 0.3 Å³
Cell temperature	153 K
Ambient diffraction temperature	153 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	0.0958
Residual factor for significantly intense reflections	0.0698
Weighted residual factors for significantly intense reflections	0.1576
Weighted residual factors for all reflections included in the refinement	0.1848
Goodness-of-fit parameter for all reflections included in the refinement	1.104
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
236843 (current)	2019-11-24	cif/ Adding structures of 4087538, 4087539, 4087540, 4087541, 4087542, 4087543, 4087544 via cif-deposit CGI script.	4087541.cif