Crystallography Open Database

Information card for entry 7130034

Preview

Coordinates	7130034.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H36 Cl5 O P2 Re
Calculated formula	C40 H36 Cl5 O P2 Re
Title of publication	An aromatic dimetallapolycyclic complex with two rhenapyrylium rings
Authors of publication	Bai, Wei; Sun, Yue; Wang, Yilun; Zhou, Yan; Zhao, Yue; Bao, Xiao; Yang, Li
Journal of publication	Chemical Communications
Year of publication	2022
a	10.3695 ± 0.0006 Å
b	12.1973 ± 0.0008 Å
c	16.6779 ± 0.001 Å
α	97.106 ± 0.001°
β	96.7 ± 0.001°
γ	102.413 ± 0.001°
Cell volume	2021.8 ± 0.2 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0253
Residual factor for significantly intense reflections	0.0243
Weighted residual factors for significantly intense reflections	0.0623
Weighted residual factors for all reflections included in the refinement	0.0628
Goodness-of-fit parameter for all reflections included in the refinement	1.048
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7130034.html