Crystallography Open Database

Information card for entry 7703173

Preview

Coordinates	7703173.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H78 Cl2 Co14 Mo24 N24 O82
Calculated formula	C60 H78 Cl2 Co14 Mo24 N24 O82
Title of publication	A novel sandwich shaped {CoCoMo} cluster with a Co triangle encapsulated in two capped Co<sup>III</sup>CoMoO<sub>40</sub> fragments.
Authors of publication	Li, Hai-Ye; Pang, Hua-Yu; Yao, Peng-Fei; Huang, Fu-Ping; Bian, He-Dong; Liang, Fu-Pei
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	5
Pages of publication	1375 - 1379
a	36.6408 ± 0.0018 Å
b	22.3598 ± 0.0009 Å
c	22.75 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	18639 ± 2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.0815
Residual factor for significantly intense reflections	0.0549
Weighted residual factors for significantly intense reflections	0.1481
Weighted residual factors for all reflections included in the refinement	0.1601
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
248940 (current)	2020-03-05	cif/ Updating files of 7703173 Original log message: Adding full bibliography for 7703173.cif.	7703173.cif
246466	2020-01-03	cif/ Adding structures of 7703173 via cif-deposit CGI script.	7703173.cif