Crystallography Open Database

Information card for entry 7035807

Preview

Coordinates	7035807.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C76.28 H62 Co8.51 N9.43 O44.45
Calculated formula	C76.26 H61.94 Co8.513 N9.42 O44.446
Title of publication	Synthesis of cobalt cluster-based supramolecular triple-stranded helicates.
Authors of publication	Yoo, Hyojong; Lee, Jeonghee; Kang, Philjae; Choi, Moon-Gun
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	32
Pages of publication	14213 - 14216
a	23.9077 ± 0.0005 Å
b	23.9077 ± 0.0005 Å
c	17.2642 ± 0.0005 Å
α	90°
β	90°
γ	120°
Cell volume	8545.8 ± 0.4 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	5
Space group number	152
Hermann-Mauguin space group symbol	P 31 2 1
Hall space group symbol	P 31 2"
Residual factor for all reflections	0.083
Residual factor for significantly intense reflections	0.0729
Weighted residual factors for significantly intense reflections	0.2014
Weighted residual factors for all reflections included in the refinement	0.2107
Goodness-of-fit parameter for all reflections included in the refinement	1.095
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
153229 (current)	2015-08-08	cif/ Updating files of 7035806, 7035807 Original log message: Adding full bibliography for 7035806--7035807.cif.	7035807.cif
152071	2015-07-15	cif/ Adding structures of 7035806, 7035807 via cif-deposit CGI script.	7035807.cif