Crystallography Open Database

Information card for entry 7121032

Preview

Coordinates	7121032.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C72 H79 N18 O53 Tb3 Zn4
Calculated formula	C72 H79 N18 O53 Tb3 Zn4
Title of publication	Ambient chemical fixation of CO<sub>2</sub> using a highly efficient heterometallic helicate catalyst system.
Authors of publication	Wang, Li; Xu, Cong; Han, Qingxin; Tang, Xiaoliang; Zhou, Panpan; Zhang, Ruilian; Gao, Guoshu; Xu, Benhua; Qin, Wenwu; Liu, Weisheng
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2018
Journal volume	54
Journal issue	18
Pages of publication	2212 - 2215
a	17.31 ± 0.003 Å
b	12.286 ± 0.0006 Å
c	29.5628 ± 0.0016 Å
α	90°
β	102.028 ± 0.009°
γ	90°
Cell volume	6149.1 ± 1.2 Å³
Cell temperature	290.83 ± 0.1 K
Ambient diffraction temperature	290.83 ± 0.1 K
Number of distinct elements	6
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.1931
Residual factor for significantly intense reflections	0.1293
Weighted residual factors for significantly intense reflections	0.2756
Weighted residual factors for all reflections included in the refinement	0.3156
Goodness-of-fit parameter for all reflections included in the refinement	1.106
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
228439 (current)	2019-11-17	cif/ Updating files of 7121032, 7121033 Original log message: Adding full bibliography for 7121032--7121033.cif.	7121032.cif
204463	2017-12-22	cif/ Adding structures of 7121032, 7121033 via cif-deposit CGI script.	7121032.cif