Crystallography Open Database

Information card for entry 4329693

Preview

Coordinates	4329693.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H76 Cu13 Mo24 N48 O104 P2
Calculated formula	C32 H36 Cu13 Mo24 N48 O104 P2
Title of publication	Two Triazole-Based Metal-Organic Frameworks Constructed from Nanosized Cu20 and Cu30 Wheels
Authors of publication	Chan-Zi Ruan; Ru Wen; Min-Xia Liang; Xiang-Jian Kong; Yan-Ping Ren; La-Sheng Long; Rong-Bin Huang; Lan-Sun Zheng
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	7587 - 7591
a	15.325 ± 0.006 Å
b	16.472 ± 0.006 Å
c	17.072 ± 0.006 Å
α	70.144 ± 0.007°
β	64.567 ± 0.007°
γ	67.516 ± 0.007°
Cell volume	3516 ± 2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1091
Residual factor for significantly intense reflections	0.078
Weighted residual factors for significantly intense reflections	0.1659
Weighted residual factors for all reflections included in the refinement	0.1833
Goodness-of-fit parameter for all reflections included in the refinement	1.025
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/4329693.html