Crystallography Open Database

Information card for entry 7721023

Preview

No preview available: file is not found.

Coordinates	Coordinates are not available: file is not found.
Original paper (by DOI)	HTML

Structure parameters

Chemical name	LHCMo12
Formula	C28 H60 Mo12 N8 O52 S12
Calculated formula	C28 H60 Mo12 N8 O52 S12
Title of publication	Azole-carboxylate-modulated assembly of [Mo<sub>2</sub>O<sub>2</sub>S<sub>2</sub>]<sup>2+</sup> units: structural evolution from {Mo<sub>12</sub>} to {Mo<sub>16</sub>} rings for enhanced proton conductivity.
Authors of publication	Liu, Huachao; Tang, Rongqing; Ma, Yubin; Shao, Zhiyu; Xuan, Weimin
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2026
Journal volume	55
Journal issue	19
Pages of publication	7497 - 7501
a	9.6711 ± 0.0004 Å
b	14.2667 ± 0.0005 Å
c	16.4303 ± 0.0007 Å
α	70.022 ± 0.003°
β	73.351 ± 0.004°
γ	87.078 ± 0.003°
Cell volume	2038.46 ± 0.15 Å³
Cell temperature	170 ± 0.1 K
Ambient diffraction temperature	170 ± 0.1 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	0.041
Residual factor for significantly intense reflections	0.0398
Weighted residual factors for significantly intense reflections	0.1085
Weighted residual factors for all reflections included in the refinement	0.1093
Goodness-of-fit parameter for all reflections included in the refinement	1.082
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Version history is temporarily not available due to server issues.