Crystallography Open Database

Information card for entry 7242012

7242011 << 7242012 >> 7242013

Preview

Coordinates	7242012.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H60 Co2 N4 O24 P4 Si
Calculated formula	C44 H60 Co2 N4 O24 P4 Si
Title of publication	Fabrication of new structures from a 3D cobalt phosphonate network: structural transformation and proton conductivity investigation
Authors of publication	Min, Xue; Tian, Hong-rui; Li, Ming; Tian, Di
Journal of publication	CrystEngComm
Year of publication	2021
Journal volume	23
Journal issue	4
Pages of publication	876 - 883
a	14.8494 ± 0.0014 Å
b	14.9534 ± 0.0013 Å
c	15.098 ± 0.0013 Å
α	67.608 ± 0.002°
β	88.443 ± 0.002°
γ	64.186 ± 0.002°
Cell volume	2751.4 ± 0.4 Å³
Cell temperature	296.15 K
Ambient diffraction temperature	296.15 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	0.0959
Residual factor for significantly intense reflections	0.0587
Weighted residual factors for significantly intense reflections	0.1309
Weighted residual factors for all reflections included in the refinement	0.1514
Goodness-of-fit parameter for all reflections included in the refinement	1.037
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
261610 (current)	2021-02-05	cif/ Updating files of 7241867, 7241868, 7241869, 7242011, 7242012, 7242013, 7242014 Original log message: Adding full bibliography for 7241867--7242014.cif.	7242012.cif
260358	2021-01-02	cif/ Adding structures of 7242011, 7242012, 7242013, 7242014 via cif-deposit CGI script.	7242012.cif