Crystallography Open Database

Information card for entry 7239162

Preview

Coordinates	7239162.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H15 Cu4 N2 O14 P4
Calculated formula	C14 H15 Cu4 N2 O14 P4
Title of publication	Eight novel metal diphosphonates based on 2-(4-pyridinyl)-1-hydroxyl-1,1-ethylidenediphosphonate: syntheses, structures, and magnetic properties
Authors of publication	Ma, Yun-Sheng; Yin, Wen-Yu; Cai, Wang-Shui; Zhu, Ping-Zhou; Tang, Xiao-Yan; Yuan, Rong-Xin; Roy, Soumyajit
Journal of publication	RSC Advances
Year of publication	2013
Journal volume	3
Journal issue	40
Pages of publication	18430
a	5.5564 ± 0.0011 Å
b	9.887 ± 0.002 Å
c	10.489 ± 0.002 Å
α	71.93 ± 0.03°
β	88.77 ± 0.03°
γ	78.8 ± 0.03°
Cell volume	536.9 ± 0.2 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 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	0.1042
Residual factor for significantly intense reflections	0.0629
Weighted residual factors for significantly intense reflections	0.1189
Weighted residual factors for all reflections included in the refinement	0.1319
Goodness-of-fit parameter for all reflections included in the refinement	1.047
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
244576 (current)	2019-11-28	cif/ Adding structures of 7239156, 7239157, 7239158, 7239159, 7239160, 7239161, 7239162, 7239163 via cif-deposit CGI script.	7239162.cif