Crystallography Open Database

Information card for entry 7236098

Preview

Coordinates	7236098.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	3,3',5,5'-tetrakis(p-carboxyphenyl)-2,2',6,6'-tetramethoxy-1,1'-biphenyl
Formula	C44 H30 Cd0.87 Mn0.63 O12
Calculated formula	C44 H30 Cd0.871 Mn0.629 O12
Title of publication	Diverse isostructural MOFs by postsynthetic metal node metathesis: anionic-to-cationic framework conversion, luminescence and separation of dyes
Authors of publication	Seth, Soana; Savitha, Govardhan; Moorthy, Jarugu Narasimha
Journal of publication	Journal of Materials Chemistry A
Year of publication	2015
Journal volume	3
Journal issue	45
Pages of publication	22915
a	15.957 ± 0.004 Å
b	16.46 ± 0.004 Å
c	17.3 ± 0.005 Å
α	106.07 ± 0.006°
β	100.85 ± 0.005°
γ	113.408 ± 0.005°
Cell volume	3770.9 ± 1.7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.2675
Residual factor for significantly intense reflections	0.1472
Weighted residual factors for significantly intense reflections	0.3403
Weighted residual factors for all reflections included in the refinement	0.401
Goodness-of-fit parameter for all reflections included in the refinement	1.131
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
233910 (current)	2019-11-23	cif/ Adding structures of 7236083, 7236084, 7236085, 7236086, 7236087, 7236088, 7236089, 7236090, 7236091, 7236092, 7236093, 7236094, 7236095, 7236096, 7236097, 7236098 via cif-deposit CGI script.	7236098.cif