Crystallography Open Database

Information card for entry 7220010

7220009 << 7220010 >> 7220011

Preview

Coordinates	7220010.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C112 H98 Mn5 O44
Calculated formula	C108 H74 Mn5 O38
Title of publication	A family of coordination polymers assembled with a flexible hexacarboxylate ligand and auxiliary N-donor ligands: syntheses, structures, and physical properties
Authors of publication	Zhang, Hong-Mei; Yang, Jin; Liu, Ying-Ying; Kang, Da-Wei; Ma, Jian-Fang
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	16
Pages of publication	3181
a	16.7488 ± 0.0009 Å
b	12.8214 ± 0.0009 Å
c	30.458 ± 0.002 Å
α	90°
β	116.084 ± 0.004°
γ	90°
Cell volume	5874.5 ± 0.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.1612
Residual factor for significantly intense reflections	0.083
Weighted residual factors for significantly intense reflections	0.1674
Weighted residual factors for all reflections included in the refinement	0.1875
Goodness-of-fit parameter for all reflections included in the refinement	1.085
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
180531 (current)	2016-03-26	cif/7/22/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/22/00.	7220010.cif
138528	2015-06-07	cif/ Updating files of 7220010, 7220011, 7220012, 7220013, 7220014, 7220015, 7220016, 7220017, 7220018 Original log message: Adding full bibliography for 7220010--7220018.cif.	7220010.cif
134468	2015-03-28	cif/ Adding structures of 7220010, 7220011, 7220012, 7220013, 7220014, 7220015, 7220016, 7220017, 7220018 via cif-deposit CGI script.	7220010.cif