Crystallography Open Database

Information card for entry 7242095

7242094 << 7242095 >> 7242096

Preview

Coordinates	7242095.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62 H60 N8 Ni2 O13
Calculated formula	C62 H60 N8 Ni2 O13
Title of publication	Ten polytorsional-amide-induced helical-based coordination polymers with difunctional electrochemical activities
Authors of publication	Liu, Guocheng; Zhao, Jing; Liang, Shuang; Li, Yan; Chang, Zhihan; Wang, Xiuli; Chen, Baokuan
Journal of publication	CrystEngComm
Year of publication	2021
Journal volume	23
Journal issue	5
Pages of publication	1263 - 1271
a	27.1381 ± 0.0015 Å
b	9.546 ± 0.0005 Å
c	26.1291 ± 0.0014 Å
α	90°
β	119.788 ± 0.002°
γ	90°
Cell volume	5874.6 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0659
Residual factor for significantly intense reflections	0.0397
Weighted residual factors for significantly intense reflections	0.0985
Weighted residual factors for all reflections included in the refinement	0.1107
Goodness-of-fit parameter for all reflections included in the refinement	1.015
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
262568 (current)	2021-03-05	cif/ Updating files of 7242094, 7242095, 7242096, 7242097, 7242098, 7242099, 7242100, 7242101, 7242102, 7242103 Original log message: Adding full bibliography for 7242094--7242103.cif.	7242095.cif
260998	2021-01-16	cif/ Adding structures of 7242094, 7242095, 7242096, 7242097, 7242098, 7242099, 7242100, 7242101, 7242102, 7242103 via cif-deposit CGI script.	7242095.cif