Crystallography Open Database

Information card for entry 7242094

7242093 << 7242094 >> 7242095

Preview

Coordinates	7242094.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62 H48 N10 Ni O12
Calculated formula	C62 H48 N10 Ni O12
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	11.389 ± 0.005 Å
b	25.046 ± 0.005 Å
c	10.134 ± 0.005 Å
α	90 ± 0.005°
β	106.839 ± 0.005°
γ	90 ± 0.005°
Cell volume	2766.8 ± 1.9 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1249
Residual factor for significantly intense reflections	0.0627
Weighted residual factors for significantly intense reflections	0.1582
Weighted residual factors for all reflections included in the refinement	0.1936
Goodness-of-fit parameter for all reflections included in the refinement	1.019
Diffraction radiation wavelength	0.71069 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.	7242094.cif
260998	2021-01-16	cif/ Adding structures of 7242094, 7242095, 7242096, 7242097, 7242098, 7242099, 7242100, 7242101, 7242102, 7242103 via cif-deposit CGI script.	7242094.cif