Crystallography Open Database

Information card for entry 7221932

7221931 << 7221932 >> 7221933

Preview

Coordinates	7221932.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C202 H166 Cl30 N12 O24 S24
Calculated formula	C202 H156 Cl30 N12 O24 S24
Title of publication	‘Honeycomb’ nanotube assembly based on thiacalix[4]arene derivatives by weak interactions
Authors of publication	Wang, Wei; Yang, Weiping; Guo, Rong; Gong, Shuling
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	40
Pages of publication	7663
a	23.994 ± 0.006 Å
b	23.994 ± 0.006 Å
c	11.648 ± 0.005 Å
α	90°
β	90°
γ	120°
Cell volume	5807 ± 3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	165
Hermann-Mauguin space group symbol	P -3 c 1
Hall space group symbol	-P 3 2"c
Residual factor for all reflections	0.2083
Residual factor for significantly intense reflections	0.1262
Weighted residual factors for significantly intense reflections	0.3612
Weighted residual factors for all reflections included in the refinement	0.4332
Goodness-of-fit parameter for all reflections included in the refinement	1.375
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
171094 (current)	2015-12-09	cif/ Updating files of 7221927, 7221928, 7221929, 7221930, 7221931, 7221932 Original log message: Adding full bibliography for 7221927--7221932.cif.	7221932.cif
153779	2015-08-29	cif/ Adding structures of 7221927, 7221928, 7221929, 7221930, 7221931, 7221932 via cif-deposit CGI script.	7221932.cif