Crystallography Open Database

Information card for entry 7216481

Preview

Coordinates	7216481.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H33 Cu3 N7 O7
Calculated formula	C41 H33 Cu3 N7 O7
Title of publication	Delicate modulated assembly of a new kind of trinuclear copper(ii) motif governed by N-containing agents
Authors of publication	Wu, Shu-Ting; Tang, Hong-Liang; Lu, Shu-Mei; Ye, Qiao-Yan; Huang, Xi-He; Huang, Chang-Cang; Hu, Xiao-Lin; Zheng, Shou-Tian
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	42
Pages of publication	9792
a	14.76 ± 0.003 Å
b	14.694 ± 0.003 Å
c	18.395 ± 0.004 Å
α	90°
β	98.88 ± 0.03°
γ	90°
Cell volume	3941.8 ± 1.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0689
Residual factor for significantly intense reflections	0.0421
Weighted residual factors for significantly intense reflections	0.1233
Weighted residual factors for all reflections included in the refinement	0.1422
Goodness-of-fit parameter for all reflections included in the refinement	0.922
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180495 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/64.	7216481.cif
126381	2014-11-06	cif/ Updating files of 7216478, 7216479, 7216480, 7216481, 7216482 Original log message: Adding full bibliography for 7216478--7216482.cif.	7216481.cif
116346	2014-06-10	cif/ Adding structures of 7216478, 7216479, 7216480, 7216481, 7216482 via cif-deposit CGI script.	7216481.cif