Crystallography Open Database

Information card for entry 7024943

Preview

Coordinates	7024943.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C92 H72 Cl20 N28 Ni7 O2
Calculated formula	C92 H72 Cl20 N28 Ni7 O2
Title of publication	Probing the electronic communication of linear heptanickel and nonanickel string complexes by utilizing two redox-active [Ni2(napy)4]3+ moieties.
Authors of publication	Hua, Shao-An; Liu, Isiah Po-Chun; Hasanov, Hasan; Huang, Gin-Chen; Ismayilov, Rayyat Huseyn; Chiu, Chien-Lan; Yeh, Chen-Yu; Lee, Gene-Hsiang; Peng, Shie-Ming
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	16
Pages of publication	3890 - 3896
a	16.0614 ± 0.0003 Å
b	16.6227 ± 0.0003 Å
c	21.0026 ± 0.0004 Å
α	70.9557 ± 0.001°
β	77.102 ± 0.001°
γ	84.3794 ± 0.001°
Cell volume	5164.79 ± 0.17 Å³
Cell temperature	150 ± 1 K
Ambient diffraction temperature	150 ± 1 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1246
Residual factor for significantly intense reflections	0.0718
Weighted residual factors for significantly intense reflections	0.2065
Weighted residual factors for all reflections included in the refinement	0.2445
Goodness-of-fit parameter for all reflections included in the refinement	1.04
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
179954 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/49.	7024943.cif
92757	2014-01-12	cif/ Adding structures of 7024943, 7024944, 7024945 via cif-deposit CGI script.	7024943.cif