Crystallography Open Database

Information card for entry 7019873

7019872 << 7019873 >> 7019874

Preview

Coordinates	7019873.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H31 N2 Ni O6 S10
Calculated formula	C24 H31 N2 Ni O6 S10
Title of publication	Crystal structures and magnetic properties of (4,4'-phenylazophenyl)diammonium(crown ethers)[Ni(dmit)(2)](2) crystals.
Authors of publication	Hoshino, Norihisa; Kubo, Kazuya; Nakamura, Takayoshi; Akutagawa, Tomoyuki
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	31
Pages of publication	9297 - 9303
a	11.4382 ± 0.0006 Å
b	12.4187 ± 0.0007 Å
c	13.6457 ± 0.0008 Å
α	104.936 ± 0.0019°
β	108.641 ± 0.0019°
γ	100.415 ± 0.0015°
Cell volume	1699.72 ± 0.17 Å³
Cell temperature	103 K
Ambient diffraction temperature	103 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 significantly intense reflections	0.0359
Weighted residual factors for all reflections included in the refinement	0.0942
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179902 (current)	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/98.	7019873.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7019873.cif
64336	2012-08-12	cif/ Adding structures of 7019873, 7019874 via cif-deposit CGI script.	7019873.cif