Crystallography Open Database

Information card for entry 7019282

7019281 << 7019282 >> 7019283

Preview

Coordinates	7019282.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Cr2Mn(dpa)4(OTf)2(CH2Cl2)0.65
Formula	C42.65 H33.3 Cl1.3 Cr2 F6 Mn N12 O6 S2
Calculated formula	C42.65 H33.3 Cl1.3 Cr1.995 F6 Mn N12 O6 S2
Title of publication	Synthesis, characterization and thermal properties of trimetallic N(3)-Cr[quadruple bond, length as m-dash]CrM-N(3) azide complexes with M = Cr, Mn, Fe, and Co.
Authors of publication	Turov, Yevgeniya; Berry, John F.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	26
Pages of publication	8153 - 8161
a	34.498 ± 0.0008 Å
b	17.8985 ± 0.0004 Å
c	16.8592 ± 0.0004 Å
α	90°
β	108.144 ± 0.001°
γ	90°
Cell volume	9892.3 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	9
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0692
Residual factor for significantly intense reflections	0.0624
Weighted residual factors for significantly intense reflections	0.1624
Weighted residual factors for all reflections included in the refinement	0.1673
Goodness-of-fit parameter for all reflections included in the refinement	1.093
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7019282.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7019282.cif
62831	2012-07-09	cif/ Adding structures of 7019282, 7019283, 7019284, 7019285, 7019286, 7019287, 7019288 via cif-deposit CGI script.	7019282.cif