Crystallography Open Database

Information card for entry 2012363

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Coordinates	2012363.cif
Original IUCr paper	HTML

Structure parameters

Common name	fac-Re(CO)~3~(dpknph)Cl.dmso
Chemical name	fac-Tricarbonylchloro(di-2-pyridylmethanone p-nitrophenylhydrazone)rhenium(I) dimethyl sulfoxide solvate
Formula	C22 H19 Cl N5 O6 Re S
Calculated formula	C22 H19 Cl N5 O6 Re S
Title of publication	The optical sensor <i>fac</i>-tricarbonylchloro(di-2-pyridylmethanone <i>p</i>-nitrophenylhydrazone)rhenium(I) dimethyl sulfoxide solvate
Authors of publication	Bakir, Mohammed
Journal of publication	Acta Crystallographica Section C
Year of publication	2001
Journal volume	57
Journal issue	12
Pages of publication	1371 - 1373
a	21.104 ± 0.002 Å
b	14.486 ± 0.002 Å
c	18.962 ± 0.002 Å
α	90°
β	116.408 ± 0.007°
γ	90°
Cell volume	5192 ± 1.1 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0335
Residual factor for significantly intense reflections	0.0266
Weighted residual factors for significantly intense reflections	0.0607
Weighted residual factors for all reflections included in the refinement	0.0641
Goodness-of-fit parameter for all reflections included in the refinement	1.081
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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