Crystallography Open Database

Information card for entry 7702584

Preview

Coordinates	7702584.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	(μ~2~-η^5^-dimethylaminomethylcyclopentadienyl)-(η^5^-cyclopentadienyl)-iron- (trimethylsilylethynyl-dimethylsulfoxide-platinum(II)) benzene solvate
Formula	C26 H37 Fe N O Pt S Si
Calculated formula	C26 H37 Fe N O Pt S Si
Title of publication	Acetylides of cycloplatinated ferrocenylamines; synthesis and redox chemistry†
Authors of publication	McAdam, C. John; Blackie, Evan J.; Morgan, Joy L.; Mole, Sarah A.; Robinson, Brian H.; Simpson, Jim
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2001
Journal issue	16
Pages of publication	2362
a	31.9871 ± 0.0006 Å
b	10.3174 ± 0.0002 Å
c	19.321 ± 0.0003 Å
α	90°
β	120.872 ± 0.001°
γ	90°
Cell volume	5472.95 ± 0.18 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	8
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	0.067
Residual factor for significantly intense reflections	0.0454
Weighted residual factors for significantly intense reflections	0.1046
Weighted residual factors for all reflections included in the refinement	0.1117
Goodness-of-fit parameter for all reflections included in the refinement	0.994
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
243911 (current)	2019-11-28	cif/ Adding structures of 7702584, 7702585 via cif-deposit CGI script.	7702584.cif