Crystallography Open Database

Information card for entry 7102171

Preview

Coordinates	7102171.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18.5 H23.5 Cl6.5 N3 Pt
Calculated formula	C18.5 H23.5 Cl6.5 N3 Pt
Title of publication	Tandem pinacol coupling-rearrangement of aromatic aldehydes with hydrogen catalyzed by a combination of a platinum complex and a polyoxometalate.
Authors of publication	Branytska, Olena; Shimon, Linda J W; Neumann, Ronny
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2007
Journal issue	38
Pages of publication	3957 - 3959
a	11.161 ± 0.0003 Å
b	15.051 ± 0.0004 Å
c	15.221 ± 0.0003 Å
α	98.929 ± 0.0017°
β	94.35 ± 0.0016°
γ	90.985 ± 0.0011°
Cell volume	2517.54 ± 0.11 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0366
Residual factor for significantly intense reflections	0.028
Weighted residual factors for significantly intense reflections	0.066
Weighted residual factors for all reflections included in the refinement	0.0697
Goodness-of-fit parameter for all reflections included in the refinement	1.076
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7102171.html