Crystallography Open Database

Information card for entry 7030612

Preview

Coordinates	7030612.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C70 H42 F12 N4 O4 Pt2
Calculated formula	C70 H42 F12 N4 O4 Pt2
Title of publication	Reductive dearomatization of a substituted benzene triggered by a strong oxidant
Authors of publication	Tan, Runyu; Song, Datong
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	44
Pages of publication	9892 - 9897
a	32.542 ± 0.002 Å
b	11.9573 ± 0.0011 Å
c	21.378 ± 0.0017 Å
α	90°
β	127.996 ± 0.004°
γ	90°
Cell volume	6555.4 ± 1 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
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	0.0635
Residual factor for significantly intense reflections	0.0378
Weighted residual factors for significantly intense reflections	0.0896
Weighted residual factors for all reflections included in the refinement	0.0959
Goodness-of-fit parameter for all reflections included in the refinement	0.997
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Duplicate of	7002764
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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