Crystallography Open Database

Information card for entry 7710486

Preview

Coordinates	7710486.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H104 Ge2.28 N4 Si7.72
Calculated formula	C60 H104 Ge2.2748 N4 Si7.7252
Title of publication	Efficient transfer hydrogenation of ketones using molybdenum complexes by comprehensively verifying the auxiliary ligands.
Authors of publication	Wang, Zheng; Liu, Yahuan; Han, Mingyang; Ma, Ning; Lyu, Quanming; Liu, Qingbin; Sun, Wen-Hua
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2022
Journal volume	51
Journal issue	29
Pages of publication	10983 - 10991
a	16.3651 ± 0.0005 Å
b	16.3651 ± 0.0005 Å
c	27.0314 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	7239.5 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	114
Hermann-Mauguin space group symbol	P -4 21 c
Hall space group symbol	P -4 2n
Residual factor for all reflections	0.0182
Residual factor for significantly intense reflections	0.0175
Weighted residual factors for significantly intense reflections	0.049
Weighted residual factors for all reflections included in the refinement	0.0493
Goodness-of-fit parameter for all reflections included in the refinement	1.08
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
277107 (current)	2022-08-06	cif/ Updating files of 7710486, 7710487, 7710488 Original log message: Adding full bibliography for 7710486--7710488.cif.	7710486.cif
276056	2022-06-16	cif/ Adding structures of 7710486, 7710487, 7710488 via cif-deposit CGI script.	7710486.cif