Crystallography Open Database

Information card for entry 4079935

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Coordinates	4079935.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H30 Mo N2 O3 P2
Calculated formula	C32 H24 Mo N2 O3 P2
Title of publication	Metal-Template-Controlled Stabilization of β-Functionalized Isocyanides
Authors of publication	Dumke, A. Carolin; Pape, Tania; Kösters, Jutta; Feldmann, Kai-Oliver; Schulte to Brinke, Christian; Hahn, F. Ekkehardt
Journal of publication	Organometallics
Year of publication	2013
Journal volume	32
Journal issue	1
Pages of publication	289
a	22.1752 ± 0.001 Å
b	8.6798 ± 0.0004 Å
c	15.6483 ± 0.0007 Å
α	90°
β	104.319 ± 0.001°
γ	90°
Cell volume	2918.4 ± 0.2 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	6
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0239
Residual factor for significantly intense reflections	0.022
Weighted residual factors for significantly intense reflections	0.0523
Weighted residual factors for all reflections included in the refinement	0.053
Goodness-of-fit parameter for all reflections included in the refinement	1.067
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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