Crystallography Open Database

Information card for entry 7714101

Preview

Coordinates	7714101.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38.06 H48.11 Cl4.11 Ga2 I6 N4 P2
Calculated formula	C38.0556 H48.1113 Cl4.1113 Ga1.99965 I5.9986 N4 P2
Title of publication	Triphosphiranes as Phosphinidene-Transfer Agents – Synthesis of Regular and Chelating NHC Phosphinidene Adducts
Authors of publication	Siewert, Jan-Erik; Schumann, André; Wellnitz, Tim; Dankert, Fabian; Hering-Junghans, Christian
Journal of publication	Dalton Transactions
Year of publication	2023
a	14.9427 ± 0.0003 Å
b	17.0844 ± 0.0003 Å
c	23.0489 ± 0.0004 Å
α	74.375 ± 0.001°
β	74.203 ± 0.001°
γ	82.817 ± 0.001°
Cell volume	5444.13 ± 0.18 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0452
Residual factor for significantly intense reflections	0.0334
Weighted residual factors for significantly intense reflections	0.0827
Weighted residual factors for all reflections included in the refinement	0.0855
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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