Crystallography Open Database

Information card for entry 7700873

Preview

Coordinates	7700873.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C94.71 H147.5 N4 P6
Calculated formula	C94.71 H147.504 N4 P6
Title of publication	Oligomerization of phosphaalkynes mediated by bulky N-heterocyclic carbenes: avenues to novel phosphorus frameworks.
Authors of publication	Liu, Liu Leo; Zhou, Jiliang; Kim, Youngsuk; Cao, Levy L.; Stephan, Douglas W.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	38
Pages of publication	14242 - 14245
a	12.2 ± 0.04 Å
b	13.55 ± 0.05 Å
c	17.59 ± 0.06 Å
α	104.73 ± 0.08°
β	106.61 ± 0.09°
γ	102.84 ± 0.1°
Cell volume	2555 ± 16 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1723
Residual factor for significantly intense reflections	0.0808
Weighted residual factors for significantly intense reflections	0.2001
Weighted residual factors for all reflections included in the refinement	0.2549
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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