Crystallography Open Database

Information card for entry 2242214

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Structure parameters

Chemical name	2-Azido-1,3-bis(2,6-diisopropylphenyl)-1,3,2-diazaphospholidine
Formula	C26 H38 N5 P
Calculated formula	C26 H38 N5 P
SMILES	P1(N=N#N)N(CCN1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C
Title of publication	Crystal structure of 2-azido-1,3-bis(2,6-diisopropylphenyl)-1,3,2-diazaphospholidine
Authors of publication	Veinot, Alex J.; Blair, Amber D.; Masuda, Jason D.
Journal of publication	Acta Crystallographica Section E
Year of publication	2017
Journal volume	73
Journal issue	6
Pages of publication	905 - 907
a	10.0148 ± 0.0012 Å
b	17.343 ± 0.002 Å
c	15.627 ± 0.0019 Å
α	90°
β	105.948 ± 0.002°
γ	90°
Cell volume	2609.7 ± 0.5 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.065
Residual factor for significantly intense reflections	0.0462
Weighted residual factors for significantly intense reflections	0.1123
Weighted residual factors for all reflections included in the refinement	0.1232
Goodness-of-fit parameter for all reflections included in the refinement	1.023
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
199179 (current)	2017-07-25	cif/ hkl/ Adding structures of 2242214 via cif-deposit CGI script.	2242214.cif 2242214.hkl