Crystallography Open Database

Information card for entry 4026422

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Coordinates	4026422.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H52 N O6 P S
Calculated formula	C30 H52 N O6 P S
Title of publication	Diastereoselective Synthesis of the Leu-Pro Type Phosphinyl Dipeptide Isostere
Authors of publication	Takehiro Yamagishi; Naoko Tashiro; Tsutomu Yokomatsu
Journal of publication	Journal of Organic Chemistry
Year of publication	2011
Journal volume	76
Pages of publication	5472 - 5476
a	10.9707 ± 0.0009 Å
b	11.573 ± 0.001 Å
c	14.9262 ± 0.0012 Å
α	110.424 ± 0.001°
β	98.32 ± 0.001°
γ	109.328 ± 0.001°
Cell volume	1601.7 ± 0.2 Å³
Cell temperature	90 K
Ambient diffraction temperature	90 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0591
Residual factor for significantly intense reflections	0.0403
Weighted residual factors for significantly intense reflections	0.0935
Weighted residual factors for all reflections included in the refinement	0.1011
Goodness-of-fit parameter for all reflections included in the refinement	1.016
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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