Crystallography Open Database

Information card for entry 2004810

2004809 << 2004810 >> 2004811

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Coordinates	2004810.cif
Original IUCr paper	HTML

Structure parameters

Formula	C17 H22 N2 O2
Calculated formula	C17 H22 N2 O2
Title of publication	4-Methylbenzylammonium 4-Methylbenzylcarbamate
Authors of publication	Aakeröy, C. B.; Nieuwenhuyzen, M.
Journal of publication	Acta Crystallographica Section C
Year of publication	1996
Journal volume	52
Journal issue	4
Pages of publication	957 - 960
a	4.829 ± 0.001 Å
b	5.843 ± 0.001 Å
c	13.61 ± 0.002 Å
α	83.39 ± 0.01°
β	86.16 ± 0.01°
γ	82.63 ± 0.02°
Cell volume	377.78 ± 0.12 Å³
Cell temperature	293 K
Number of distinct elements	4
Space group number	1
Hermann-Mauguin space group symbol	P 1
Hall space group symbol	P 1
Residual factor for significantly intense reflections	0.0658
Weighted residual factors for significantly intense reflections	0.1714
Goodness-of-fit parameter for significantly intense reflections	1.039
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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