Crystallography Open Database

Information card for entry 1577483

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Coordinates	Coordinates are not available: file is not found.
Original IUCr paper	HTML

Structure parameters

Chemical name	1,3,5-Triaza-7-phosphaadamantan-1-ium nitrate
Formula	C6 H13 N4 O3 P
Calculated formula	C6 H13 N4 O3 P
Title of publication	1,3,5-Triaza-7-phosphaadamantan-1-ium nitrate
Authors of publication	Adeleke, Adesola A.; Zamisa, Sizwe J.; Omondi, Bernard; Olatunji, Olatunde S.
Journal of publication	IUCrData
Year of publication	2026
Journal volume	11
Journal issue	9
a	7.075 ± 0.0003 Å
b	9.895 ± 0.0004 Å
c	13.6434 ± 0.0005 Å
α	102.614 ± 0.002°
β	90.123 ± 0.002°
γ	90.613 ± 0.002°
Cell volume	932.02 ± 0.06 Å³
Cell temperature	100.15 K
Ambient diffraction temperature	100.15 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0353
Residual factor for significantly intense reflections	0.0339
Weighted residual factors for significantly intense reflections	0.0983
Weighted residual factors for all reflections included in the refinement	0.0997
Goodness-of-fit parameter for all reflections included in the refinement	1.119
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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